digraph G {
	rankdir=LR
	node [shape=box]
	"1 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CSc4nnc(C)s4)CS[C@H]23)cs1" [color=lightblue shape=box style=filled]
	1 [color=aquamarine shape=rarrow style=filled]
	"1 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CSc4nnc(C)s4)CS[C@H]23)cs1" -> 1 [label=0.000]
	2 [color=lightblue shape=rarrow style=filled]
	"1 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CSc4nnc(C)s4)CS[C@H]23)cs1" -> 2 [label=0.000]
	3 [color=aquamarine shape=rarrow style=filled]
	"1 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CSc4nnc(C)s4)CS[C@H]23)cs1" -> 3 [label=0.000]
	4 [color=aquamarine shape=rarrow style=filled]
	"1 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CSc4nnc(C)s4)CS[C@H]23)cs1" -> 4 [label=0.000]
	5 [color=aquamarine shape=rarrow style=filled]
	"1 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CSc4nnc(C)s4)CS[C@H]23)cs1" -> 5 [label=0.000]
	"2 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CBr)CS[C@H]23)cs1" [color=aquamarine shape=box style=filled]
	1 -> "2 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CBr)CS[C@H]23)cs1" [label=""]
	"3 | Cc1nnc(S)s1" [color=lightyellow shape=box style=filled]
	1 -> "3 | Cc1nnc(S)s1" [label=""]
	"4 | Cc1nnc(SCC2=C(C(=O)O)N3C(=O)C(N)[C@H]3SC2)s1" [color=lightblue shape=box style=filled]
	2 -> "4 | Cc1nnc(SCC2=C(C(=O)O)N3C(=O)C(N)[C@H]3SC2)s1" [label=""]
	"5 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=lightblue shape=box style=filled]
	2 -> "5 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"6 | Cc1nnc(S)s1" [color=lightyellow shape=box style=filled]
	3 -> "6 | Cc1nnc(S)s1" [label=""]
	"7 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C=O)CS[C@H]23)cs1" [color=aquamarine shape=box style=filled]
	3 -> "7 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C=O)CS[C@H]23)cs1" [label=""]
	"8 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" [color=aquamarine shape=box style=filled]
	4 -> "8 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" [label=""]
	"9 | Cc1nnc(SBr)s1" [color=lightblue shape=box style=filled]
	4 -> "9 | Cc1nnc(SBr)s1" [label=""]
	"10 | Cc1nnc(S)s1" [color=lightyellow shape=box style=filled]
	5 -> "10 | Cc1nnc(S)s1" [label=""]
	"11 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CCl)CS[C@H]23)cs1" [color=aquamarine shape=box style=filled]
	5 -> "11 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CCl)CS[C@H]23)cs1" [label=""]
	6 [color=aquamarine shape=rarrow style=filled]
	"2 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CBr)CS[C@H]23)cs1" -> 6 [label=0.000]
	7 [color=aquamarine shape=rarrow style=filled]
	"2 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CBr)CS[C@H]23)cs1" -> 7 [label=0.000]
	8 [color=aquamarine shape=rarrow style=filled]
	"2 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CBr)CS[C@H]23)cs1" -> 8 [label=0.000]
	9 [color=aquamarine shape=rarrow style=filled]
	"2 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CBr)CS[C@H]23)cs1" -> 9 [label=0.000]
	10 [color=aquamarine shape=rarrow style=filled]
	"4 | Cc1nnc(SCC2=C(C(=O)O)N3C(=O)C(N)[C@H]3SC2)s1" -> 10 [label=0.000]
	11 [color=lightblue shape=rarrow style=filled]
	"4 | Cc1nnc(SCC2=C(C(=O)O)N3C(=O)C(N)[C@H]3SC2)s1" -> 11 [label=0.000]
	12 [color=aquamarine shape=rarrow style=filled]
	"4 | Cc1nnc(SCC2=C(C(=O)O)N3C(=O)C(N)[C@H]3SC2)s1" -> 12 [label=0.000]
	13 [color=aquamarine shape=rarrow style=filled]
	"5 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 13 [label=0.000]
	14 [color=lightblue shape=rarrow style=filled]
	"5 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 14 [label=0.000]
	15 [color=aquamarine shape=rarrow style=filled]
	"5 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 15 [label=0.000]
	16 [color=lightblue shape=rarrow style=filled]
	"5 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 16 [label=0.000]
	17 [color=lightblue shape=rarrow style=filled]
	"5 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 17 [label=0.000]
	18 [color=lightblue shape=rarrow style=filled]
	"5 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 18 [label=0.000]
	19 [color=aquamarine shape=rarrow style=filled]
	"5 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 19 [label=0.000]
	20 [color=aquamarine shape=rarrow style=filled]
	"5 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 20 [label=0.000]
	21 [color=lightblue shape=rarrow style=filled]
	"5 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 21 [label=0.000]
	22 [color=aquamarine shape=rarrow style=filled]
	"5 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 22 [label=0.000]
	23 [color=aquamarine shape=rarrow style=filled]
	"7 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C=O)CS[C@H]23)cs1" -> 23 [label=0.000]
	24 [color=aquamarine shape=rarrow style=filled]
	"7 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C=O)CS[C@H]23)cs1" -> 24 [label=0.000]
	25 [color=aquamarine shape=rarrow style=filled]
	"7 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C=O)CS[C@H]23)cs1" -> 25 [label=0.000]
	26 [color=aquamarine shape=rarrow style=filled]
	"7 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C=O)CS[C@H]23)cs1" -> 26 [label=0.000]
	27 [color=aquamarine shape=rarrow style=filled]
	"7 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C=O)CS[C@H]23)cs1" -> 27 [label=0.000]
	28 [color=aquamarine shape=rarrow style=filled]
	"7 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C=O)CS[C@H]23)cs1" -> 28 [label=0.000]
	29 [color=aquamarine shape=rarrow style=filled]
	"7 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C=O)CS[C@H]23)cs1" -> 29 [label=0.000]
	30 [color=aquamarine shape=rarrow style=filled]
	"7 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C=O)CS[C@H]23)cs1" -> 30 [label=0.000]
	31 [color=aquamarine shape=rarrow style=filled]
	"7 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C=O)CS[C@H]23)cs1" -> 31 [label=0.000]
	32 [color=aquamarine shape=rarrow style=filled]
	"7 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C=O)CS[C@H]23)cs1" -> 32 [label=0.000]
	33 [color=aquamarine shape=rarrow style=filled]
	"8 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 33 [label=0.000]
	34 [color=aquamarine shape=rarrow style=filled]
	"8 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 34 [label=0.000]
	35 [color=aquamarine shape=rarrow style=filled]
	"8 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 35 [label=0.000]
	36 [color=aquamarine shape=rarrow style=filled]
	"8 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 36 [label=0.000]
	37 [color=aquamarine shape=rarrow style=filled]
	"8 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 37 [label=0.000]
	38 [color=aquamarine shape=rarrow style=filled]
	"8 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 38 [label=0.000]
	39 [color=aquamarine shape=rarrow style=filled]
	"8 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 39 [label=0.000]
	40 [color=aquamarine shape=rarrow style=filled]
	"8 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 40 [label=0.000]
	41 [color=aquamarine shape=rarrow style=filled]
	"8 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 41 [label=0.000]
	42 [color=lightblue shape=rarrow style=filled]
	"9 | Cc1nnc(SBr)s1" -> 42 [label=0.000]
	43 [color=aquamarine shape=rarrow style=filled]
	"9 | Cc1nnc(SBr)s1" -> 43 [label=0.000]
	44 [color=aquamarine shape=rarrow style=filled]
	"9 | Cc1nnc(SBr)s1" -> 44 [label=0.000]
	45 [color=aquamarine shape=rarrow style=filled]
	"9 | Cc1nnc(SBr)s1" -> 45 [label=0.000]
	46 [color=aquamarine shape=rarrow style=filled]
	"11 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CCl)CS[C@H]23)cs1" -> 46 [label=0.000]
	47 [color=aquamarine shape=rarrow style=filled]
	"11 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CCl)CS[C@H]23)cs1" -> 47 [label=0.000]
	48 [color=aquamarine shape=rarrow style=filled]
	"11 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CCl)CS[C@H]23)cs1" -> 48 [label=0.000]
	49 [color=aquamarine shape=rarrow style=filled]
	"11 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CCl)CS[C@H]23)cs1" -> 49 [label=0.000]
	50 [color=aquamarine shape=rarrow style=filled]
	"11 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CCl)CS[C@H]23)cs1" -> 50 [label=0.000]
	51 [color=aquamarine shape=rarrow style=filled]
	"11 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CCl)CS[C@H]23)cs1" -> 51 [label=0.000]
	52 [color=aquamarine shape=rarrow style=filled]
	"11 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CCl)CS[C@H]23)cs1" -> 52 [label=0.000]
	53 [color=aquamarine shape=rarrow style=filled]
	"11 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CCl)CS[C@H]23)cs1" -> 53 [label=0.000]
	54 [color=aquamarine shape=rarrow style=filled]
	"11 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CCl)CS[C@H]23)cs1" -> 54 [label=0.000]
	55 [color=aquamarine shape=rarrow style=filled]
	"11 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CCl)CS[C@H]23)cs1" -> 55 [label=0.000]
	"12 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=lightblue shape=box style=filled]
	6 -> "12 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"13 | NC1C(=O)N2C(C(=O)O)=C(CBr)CS[C@H]12" [color=aquamarine shape=box style=filled]
	6 -> "13 | NC1C(=O)N2C(C(=O)O)=C(CBr)CS[C@H]12" [label=""]
	"14 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" [color=aquamarine shape=box style=filled]
	7 -> "14 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" [label=""]
	"15 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	7 -> "15 | O=C1CCC(=O)N1Br" [label=""]
	"16 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S([C]=O)=[O+]Br)cs1" [color=aquamarine shape=box style=filled]
	8 -> "16 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S([C]=O)=[O+]Br)cs1" [label=""]
	"17 | O=C(Br)[C]=C(Cl)C(=O)O" [color=lightblue shape=box style=filled]
	8 -> "17 | O=C(Br)[C]=C(Cl)C(=O)O" [label=""]
	"18 | [Br]" [color=lightyellow shape=box style=filled]
	9 -> "18 | [Br]" [label=""]
	"19 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=[O+])C(=O)C(C(=O)Br)=C(Cl)C(=O)O)cs1" [color=aquamarine shape=box style=filled]
	9 -> "19 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=[O+])C(=O)C(C(=O)Br)=C(Cl)C(=O)O)cs1" [label=""]
	"20 | NC1C(=O)N2C(C(=O)O)=C(CBr)CS[C@H]12" [color=aquamarine shape=box style=filled]
	10 -> "20 | NC1C(=O)N2C(C(=O)O)=C(CBr)CS[C@H]12" [label=""]
	"21 | Cc1nnc(S)s1" [color=lightyellow shape=box style=filled]
	10 -> "21 | Cc1nnc(S)s1" [label=""]
	"22 | Cc1nnc(SBr)s1" [color=lightblue shape=box style=filled]
	11 -> "22 | Cc1nnc(SBr)s1" [label=""]
	"23 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [color=lightblue shape=box style=filled]
	11 -> "23 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [label=""]
	"24 | Cc1nnc(SCC(=CC(=O)O)CS[C@H]2[N+]C(=O)C2N)s1" [color=aquamarine shape=box style=filled]
	12 -> "24 | Cc1nnc(SCC(=CC(=O)O)CS[C@H]2[N+]C(=O)C2N)s1" [label=""]
	"25 | OO" [color=lightyellow shape=box style=filled]
	12 -> "25 | OO" [label=""]
	"26 | ClBr" [color=lightblue shape=box style=filled]
	12 -> "26 | ClBr" [label=""]
	"27 | O=C(O)c1cccc(Cl)c1" [color=lightyellow shape=box style=filled]
	12 -> "27 | O=C(O)c1cccc(Cl)c1" [label=""]
	"28 | Nc1nc(C(O)C(=O)O)cs1" [color=lightblue shape=box style=filled]
	13 -> "28 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"29 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=aquamarine shape=box style=filled]
	13 -> "29 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"30 | Nc1nc(C(O)C(=O)O)cs1" [color=lightblue shape=box style=filled]
	14 -> "30 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"31 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	14 -> "31 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"32 | CCC(C)(C)OC(=O)O" [color=lightblue shape=box style=filled]
	14 -> "32 | CCC(C)(C)OC(=O)O" [label=""]
	"33 | CCC(C)(C)OC(=O)Nc1nccs1" [color=aquamarine shape=box style=filled]
	15 -> "33 | CCC(C)(C)OC(=O)Nc1nccs1" [label=""]
	"34 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	15 -> "34 | O=CC(=O)O" [label=""]
	"35 | Nc1nc(C(O)C(=O)O)cs1" [color=lightblue shape=box style=filled]
	16 -> "35 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"36 | CCC(C)(C)OC(=O)O" [color=lightblue shape=box style=filled]
	16 -> "36 | CCC(C)(C)OC(=O)O" [label=""]
	"37 | CCC(C)(C)OC(N)=O" [color=lightblue shape=box style=filled]
	17 -> "37 | CCC(C)(C)OC(N)=O" [label=""]
	"38 | O=C(O)C(O)c1csc(Br)n1" [color=lightyellow shape=box style=filled]
	17 -> "38 | O=C(O)C(O)c1csc(Br)n1" [label=""]
	"39 | Nc1nc(C(O)C(=O)O)cs1" [color=lightblue shape=box style=filled]
	18 -> "39 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"40 | CCC(C)(C)OCO" [color=lightblue shape=box style=filled]
	18 -> "40 | CCC(C)(C)OCO" [label=""]
	"41 | CCC(C)(C)OC(=O)Nc1nc(CO)cs1" [color=aquamarine shape=box style=filled]
	19 -> "41 | CCC(C)(C)OC(=O)Nc1nc(CO)cs1" [label=""]
	"42 | O=C=O" [color=lightyellow shape=box style=filled]
	19 -> "42 | O=C=O" [label=""]
	"43 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	20 -> "43 | O=C(O)CO" [label=""]
	"44 | CCC(C)(C)OC(=O)Nc1nc(Br)cs1" [color=aquamarine shape=box style=filled]
	20 -> "44 | CCC(C)(C)OC(=O)Nc1nc(Br)cs1" [label=""]
	"45 | CC(C)(C)OC(=O)O" [color=lightblue shape=box style=filled]
	21 -> "45 | CC(C)(C)OC(=O)O" [label=""]
	"46 | Nc1nc(C(O)C(=O)O)cs1" [color=lightblue shape=box style=filled]
	21 -> "46 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"47 | CCC(C)(C)OC(=O)O" [color=lightblue shape=box style=filled]
	21 -> "47 | CCC(C)(C)OC(=O)O" [label=""]
	"48 | O=C(O)C(=O)O" [color=lightyellow shape=box style=filled]
	22 -> "48 | O=C(O)C(=O)O" [label=""]
	"49 | CCC(C)(C)OC(=O)Nc1nccs1" [color=aquamarine shape=box style=filled]
	22 -> "49 | CCC(C)(C)OC(=O)Nc1nccs1" [label=""]
	"50 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=aquamarine shape=box style=filled]
	23 -> "50 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"51 | NC1C(=O)N2C(C(=O)O)=C(C=O)CS[C@H]12" [color=aquamarine shape=box style=filled]
	23 -> "51 | NC1C(=O)N2C(C(=O)O)=C(C=O)CS[C@H]12" [label=""]
	"52 | CN(C)C=O" [color=lightyellow shape=box style=filled]
	24 -> "52 | CN(C)C=O" [label=""]
	"53 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" [color=aquamarine shape=box style=filled]
	24 -> "53 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" [label=""]
	"54 | O=CO" [color=lightyellow shape=box style=filled]
	25 -> "54 | O=CO" [label=""]
	"55 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" [color=aquamarine shape=box style=filled]
	25 -> "55 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" [label=""]
	"56 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C=O)CS[C@H]23)cs1" [color=aquamarine shape=box style=filled]
	26 -> "56 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C=O)CS[C@H]23)cs1" [label=""]
	"57 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=aquamarine shape=box style=filled]
	26 -> "57 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"58 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(=O)C=O)cs1" [color=aquamarine shape=box style=filled]
	27 -> "58 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(=O)C=O)cs1" [label=""]
	"59 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(Br)C=O)cs1" [color=aquamarine shape=box style=filled]
	28 -> "59 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(Br)C=O)cs1" [label=""]
	"60 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(C(Cl)C(=O)O)[C@@H]2SCCC=O)cs1" [color=aquamarine shape=box style=filled]
	29 -> "60 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(C(Cl)C(=O)O)[C@@H]2SCCC=O)cs1" [label=""]
	"61 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(O)C=O)cs1" [color=aquamarine shape=box style=filled]
	30 -> "61 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(O)C=O)cs1" [label=""]
	"62 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(Cl)C=O)cs1" [color=aquamarine shape=box style=filled]
	31 -> "62 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(Cl)C=O)cs1" [label=""]
	"63 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C=O)CS[C@H]23)cs1" [color=aquamarine shape=box style=filled]
	32 -> "63 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C=O)CS[C@H]23)cs1" [label=""]
	"64 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	32 -> "64 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"65 | CCC(C)(C)OC(=O)O" [color=lightblue shape=box style=filled]
	32 -> "65 | CCC(C)(C)OC(=O)O" [label=""]
	"66 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=aquamarine shape=box style=filled]
	33 -> "66 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"67 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [color=aquamarine shape=box style=filled]
	33 -> "67 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [label=""]
	"68 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=aquamarine shape=box style=filled]
	34 -> "68 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"69 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=aquamarine shape=box style=filled]
	34 -> "69 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"70 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" [color=aquamarine shape=box style=filled]
	35 -> "70 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" [label=""]
	"71 | O=C=O" [color=lightyellow shape=box style=filled]
	35 -> "71 | O=C=O" [label=""]
	"72 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	36 -> "72 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"73 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=aquamarine shape=box style=filled]
	36 -> "73 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"74 | CCC(C)(C)OC(=O)O" [color=lightblue shape=box style=filled]
	36 -> "74 | CCC(C)(C)OC(=O)O" [label=""]
	"75 | Nc1nc(C(O)C(=O)O)cs1" [color=lightblue shape=box style=filled]
	37 -> "75 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"76 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [color=aquamarine shape=box style=filled]
	37 -> "76 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [label=""]
	"77 | CCC(C)(C)OC=O" [color=lightblue shape=box style=filled]
	37 -> "77 | CCC(C)(C)OC=O" [label=""]
	"78 | O=C=O" [color=lightyellow shape=box style=filled]
	38 -> "78 | O=C=O" [label=""]
	"79 | CC(=O)C(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" [color=aquamarine shape=box style=filled]
	38 -> "79 | CC(=O)C(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" [label=""]
	"80 | CCC(C)(C)OC(=O)O" [color=lightblue shape=box style=filled]
	39 -> "80 | CCC(C)(C)OC(=O)O" [label=""]
	"81 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=aquamarine shape=box style=filled]
	39 -> "81 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"82 | CCC(C)(C)OCO" [color=lightblue shape=box style=filled]
	40 -> "82 | CCC(C)(C)OCO" [label=""]
	"83 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=aquamarine shape=box style=filled]
	40 -> "83 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"84 | CC(C)(C)OC(=O)O" [color=lightblue shape=box style=filled]
	41 -> "84 | CC(C)(C)OC(=O)O" [label=""]
	"85 | CCC(C)(C)OC(=O)O" [color=lightblue shape=box style=filled]
	41 -> "85 | CCC(C)(C)OC(=O)O" [label=""]
	"86 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=aquamarine shape=box style=filled]
	41 -> "86 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"87 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	42 -> "87 | O=C1CCC(=O)N1Br" [label=""]
	"88 | Cc1nnc(S)s1" [color=lightyellow shape=box style=filled]
	42 -> "88 | Cc1nnc(S)s1" [label=""]
	"89 | BrSBr" [color=aquamarine shape=box style=filled]
	43 -> "89 | BrSBr" [label=""]
	"90 | Cc1nncs1" [color=lightblue shape=box style=filled]
	43 -> "90 | Cc1nncs1" [label=""]
	"91 | Cc1nnc(Br)s1" [color=lightyellow shape=box style=filled]
	44 -> "91 | Cc1nnc(Br)s1" [label=""]
	"92 | SBr" [color=aquamarine shape=box style=filled]
	44 -> "92 | SBr" [label=""]
	"93 | NN=C=[S]Br" [color=aquamarine shape=box style=filled]
	45 -> "93 | NN=C=[S]Br" [label=""]
	"94 | CC[SH](=O)=O" [color=lightblue shape=box style=filled]
	45 -> "94 | CC[SH](=O)=O" [label=""]
	"95 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	45 -> "95 | O=C1CCC(=O)N1Br" [label=""]
	"96 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=aquamarine shape=box style=filled]
	46 -> "96 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"97 | NC1C(=O)N2C(C(=O)O)=C(CCl)CS[C@H]12" [color=aquamarine shape=box style=filled]
	46 -> "97 | NC1C(=O)N2C(C(=O)O)=C(CCl)CS[C@H]12" [label=""]
	"98 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" [color=aquamarine shape=box style=filled]
	47 -> "98 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" [label=""]
	"99 | ClC(Cl)(Cl)Cl" [color=lightyellow shape=box style=filled]
	47 -> "99 | ClC(Cl)(Cl)Cl" [label=""]
	"100 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" [color=aquamarine shape=box style=filled]
	48 -> "100 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" [label=""]
	"101 | O=C1CCC(=O)N1Cl" [color=lightyellow shape=box style=filled]
	48 -> "101 | O=C1CCC(=O)N1Cl" [label=""]
	"102 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=aquamarine shape=box style=filled]
	49 -> "102 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"103 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CCl)CS[C@H]23)cs1" [color=aquamarine shape=box style=filled]
	49 -> "103 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CCl)CS[C@H]23)cs1" [label=""]
	"104 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CBr)CS[C@H]23)cs1" [color=aquamarine shape=box style=filled]
	50 -> "104 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CBr)CS[C@H]23)cs1" [label=""]
	"105 | Cl" [color=lightyellow shape=box style=filled]
	50 -> "105 | Cl" [label=""]
	"106 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	51 -> "106 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"107 | CCC(C)(C)OC(=O)O" [color=lightblue shape=box style=filled]
	51 -> "107 | CCC(C)(C)OC(=O)O" [label=""]
	"108 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CCl)CS[C@H]23)cs1" [color=aquamarine shape=box style=filled]
	51 -> "108 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CCl)CS[C@H]23)cs1" [label=""]
	"109 | ClCl" [color=lightyellow shape=box style=filled]
	52 -> "109 | ClCl" [label=""]
	"110 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" [color=aquamarine shape=box style=filled]
	52 -> "110 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" [label=""]
	"111 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" [color=aquamarine shape=box style=filled]
	53 -> "111 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" [label=""]
	"112 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	53 -> "112 | O=C1CCC(=O)N1Br" [label=""]
	"113 | Cl" [color=lightyellow shape=box style=filled]
	53 -> "113 | Cl" [label=""]
	"114 | Nc1nc(C(O)C(=O)O)cs1" [color=lightblue shape=box style=filled]
	54 -> "114 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"115 | NC1C(=O)N2C(C(=O)O)=C(CCl)CS[C@H]12" [color=aquamarine shape=box style=filled]
	54 -> "115 | NC1C(=O)N2C(C(=O)O)=C(CCl)CS[C@H]12" [label=""]
	"116 | CCC(C)(C)OC=O" [color=lightblue shape=box style=filled]
	54 -> "116 | CCC(C)(C)OC=O" [label=""]
	"117 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CCl)CS[C@H]23)cs1" [color=aquamarine shape=box style=filled]
	55 -> "117 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CCl)CS[C@H]23)cs1" [label=""]
	"118 | CCC(C)(C)OC(=O)O" [color=lightblue shape=box style=filled]
	55 -> "118 | CCC(C)(C)OC(=O)O" [label=""]
	56 [color=aquamarine shape=rarrow style=filled]
	"12 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 56 [label=0.000]
	57 [color=lightblue shape=rarrow style=filled]
	"12 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 57 [label=0.000]
	58 [color=aquamarine shape=rarrow style=filled]
	"12 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 58 [label=0.000]
	59 [color=lightblue shape=rarrow style=filled]
	"12 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 59 [label=0.000]
	60 [color=lightblue shape=rarrow style=filled]
	"12 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 60 [label=0.000]
	61 [color=lightblue shape=rarrow style=filled]
	"12 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 61 [label=0.000]
	62 [color=aquamarine shape=rarrow style=filled]
	"12 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 62 [label=0.000]
	63 [color=aquamarine shape=rarrow style=filled]
	"12 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 63 [label=0.000]
	64 [color=lightblue shape=rarrow style=filled]
	"12 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 64 [label=0.000]
	65 [color=aquamarine shape=rarrow style=filled]
	"12 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 65 [label=0.000]
	66 [color=aquamarine shape=rarrow style=filled]
	"13 | NC1C(=O)N2C(C(=O)O)=C(CBr)CS[C@H]12" -> 66 [label=0.000]
	67 [color=aquamarine shape=rarrow style=filled]
	"13 | NC1C(=O)N2C(C(=O)O)=C(CBr)CS[C@H]12" -> 67 [label=0.000]
	68 [color=aquamarine shape=rarrow style=filled]
	"13 | NC1C(=O)N2C(C(=O)O)=C(CBr)CS[C@H]12" -> 68 [label=0.000]
	69 [color=aquamarine shape=rarrow style=filled]
	"13 | NC1C(=O)N2C(C(=O)O)=C(CBr)CS[C@H]12" -> 69 [label=0.000]
	70 [color=aquamarine shape=rarrow style=filled]
	"13 | NC1C(=O)N2C(C(=O)O)=C(CBr)CS[C@H]12" -> 70 [label=0.000]
	71 [color=aquamarine shape=rarrow style=filled]
	"13 | NC1C(=O)N2C(C(=O)O)=C(CBr)CS[C@H]12" -> 71 [label=0.000]
	72 [color=aquamarine shape=rarrow style=filled]
	"13 | NC1C(=O)N2C(C(=O)O)=C(CBr)CS[C@H]12" -> 72 [label=0.000]
	73 [color=aquamarine shape=rarrow style=filled]
	"13 | NC1C(=O)N2C(C(=O)O)=C(CBr)CS[C@H]12" -> 73 [label=0.000]
	74 [color=aquamarine shape=rarrow style=filled]
	"13 | NC1C(=O)N2C(C(=O)O)=C(CBr)CS[C@H]12" -> 74 [label=0.000]
	75 [color=aquamarine shape=rarrow style=filled]
	"14 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 75 [label=0.000]
	76 [color=aquamarine shape=rarrow style=filled]
	"14 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 76 [label=0.000]
	77 [color=aquamarine shape=rarrow style=filled]
	"14 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 77 [label=0.000]
	78 [color=aquamarine shape=rarrow style=filled]
	"14 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 78 [label=0.000]
	79 [color=aquamarine shape=rarrow style=filled]
	"14 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 79 [label=0.000]
	80 [color=aquamarine shape=rarrow style=filled]
	"14 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 80 [label=0.000]
	81 [color=aquamarine shape=rarrow style=filled]
	"14 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 81 [label=0.000]
	82 [color=aquamarine shape=rarrow style=filled]
	"14 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 82 [label=0.000]
	83 [color=aquamarine shape=rarrow style=filled]
	"14 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 83 [label=0.000]
	84 [color=aquamarine shape=rarrow style=filled]
	"16 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S([C]=O)=[O+]Br)cs1" -> 84 [label=0.000]
	85 [color=aquamarine shape=rarrow style=filled]
	"16 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S([C]=O)=[O+]Br)cs1" -> 85 [label=0.000]
	86 [color=aquamarine shape=rarrow style=filled]
	"16 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S([C]=O)=[O+]Br)cs1" -> 86 [label=0.000]
	87 [color=aquamarine shape=rarrow style=filled]
	"16 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S([C]=O)=[O+]Br)cs1" -> 87 [label=0.000]
	88 [color=aquamarine shape=rarrow style=filled]
	"16 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S([C]=O)=[O+]Br)cs1" -> 88 [label=0.000]
	89 [color=aquamarine shape=rarrow style=filled]
	"16 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S([C]=O)=[O+]Br)cs1" -> 89 [label=0.000]
	90 [color=aquamarine shape=rarrow style=filled]
	"16 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S([C]=O)=[O+]Br)cs1" -> 90 [label=0.000]
	91 [color=aquamarine shape=rarrow style=filled]
	"16 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S([C]=O)=[O+]Br)cs1" -> 91 [label=0.000]
	92 [color=aquamarine shape=rarrow style=filled]
	"16 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S([C]=O)=[O+]Br)cs1" -> 92 [label=0.000]
	93 [color=aquamarine shape=rarrow style=filled]
	"16 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S([C]=O)=[O+]Br)cs1" -> 93 [label=0.000]
	94 [color=lightblue shape=rarrow style=filled]
	"17 | O=C(Br)[C]=C(Cl)C(=O)O" -> 94 [label=0.000]
	95 [color=lightblue shape=rarrow style=filled]
	"17 | O=C(Br)[C]=C(Cl)C(=O)O" -> 95 [label=0.000]
	96 [color=lightblue shape=rarrow style=filled]
	"17 | O=C(Br)[C]=C(Cl)C(=O)O" -> 96 [label=0.000]
	97 [color=lightblue shape=rarrow style=filled]
	"17 | O=C(Br)[C]=C(Cl)C(=O)O" -> 97 [label=0.000]
	98 [color=lightblue shape=rarrow style=filled]
	"17 | O=C(Br)[C]=C(Cl)C(=O)O" -> 98 [label=0.000]
	99 [color=lightblue shape=rarrow style=filled]
	"17 | O=C(Br)[C]=C(Cl)C(=O)O" -> 99 [label=0.000]
	100 [color=lightblue shape=rarrow style=filled]
	"17 | O=C(Br)[C]=C(Cl)C(=O)O" -> 100 [label=0.000]
	101 [color=aquamarine shape=rarrow style=filled]
	"17 | O=C(Br)[C]=C(Cl)C(=O)O" -> 101 [label=0.000]
	102 [color=aquamarine shape=rarrow style=filled]
	"19 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=[O+])C(=O)C(C(=O)Br)=C(Cl)C(=O)O)cs1" -> 102 [label=0.000]
	103 [color=aquamarine shape=rarrow style=filled]
	"19 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=[O+])C(=O)C(C(=O)Br)=C(Cl)C(=O)O)cs1" -> 103 [label=0.000]
	104 [color=aquamarine shape=rarrow style=filled]
	"19 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=[O+])C(=O)C(C(=O)Br)=C(Cl)C(=O)O)cs1" -> 104 [label=0.000]
	105 [color=aquamarine shape=rarrow style=filled]
	"19 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=[O+])C(=O)C(C(=O)Br)=C(Cl)C(=O)O)cs1" -> 105 [label=0.000]
	106 [color=aquamarine shape=rarrow style=filled]
	"19 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=[O+])C(=O)C(C(=O)Br)=C(Cl)C(=O)O)cs1" -> 106 [label=0.000]
	107 [color=aquamarine shape=rarrow style=filled]
	"19 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=[O+])C(=O)C(C(=O)Br)=C(Cl)C(=O)O)cs1" -> 107 [label=0.000]
	108 [color=aquamarine shape=rarrow style=filled]
	"19 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=[O+])C(=O)C(C(=O)Br)=C(Cl)C(=O)O)cs1" -> 108 [label=0.000]
	109 [color=aquamarine shape=rarrow style=filled]
	"19 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=[O+])C(=O)C(C(=O)Br)=C(Cl)C(=O)O)cs1" -> 109 [label=0.000]
	110 [color=aquamarine shape=rarrow style=filled]
	"19 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=[O+])C(=O)C(C(=O)Br)=C(Cl)C(=O)O)cs1" -> 110 [label=0.000]
	111 [color=aquamarine shape=rarrow style=filled]
	"19 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=[O+])C(=O)C(C(=O)Br)=C(Cl)C(=O)O)cs1" -> 111 [label=0.000]
	112 [color=aquamarine shape=rarrow style=filled]
	"20 | NC1C(=O)N2C(C(=O)O)=C(CBr)CS[C@H]12" -> 112 [label=0.000]
	113 [color=aquamarine shape=rarrow style=filled]
	"20 | NC1C(=O)N2C(C(=O)O)=C(CBr)CS[C@H]12" -> 113 [label=0.000]
	114 [color=aquamarine shape=rarrow style=filled]
	"20 | NC1C(=O)N2C(C(=O)O)=C(CBr)CS[C@H]12" -> 114 [label=0.000]
	115 [color=aquamarine shape=rarrow style=filled]
	"20 | NC1C(=O)N2C(C(=O)O)=C(CBr)CS[C@H]12" -> 115 [label=0.000]
	116 [color=aquamarine shape=rarrow style=filled]
	"20 | NC1C(=O)N2C(C(=O)O)=C(CBr)CS[C@H]12" -> 116 [label=0.000]
	117 [color=aquamarine shape=rarrow style=filled]
	"20 | NC1C(=O)N2C(C(=O)O)=C(CBr)CS[C@H]12" -> 117 [label=0.000]
	118 [color=aquamarine shape=rarrow style=filled]
	"20 | NC1C(=O)N2C(C(=O)O)=C(CBr)CS[C@H]12" -> 118 [label=0.000]
	119 [color=aquamarine shape=rarrow style=filled]
	"20 | NC1C(=O)N2C(C(=O)O)=C(CBr)CS[C@H]12" -> 119 [label=0.000]
	120 [color=aquamarine shape=rarrow style=filled]
	"20 | NC1C(=O)N2C(C(=O)O)=C(CBr)CS[C@H]12" -> 120 [label=0.000]
	121 [color=lightblue shape=rarrow style=filled]
	"22 | Cc1nnc(SBr)s1" -> 121 [label=0.000]
	122 [color=aquamarine shape=rarrow style=filled]
	"22 | Cc1nnc(SBr)s1" -> 122 [label=0.000]
	123 [color=aquamarine shape=rarrow style=filled]
	"22 | Cc1nnc(SBr)s1" -> 123 [label=0.000]
	124 [color=aquamarine shape=rarrow style=filled]
	"22 | Cc1nnc(SBr)s1" -> 124 [label=0.000]
	125 [color=aquamarine shape=rarrow style=filled]
	"23 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 125 [label=0.000]
	126 [color=lightblue shape=rarrow style=filled]
	"23 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 126 [label=0.000]
	127 [color=aquamarine shape=rarrow style=filled]
	"23 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 127 [label=0.000]
	128 [color=aquamarine shape=rarrow style=filled]
	"23 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 128 [label=0.000]
	129 [color=aquamarine shape=rarrow style=filled]
	"23 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 129 [label=0.000]
	130 [color=aquamarine shape=rarrow style=filled]
	"23 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 130 [label=0.000]
	131 [color=aquamarine shape=rarrow style=filled]
	"23 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 131 [label=0.000]
	132 [color=aquamarine shape=rarrow style=filled]
	"23 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 132 [label=0.000]
	133 [color=aquamarine shape=rarrow style=filled]
	"23 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 133 [label=0.000]
	134 [color=aquamarine shape=rarrow style=filled]
	"23 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 134 [label=0.000]
	135 [color=aquamarine shape=rarrow style=filled]
	"24 | Cc1nnc(SCC(=CC(=O)O)CS[C@H]2[N+]C(=O)C2N)s1" -> 135 [label=0.000]
	136 [color=aquamarine shape=rarrow style=filled]
	"24 | Cc1nnc(SCC(=CC(=O)O)CS[C@H]2[N+]C(=O)C2N)s1" -> 136 [label=0.000]
	137 [color=aquamarine shape=rarrow style=filled]
	"24 | Cc1nnc(SCC(=CC(=O)O)CS[C@H]2[N+]C(=O)C2N)s1" -> 137 [label=0.000]
	138 [color=aquamarine shape=rarrow style=filled]
	"24 | Cc1nnc(SCC(=CC(=O)O)CS[C@H]2[N+]C(=O)C2N)s1" -> 138 [label=0.000]
	139 [color=aquamarine shape=rarrow style=filled]
	"24 | Cc1nnc(SCC(=CC(=O)O)CS[C@H]2[N+]C(=O)C2N)s1" -> 139 [label=0.000]
	140 [color=aquamarine shape=rarrow style=filled]
	"24 | Cc1nnc(SCC(=CC(=O)O)CS[C@H]2[N+]C(=O)C2N)s1" -> 140 [label=0.000]
	141 [color=aquamarine shape=rarrow style=filled]
	"24 | Cc1nnc(SCC(=CC(=O)O)CS[C@H]2[N+]C(=O)C2N)s1" -> 141 [label=0.000]
	142 [color=aquamarine shape=rarrow style=filled]
	"24 | Cc1nnc(SCC(=CC(=O)O)CS[C@H]2[N+]C(=O)C2N)s1" -> 142 [label=0.000]
	143 [color=aquamarine shape=rarrow style=filled]
	"24 | Cc1nnc(SCC(=CC(=O)O)CS[C@H]2[N+]C(=O)C2N)s1" -> 143 [label=0.000]
	144 [color=aquamarine shape=rarrow style=filled]
	"24 | Cc1nnc(SCC(=CC(=O)O)CS[C@H]2[N+]C(=O)C2N)s1" -> 144 [label=0.000]
	145 [color=lightblue shape=rarrow style=filled]
	"26 | ClBr" -> 145 [label=0.000]
	146 [color=lightblue shape=rarrow style=filled]
	"26 | ClBr" -> 146 [label=0.000]
	147 [color=lightblue shape=rarrow style=filled]
	"26 | ClBr" -> 147 [label=0.000]
	148 [color=lightblue shape=rarrow style=filled]
	"26 | ClBr" -> 148 [label=0.000]
	149 [color=lightblue shape=rarrow style=filled]
	"26 | ClBr" -> 149 [label=0.000]
	150 [color=aquamarine shape=rarrow style=filled]
	"26 | ClBr" -> 150 [label=0.000]
	151 [color=aquamarine shape=rarrow style=filled]
	"26 | ClBr" -> 151 [label=0.000]
	152 [color=lightblue shape=rarrow style=filled]
	"26 | ClBr" -> 152 [label=0.000]
	153 [color=lightblue shape=rarrow style=filled]
	"28 | Nc1nc(C(O)C(=O)O)cs1" -> 153 [label=0.000]
	154 [color=lightblue shape=rarrow style=filled]
	"28 | Nc1nc(C(O)C(=O)O)cs1" -> 154 [label=0.000]
	155 [color=lightblue shape=rarrow style=filled]
	"28 | Nc1nc(C(O)C(=O)O)cs1" -> 155 [label=0.000]
	156 [color=aquamarine shape=rarrow style=filled]
	"28 | Nc1nc(C(O)C(=O)O)cs1" -> 156 [label=0.000]
	157 [color=lightblue shape=rarrow style=filled]
	"28 | Nc1nc(C(O)C(=O)O)cs1" -> 157 [label=0.000]
	158 [color=lightblue shape=rarrow style=filled]
	"28 | Nc1nc(C(O)C(=O)O)cs1" -> 158 [label=0.000]
	159 [color=lightblue shape=rarrow style=filled]
	"28 | Nc1nc(C(O)C(=O)O)cs1" -> 159 [label=0.000]
	160 [color=lightblue shape=rarrow style=filled]
	"28 | Nc1nc(C(O)C(=O)O)cs1" -> 160 [label=0.000]
	161 [color=aquamarine shape=rarrow style=filled]
	"28 | Nc1nc(C(O)C(=O)O)cs1" -> 161 [label=0.000]
	162 [color=lightblue shape=rarrow style=filled]
	"28 | Nc1nc(C(O)C(=O)O)cs1" -> 162 [label=0.000]
	163 [color=aquamarine shape=rarrow style=filled]
	"29 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 163 [label=0.000]
	164 [color=aquamarine shape=rarrow style=filled]
	"29 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 164 [label=0.000]
	165 [color=aquamarine shape=rarrow style=filled]
	"29 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 165 [label=0.000]
	166 [color=aquamarine shape=rarrow style=filled]
	"29 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 166 [label=0.000]
	167 [color=aquamarine shape=rarrow style=filled]
	"29 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 167 [label=0.000]
	168 [color=aquamarine shape=rarrow style=filled]
	"29 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 168 [label=0.000]
	169 [color=aquamarine shape=rarrow style=filled]
	"29 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 169 [label=0.000]
	170 [color=aquamarine shape=rarrow style=filled]
	"29 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 170 [label=0.000]
	171 [color=aquamarine shape=rarrow style=filled]
	"29 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 171 [label=0.000]
	172 [color=lightblue shape=rarrow style=filled]
	"30 | Nc1nc(C(O)C(=O)O)cs1" -> 172 [label=0.000]
	173 [color=lightblue shape=rarrow style=filled]
	"30 | Nc1nc(C(O)C(=O)O)cs1" -> 173 [label=0.000]
	174 [color=lightblue shape=rarrow style=filled]
	"30 | Nc1nc(C(O)C(=O)O)cs1" -> 174 [label=0.000]
	175 [color=aquamarine shape=rarrow style=filled]
	"30 | Nc1nc(C(O)C(=O)O)cs1" -> 175 [label=0.000]
	176 [color=lightblue shape=rarrow style=filled]
	"30 | Nc1nc(C(O)C(=O)O)cs1" -> 176 [label=0.000]
	177 [color=lightblue shape=rarrow style=filled]
	"30 | Nc1nc(C(O)C(=O)O)cs1" -> 177 [label=0.000]
	178 [color=lightblue shape=rarrow style=filled]
	"30 | Nc1nc(C(O)C(=O)O)cs1" -> 178 [label=0.000]
	179 [color=lightblue shape=rarrow style=filled]
	"30 | Nc1nc(C(O)C(=O)O)cs1" -> 179 [label=0.000]
	180 [color=aquamarine shape=rarrow style=filled]
	"30 | Nc1nc(C(O)C(=O)O)cs1" -> 180 [label=0.000]
	181 [color=lightblue shape=rarrow style=filled]
	"30 | Nc1nc(C(O)C(=O)O)cs1" -> 181 [label=0.000]
	182 [color=lightblue shape=rarrow style=filled]
	"32 | CCC(C)(C)OC(=O)O" -> 182 [label=0.000]
	183 [color=lightblue shape=rarrow style=filled]
	"32 | CCC(C)(C)OC(=O)O" -> 183 [label=0.000]
	184 [color=lightblue shape=rarrow style=filled]
	"32 | CCC(C)(C)OC(=O)O" -> 184 [label=0.000]
	185 [color=aquamarine shape=rarrow style=filled]
	"32 | CCC(C)(C)OC(=O)O" -> 185 [label=0.000]
	186 [color=lightblue shape=rarrow style=filled]
	"32 | CCC(C)(C)OC(=O)O" -> 186 [label=0.000]
	187 [color=aquamarine shape=rarrow style=filled]
	"32 | CCC(C)(C)OC(=O)O" -> 187 [label=0.000]
	188 [color=aquamarine shape=rarrow style=filled]
	"32 | CCC(C)(C)OC(=O)O" -> 188 [label=0.000]
	189 [color=aquamarine shape=rarrow style=filled]
	"32 | CCC(C)(C)OC(=O)O" -> 189 [label=0.000]
	190 [color=aquamarine shape=rarrow style=filled]
	"33 | CCC(C)(C)OC(=O)Nc1nccs1" -> 190 [label=0.000]
	191 [color=aquamarine shape=rarrow style=filled]
	"33 | CCC(C)(C)OC(=O)Nc1nccs1" -> 191 [label=0.000]
	192 [color=aquamarine shape=rarrow style=filled]
	"33 | CCC(C)(C)OC(=O)Nc1nccs1" -> 192 [label=0.000]
	193 [color=aquamarine shape=rarrow style=filled]
	"33 | CCC(C)(C)OC(=O)Nc1nccs1" -> 193 [label=0.000]
	194 [color=aquamarine shape=rarrow style=filled]
	"33 | CCC(C)(C)OC(=O)Nc1nccs1" -> 194 [label=0.000]
	195 [color=aquamarine shape=rarrow style=filled]
	"33 | CCC(C)(C)OC(=O)Nc1nccs1" -> 195 [label=0.000]
	196 [color=aquamarine shape=rarrow style=filled]
	"33 | CCC(C)(C)OC(=O)Nc1nccs1" -> 196 [label=0.000]
	197 [color=aquamarine shape=rarrow style=filled]
	"33 | CCC(C)(C)OC(=O)Nc1nccs1" -> 197 [label=0.000]
	198 [color=aquamarine shape=rarrow style=filled]
	"33 | CCC(C)(C)OC(=O)Nc1nccs1" -> 198 [label=0.000]
	199 [color=aquamarine shape=rarrow style=filled]
	"33 | CCC(C)(C)OC(=O)Nc1nccs1" -> 199 [label=0.000]
	200 [color=lightblue shape=rarrow style=filled]
	"35 | Nc1nc(C(O)C(=O)O)cs1" -> 200 [label=0.000]
	201 [color=lightblue shape=rarrow style=filled]
	"35 | Nc1nc(C(O)C(=O)O)cs1" -> 201 [label=0.000]
	202 [color=lightblue shape=rarrow style=filled]
	"35 | Nc1nc(C(O)C(=O)O)cs1" -> 202 [label=0.000]
	203 [color=aquamarine shape=rarrow style=filled]
	"35 | Nc1nc(C(O)C(=O)O)cs1" -> 203 [label=0.000]
	204 [color=lightblue shape=rarrow style=filled]
	"35 | Nc1nc(C(O)C(=O)O)cs1" -> 204 [label=0.000]
	205 [color=lightblue shape=rarrow style=filled]
	"35 | Nc1nc(C(O)C(=O)O)cs1" -> 205 [label=0.000]
	206 [color=lightblue shape=rarrow style=filled]
	"35 | Nc1nc(C(O)C(=O)O)cs1" -> 206 [label=0.000]
	207 [color=lightblue shape=rarrow style=filled]
	"35 | Nc1nc(C(O)C(=O)O)cs1" -> 207 [label=0.000]
	208 [color=aquamarine shape=rarrow style=filled]
	"35 | Nc1nc(C(O)C(=O)O)cs1" -> 208 [label=0.000]
	209 [color=lightblue shape=rarrow style=filled]
	"35 | Nc1nc(C(O)C(=O)O)cs1" -> 209 [label=0.000]
	210 [color=lightblue shape=rarrow style=filled]
	"36 | CCC(C)(C)OC(=O)O" -> 210 [label=0.000]
	211 [color=lightblue shape=rarrow style=filled]
	"36 | CCC(C)(C)OC(=O)O" -> 211 [label=0.000]
	212 [color=lightblue shape=rarrow style=filled]
	"36 | CCC(C)(C)OC(=O)O" -> 212 [label=0.000]
	213 [color=aquamarine shape=rarrow style=filled]
	"36 | CCC(C)(C)OC(=O)O" -> 213 [label=0.000]
	214 [color=lightblue shape=rarrow style=filled]
	"36 | CCC(C)(C)OC(=O)O" -> 214 [label=0.000]
	215 [color=aquamarine shape=rarrow style=filled]
	"36 | CCC(C)(C)OC(=O)O" -> 215 [label=0.000]
	216 [color=aquamarine shape=rarrow style=filled]
	"36 | CCC(C)(C)OC(=O)O" -> 216 [label=0.000]
	217 [color=aquamarine shape=rarrow style=filled]
	"36 | CCC(C)(C)OC(=O)O" -> 217 [label=0.000]
	218 [color=aquamarine shape=rarrow style=filled]
	"37 | CCC(C)(C)OC(N)=O" -> 218 [label=0.000]
	219 [color=lightblue shape=rarrow style=filled]
	"37 | CCC(C)(C)OC(N)=O" -> 219 [label=0.000]
	220 [color=lightblue shape=rarrow style=filled]
	"37 | CCC(C)(C)OC(N)=O" -> 220 [label=0.000]
	221 [color=lightblue shape=rarrow style=filled]
	"37 | CCC(C)(C)OC(N)=O" -> 221 [label=0.000]
	222 [color=lightblue shape=rarrow style=filled]
	"37 | CCC(C)(C)OC(N)=O" -> 222 [label=0.000]
	223 [color=lightblue shape=rarrow style=filled]
	"37 | CCC(C)(C)OC(N)=O" -> 223 [label=0.000]
	224 [color=lightblue shape=rarrow style=filled]
	"37 | CCC(C)(C)OC(N)=O" -> 224 [label=0.000]
	225 [color=aquamarine shape=rarrow style=filled]
	"37 | CCC(C)(C)OC(N)=O" -> 225 [label=0.000]
	226 [color=lightblue shape=rarrow style=filled]
	"37 | CCC(C)(C)OC(N)=O" -> 226 [label=0.000]
	227 [color=lightblue shape=rarrow style=filled]
	"39 | Nc1nc(C(O)C(=O)O)cs1" -> 227 [label=0.000]
	228 [color=lightblue shape=rarrow style=filled]
	"39 | Nc1nc(C(O)C(=O)O)cs1" -> 228 [label=0.000]
	229 [color=lightblue shape=rarrow style=filled]
	"39 | Nc1nc(C(O)C(=O)O)cs1" -> 229 [label=0.000]
	230 [color=aquamarine shape=rarrow style=filled]
	"39 | Nc1nc(C(O)C(=O)O)cs1" -> 230 [label=0.000]
	231 [color=lightblue shape=rarrow style=filled]
	"39 | Nc1nc(C(O)C(=O)O)cs1" -> 231 [label=0.000]
	232 [color=lightblue shape=rarrow style=filled]
	"39 | Nc1nc(C(O)C(=O)O)cs1" -> 232 [label=0.000]
	233 [color=lightblue shape=rarrow style=filled]
	"39 | Nc1nc(C(O)C(=O)O)cs1" -> 233 [label=0.000]
	234 [color=lightblue shape=rarrow style=filled]
	"39 | Nc1nc(C(O)C(=O)O)cs1" -> 234 [label=0.000]
	235 [color=aquamarine shape=rarrow style=filled]
	"39 | Nc1nc(C(O)C(=O)O)cs1" -> 235 [label=0.000]
	236 [color=lightblue shape=rarrow style=filled]
	"39 | Nc1nc(C(O)C(=O)O)cs1" -> 236 [label=0.000]
	237 [color=lightblue shape=rarrow style=filled]
	"40 | CCC(C)(C)OCO" -> 237 [label=0.000]
	238 [color=lightblue shape=rarrow style=filled]
	"40 | CCC(C)(C)OCO" -> 238 [label=0.000]
	239 [color=lightblue shape=rarrow style=filled]
	"40 | CCC(C)(C)OCO" -> 239 [label=0.000]
	240 [color=lightblue shape=rarrow style=filled]
	"40 | CCC(C)(C)OCO" -> 240 [label=0.000]
	241 [color=lightblue shape=rarrow style=filled]
	"40 | CCC(C)(C)OCO" -> 241 [label=0.000]
	242 [color=lightblue shape=rarrow style=filled]
	"40 | CCC(C)(C)OCO" -> 242 [label=0.000]
	243 [color=lightblue shape=rarrow style=filled]
	"40 | CCC(C)(C)OCO" -> 243 [label=0.000]
	244 [color=lightblue shape=rarrow style=filled]
	"40 | CCC(C)(C)OCO" -> 244 [label=0.000]
	245 [color=lightblue shape=rarrow style=filled]
	"40 | CCC(C)(C)OCO" -> 245 [label=0.000]
	246 [color=lightblue shape=rarrow style=filled]
	"40 | CCC(C)(C)OCO" -> 246 [label=0.000]
	247 [color=aquamarine shape=rarrow style=filled]
	"41 | CCC(C)(C)OC(=O)Nc1nc(CO)cs1" -> 247 [label=0.000]
	248 [color=aquamarine shape=rarrow style=filled]
	"41 | CCC(C)(C)OC(=O)Nc1nc(CO)cs1" -> 248 [label=0.000]
	249 [color=aquamarine shape=rarrow style=filled]
	"41 | CCC(C)(C)OC(=O)Nc1nc(CO)cs1" -> 249 [label=0.000]
	250 [color=aquamarine shape=rarrow style=filled]
	"41 | CCC(C)(C)OC(=O)Nc1nc(CO)cs1" -> 250 [label=0.000]
	251 [color=aquamarine shape=rarrow style=filled]
	"41 | CCC(C)(C)OC(=O)Nc1nc(CO)cs1" -> 251 [label=0.000]
	252 [color=aquamarine shape=rarrow style=filled]
	"41 | CCC(C)(C)OC(=O)Nc1nc(CO)cs1" -> 252 [label=0.000]
	253 [color=aquamarine shape=rarrow style=filled]
	"41 | CCC(C)(C)OC(=O)Nc1nc(CO)cs1" -> 253 [label=0.000]
	254 [color=aquamarine shape=rarrow style=filled]
	"41 | CCC(C)(C)OC(=O)Nc1nc(CO)cs1" -> 254 [label=0.000]
	255 [color=aquamarine shape=rarrow style=filled]
	"41 | CCC(C)(C)OC(=O)Nc1nc(CO)cs1" -> 255 [label=0.000]
	256 [color=aquamarine shape=rarrow style=filled]
	"41 | CCC(C)(C)OC(=O)Nc1nc(CO)cs1" -> 256 [label=0.000]
	257 [color=aquamarine shape=rarrow style=filled]
	"44 | CCC(C)(C)OC(=O)Nc1nc(Br)cs1" -> 257 [label=0.000]
	258 [color=aquamarine shape=rarrow style=filled]
	"44 | CCC(C)(C)OC(=O)Nc1nc(Br)cs1" -> 258 [label=0.000]
	259 [color=aquamarine shape=rarrow style=filled]
	"44 | CCC(C)(C)OC(=O)Nc1nc(Br)cs1" -> 259 [label=0.000]
	260 [color=aquamarine shape=rarrow style=filled]
	"44 | CCC(C)(C)OC(=O)Nc1nc(Br)cs1" -> 260 [label=0.000]
	261 [color=aquamarine shape=rarrow style=filled]
	"44 | CCC(C)(C)OC(=O)Nc1nc(Br)cs1" -> 261 [label=0.000]
	262 [color=aquamarine shape=rarrow style=filled]
	"44 | CCC(C)(C)OC(=O)Nc1nc(Br)cs1" -> 262 [label=0.000]
	263 [color=aquamarine shape=rarrow style=filled]
	"44 | CCC(C)(C)OC(=O)Nc1nc(Br)cs1" -> 263 [label=0.000]
	264 [color=aquamarine shape=rarrow style=filled]
	"44 | CCC(C)(C)OC(=O)Nc1nc(Br)cs1" -> 264 [label=0.000]
	265 [color=aquamarine shape=rarrow style=filled]
	"44 | CCC(C)(C)OC(=O)Nc1nc(Br)cs1" -> 265 [label=0.000]
	266 [color=lightblue shape=rarrow style=filled]
	"45 | CC(C)(C)OC(=O)O" -> 266 [label=0.000]
	267 [color=lightblue shape=rarrow style=filled]
	"45 | CC(C)(C)OC(=O)O" -> 267 [label=0.000]
	268 [color=lightblue shape=rarrow style=filled]
	"45 | CC(C)(C)OC(=O)O" -> 268 [label=0.000]
	269 [color=aquamarine shape=rarrow style=filled]
	"45 | CC(C)(C)OC(=O)O" -> 269 [label=0.000]
	270 [color=lightblue shape=rarrow style=filled]
	"45 | CC(C)(C)OC(=O)O" -> 270 [label=0.000]
	271 [color=lightblue shape=rarrow style=filled]
	"45 | CC(C)(C)OC(=O)O" -> 271 [label=0.000]
	272 [color=aquamarine shape=rarrow style=filled]
	"45 | CC(C)(C)OC(=O)O" -> 272 [label=0.000]
	273 [color=lightblue shape=rarrow style=filled]
	"45 | CC(C)(C)OC(=O)O" -> 273 [label=0.000]
	274 [color=aquamarine shape=rarrow style=filled]
	"45 | CC(C)(C)OC(=O)O" -> 274 [label=0.000]
	275 [color=aquamarine shape=rarrow style=filled]
	"45 | CC(C)(C)OC(=O)O" -> 275 [label=0.000]
	276 [color=lightblue shape=rarrow style=filled]
	"46 | Nc1nc(C(O)C(=O)O)cs1" -> 276 [label=0.000]
	277 [color=lightblue shape=rarrow style=filled]
	"46 | Nc1nc(C(O)C(=O)O)cs1" -> 277 [label=0.000]
	278 [color=lightblue shape=rarrow style=filled]
	"46 | Nc1nc(C(O)C(=O)O)cs1" -> 278 [label=0.000]
	279 [color=aquamarine shape=rarrow style=filled]
	"46 | Nc1nc(C(O)C(=O)O)cs1" -> 279 [label=0.000]
	280 [color=lightblue shape=rarrow style=filled]
	"46 | Nc1nc(C(O)C(=O)O)cs1" -> 280 [label=0.000]
	281 [color=lightblue shape=rarrow style=filled]
	"46 | Nc1nc(C(O)C(=O)O)cs1" -> 281 [label=0.000]
	282 [color=lightblue shape=rarrow style=filled]
	"46 | Nc1nc(C(O)C(=O)O)cs1" -> 282 [label=0.000]
	283 [color=lightblue shape=rarrow style=filled]
	"46 | Nc1nc(C(O)C(=O)O)cs1" -> 283 [label=0.000]
	284 [color=aquamarine shape=rarrow style=filled]
	"46 | Nc1nc(C(O)C(=O)O)cs1" -> 284 [label=0.000]
	285 [color=lightblue shape=rarrow style=filled]
	"46 | Nc1nc(C(O)C(=O)O)cs1" -> 285 [label=0.000]
	286 [color=lightblue shape=rarrow style=filled]
	"47 | CCC(C)(C)OC(=O)O" -> 286 [label=0.000]
	287 [color=lightblue shape=rarrow style=filled]
	"47 | CCC(C)(C)OC(=O)O" -> 287 [label=0.000]
	288 [color=lightblue shape=rarrow style=filled]
	"47 | CCC(C)(C)OC(=O)O" -> 288 [label=0.000]
	289 [color=aquamarine shape=rarrow style=filled]
	"47 | CCC(C)(C)OC(=O)O" -> 289 [label=0.000]
	290 [color=lightblue shape=rarrow style=filled]
	"47 | CCC(C)(C)OC(=O)O" -> 290 [label=0.000]
	291 [color=aquamarine shape=rarrow style=filled]
	"47 | CCC(C)(C)OC(=O)O" -> 291 [label=0.000]
	292 [color=aquamarine shape=rarrow style=filled]
	"47 | CCC(C)(C)OC(=O)O" -> 292 [label=0.000]
	293 [color=aquamarine shape=rarrow style=filled]
	"47 | CCC(C)(C)OC(=O)O" -> 293 [label=0.000]
	294 [color=aquamarine shape=rarrow style=filled]
	"49 | CCC(C)(C)OC(=O)Nc1nccs1" -> 294 [label=0.000]
	295 [color=aquamarine shape=rarrow style=filled]
	"49 | CCC(C)(C)OC(=O)Nc1nccs1" -> 295 [label=0.000]
	296 [color=aquamarine shape=rarrow style=filled]
	"49 | CCC(C)(C)OC(=O)Nc1nccs1" -> 296 [label=0.000]
	297 [color=aquamarine shape=rarrow style=filled]
	"49 | CCC(C)(C)OC(=O)Nc1nccs1" -> 297 [label=0.000]
	298 [color=aquamarine shape=rarrow style=filled]
	"49 | CCC(C)(C)OC(=O)Nc1nccs1" -> 298 [label=0.000]
	299 [color=aquamarine shape=rarrow style=filled]
	"49 | CCC(C)(C)OC(=O)Nc1nccs1" -> 299 [label=0.000]
	300 [color=aquamarine shape=rarrow style=filled]
	"49 | CCC(C)(C)OC(=O)Nc1nccs1" -> 300 [label=0.000]
	301 [color=aquamarine shape=rarrow style=filled]
	"49 | CCC(C)(C)OC(=O)Nc1nccs1" -> 301 [label=0.000]
	302 [color=aquamarine shape=rarrow style=filled]
	"49 | CCC(C)(C)OC(=O)Nc1nccs1" -> 302 [label=0.000]
	303 [color=aquamarine shape=rarrow style=filled]
	"49 | CCC(C)(C)OC(=O)Nc1nccs1" -> 303 [label=0.000]
	304 [color=aquamarine shape=rarrow style=filled]
	"50 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 304 [label=0.000]
	305 [color=aquamarine shape=rarrow style=filled]
	"50 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 305 [label=0.000]
	306 [color=aquamarine shape=rarrow style=filled]
	"50 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 306 [label=0.000]
	307 [color=aquamarine shape=rarrow style=filled]
	"50 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 307 [label=0.000]
	308 [color=aquamarine shape=rarrow style=filled]
	"50 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 308 [label=0.000]
	309 [color=aquamarine shape=rarrow style=filled]
	"50 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 309 [label=0.000]
	310 [color=aquamarine shape=rarrow style=filled]
	"50 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 310 [label=0.000]
	311 [color=aquamarine shape=rarrow style=filled]
	"50 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 311 [label=0.000]
	312 [color=aquamarine shape=rarrow style=filled]
	"50 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 312 [label=0.000]
	313 [color=aquamarine shape=rarrow style=filled]
	"50 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 313 [label=0.000]
	314 [color=aquamarine shape=rarrow style=filled]
	"51 | NC1C(=O)N2C(C(=O)O)=C(C=O)CS[C@H]12" -> 314 [label=0.000]
	315 [color=aquamarine shape=rarrow style=filled]
	"51 | NC1C(=O)N2C(C(=O)O)=C(C=O)CS[C@H]12" -> 315 [label=0.000]
	316 [color=aquamarine shape=rarrow style=filled]
	"51 | NC1C(=O)N2C(C(=O)O)=C(C=O)CS[C@H]12" -> 316 [label=0.000]
	317 [color=aquamarine shape=rarrow style=filled]
	"51 | NC1C(=O)N2C(C(=O)O)=C(C=O)CS[C@H]12" -> 317 [label=0.000]
	318 [color=aquamarine shape=rarrow style=filled]
	"51 | NC1C(=O)N2C(C(=O)O)=C(C=O)CS[C@H]12" -> 318 [label=0.000]
	319 [color=aquamarine shape=rarrow style=filled]
	"51 | NC1C(=O)N2C(C(=O)O)=C(C=O)CS[C@H]12" -> 319 [label=0.000]
	320 [color=aquamarine shape=rarrow style=filled]
	"51 | NC1C(=O)N2C(C(=O)O)=C(C=O)CS[C@H]12" -> 320 [label=0.000]
	321 [color=aquamarine shape=rarrow style=filled]
	"51 | NC1C(=O)N2C(C(=O)O)=C(C=O)CS[C@H]12" -> 321 [label=0.000]
	322 [color=aquamarine shape=rarrow style=filled]
	"51 | NC1C(=O)N2C(C(=O)O)=C(C=O)CS[C@H]12" -> 322 [label=0.000]
	323 [color=aquamarine shape=rarrow style=filled]
	"51 | NC1C(=O)N2C(C(=O)O)=C(C=O)CS[C@H]12" -> 323 [label=0.000]
	324 [color=aquamarine shape=rarrow style=filled]
	"53 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" -> 324 [label=0.000]
	325 [color=aquamarine shape=rarrow style=filled]
	"53 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" -> 325 [label=0.000]
	326 [color=aquamarine shape=rarrow style=filled]
	"53 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" -> 326 [label=0.000]
	327 [color=aquamarine shape=rarrow style=filled]
	"53 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" -> 327 [label=0.000]
	328 [color=aquamarine shape=rarrow style=filled]
	"53 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" -> 328 [label=0.000]
	329 [color=aquamarine shape=rarrow style=filled]
	"53 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" -> 329 [label=0.000]
	330 [color=aquamarine shape=rarrow style=filled]
	"53 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" -> 330 [label=0.000]
	331 [color=aquamarine shape=rarrow style=filled]
	"53 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" -> 331 [label=0.000]
	332 [color=aquamarine shape=rarrow style=filled]
	"53 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" -> 332 [label=0.000]
	333 [color=aquamarine shape=rarrow style=filled]
	"53 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" -> 333 [label=0.000]
	334 [color=aquamarine shape=rarrow style=filled]
	"55 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" -> 334 [label=0.000]
	335 [color=aquamarine shape=rarrow style=filled]
	"55 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" -> 335 [label=0.000]
	336 [color=aquamarine shape=rarrow style=filled]
	"55 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" -> 336 [label=0.000]
	337 [color=aquamarine shape=rarrow style=filled]
	"55 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" -> 337 [label=0.000]
	338 [color=aquamarine shape=rarrow style=filled]
	"55 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" -> 338 [label=0.000]
	339 [color=aquamarine shape=rarrow style=filled]
	"55 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" -> 339 [label=0.000]
	340 [color=aquamarine shape=rarrow style=filled]
	"55 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" -> 340 [label=0.000]
	341 [color=aquamarine shape=rarrow style=filled]
	"55 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" -> 341 [label=0.000]
	342 [color=aquamarine shape=rarrow style=filled]
	"55 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" -> 342 [label=0.000]
	343 [color=aquamarine shape=rarrow style=filled]
	"55 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" -> 343 [label=0.000]
	344 [color=aquamarine shape=rarrow style=filled]
	"56 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C=O)CS[C@H]23)cs1" -> 344 [label=0.000]
	345 [color=aquamarine shape=rarrow style=filled]
	"56 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C=O)CS[C@H]23)cs1" -> 345 [label=0.000]
	346 [color=aquamarine shape=rarrow style=filled]
	"56 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C=O)CS[C@H]23)cs1" -> 346 [label=0.000]
	347 [color=aquamarine shape=rarrow style=filled]
	"56 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C=O)CS[C@H]23)cs1" -> 347 [label=0.000]
	348 [color=aquamarine shape=rarrow style=filled]
	"56 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C=O)CS[C@H]23)cs1" -> 348 [label=0.000]
	349 [color=aquamarine shape=rarrow style=filled]
	"56 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C=O)CS[C@H]23)cs1" -> 349 [label=0.000]
	350 [color=aquamarine shape=rarrow style=filled]
	"56 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C=O)CS[C@H]23)cs1" -> 350 [label=0.000]
	351 [color=aquamarine shape=rarrow style=filled]
	"56 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C=O)CS[C@H]23)cs1" -> 351 [label=0.000]
	352 [color=aquamarine shape=rarrow style=filled]
	"56 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C=O)CS[C@H]23)cs1" -> 352 [label=0.000]
	353 [color=aquamarine shape=rarrow style=filled]
	"56 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C=O)CS[C@H]23)cs1" -> 353 [label=0.000]
	354 [color=aquamarine shape=rarrow style=filled]
	"57 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 354 [label=0.000]
	355 [color=aquamarine shape=rarrow style=filled]
	"57 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 355 [label=0.000]
	356 [color=aquamarine shape=rarrow style=filled]
	"57 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 356 [label=0.000]
	357 [color=aquamarine shape=rarrow style=filled]
	"57 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 357 [label=0.000]
	358 [color=aquamarine shape=rarrow style=filled]
	"57 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 358 [label=0.000]
	359 [color=aquamarine shape=rarrow style=filled]
	"57 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 359 [label=0.000]
	360 [color=aquamarine shape=rarrow style=filled]
	"57 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 360 [label=0.000]
	361 [color=aquamarine shape=rarrow style=filled]
	"57 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 361 [label=0.000]
	362 [color=aquamarine shape=rarrow style=filled]
	"57 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 362 [label=0.000]
	363 [color=aquamarine shape=rarrow style=filled]
	"58 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(=O)C=O)cs1" -> 363 [label=0.000]
	364 [color=aquamarine shape=rarrow style=filled]
	"58 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(=O)C=O)cs1" -> 364 [label=0.000]
	365 [color=aquamarine shape=rarrow style=filled]
	"58 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(=O)C=O)cs1" -> 365 [label=0.000]
	366 [color=aquamarine shape=rarrow style=filled]
	"58 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(=O)C=O)cs1" -> 366 [label=0.000]
	367 [color=aquamarine shape=rarrow style=filled]
	"58 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(=O)C=O)cs1" -> 367 [label=0.000]
	368 [color=aquamarine shape=rarrow style=filled]
	"58 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(=O)C=O)cs1" -> 368 [label=0.000]
	369 [color=aquamarine shape=rarrow style=filled]
	"58 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(=O)C=O)cs1" -> 369 [label=0.000]
	370 [color=aquamarine shape=rarrow style=filled]
	"58 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(=O)C=O)cs1" -> 370 [label=0.000]
	371 [color=aquamarine shape=rarrow style=filled]
	"58 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(=O)C=O)cs1" -> 371 [label=0.000]
	372 [color=aquamarine shape=rarrow style=filled]
	"58 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(=O)C=O)cs1" -> 372 [label=0.000]
	373 [color=aquamarine shape=rarrow style=filled]
	"59 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(Br)C=O)cs1" -> 373 [label=0.000]
	374 [color=aquamarine shape=rarrow style=filled]
	"59 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(Br)C=O)cs1" -> 374 [label=0.000]
	375 [color=aquamarine shape=rarrow style=filled]
	"59 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(Br)C=O)cs1" -> 375 [label=0.000]
	376 [color=aquamarine shape=rarrow style=filled]
	"59 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(Br)C=O)cs1" -> 376 [label=0.000]
	377 [color=aquamarine shape=rarrow style=filled]
	"59 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(Br)C=O)cs1" -> 377 [label=0.000]
	378 [color=aquamarine shape=rarrow style=filled]
	"59 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(Br)C=O)cs1" -> 378 [label=0.000]
	379 [color=aquamarine shape=rarrow style=filled]
	"59 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(Br)C=O)cs1" -> 379 [label=0.000]
	380 [color=aquamarine shape=rarrow style=filled]
	"59 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(Br)C=O)cs1" -> 380 [label=0.000]
	381 [color=aquamarine shape=rarrow style=filled]
	"59 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(Br)C=O)cs1" -> 381 [label=0.000]
	382 [color=aquamarine shape=rarrow style=filled]
	"59 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(Br)C=O)cs1" -> 382 [label=0.000]
	383 [color=aquamarine shape=rarrow style=filled]
	"60 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(C(Cl)C(=O)O)[C@@H]2SCCC=O)cs1" -> 383 [label=0.000]
	384 [color=aquamarine shape=rarrow style=filled]
	"60 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(C(Cl)C(=O)O)[C@@H]2SCCC=O)cs1" -> 384 [label=0.000]
	385 [color=aquamarine shape=rarrow style=filled]
	"60 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(C(Cl)C(=O)O)[C@@H]2SCCC=O)cs1" -> 385 [label=0.000]
	386 [color=aquamarine shape=rarrow style=filled]
	"60 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(C(Cl)C(=O)O)[C@@H]2SCCC=O)cs1" -> 386 [label=0.000]
	387 [color=aquamarine shape=rarrow style=filled]
	"60 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(C(Cl)C(=O)O)[C@@H]2SCCC=O)cs1" -> 387 [label=0.000]
	388 [color=aquamarine shape=rarrow style=filled]
	"60 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(C(Cl)C(=O)O)[C@@H]2SCCC=O)cs1" -> 388 [label=0.000]
	389 [color=aquamarine shape=rarrow style=filled]
	"60 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(C(Cl)C(=O)O)[C@@H]2SCCC=O)cs1" -> 389 [label=0.000]
	390 [color=aquamarine shape=rarrow style=filled]
	"60 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(C(Cl)C(=O)O)[C@@H]2SCCC=O)cs1" -> 390 [label=0.000]
	391 [color=aquamarine shape=rarrow style=filled]
	"60 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(C(Cl)C(=O)O)[C@@H]2SCCC=O)cs1" -> 391 [label=0.000]
	392 [color=aquamarine shape=rarrow style=filled]
	"60 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(C(Cl)C(=O)O)[C@@H]2SCCC=O)cs1" -> 392 [label=0.000]
	393 [color=aquamarine shape=rarrow style=filled]
	"61 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(O)C=O)cs1" -> 393 [label=0.000]
	394 [color=aquamarine shape=rarrow style=filled]
	"61 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(O)C=O)cs1" -> 394 [label=0.000]
	395 [color=aquamarine shape=rarrow style=filled]
	"61 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(O)C=O)cs1" -> 395 [label=0.000]
	396 [color=aquamarine shape=rarrow style=filled]
	"61 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(O)C=O)cs1" -> 396 [label=0.000]
	397 [color=aquamarine shape=rarrow style=filled]
	"61 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(O)C=O)cs1" -> 397 [label=0.000]
	398 [color=aquamarine shape=rarrow style=filled]
	"61 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(O)C=O)cs1" -> 398 [label=0.000]
	399 [color=aquamarine shape=rarrow style=filled]
	"61 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(O)C=O)cs1" -> 399 [label=0.000]
	400 [color=aquamarine shape=rarrow style=filled]
	"61 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(O)C=O)cs1" -> 400 [label=0.000]
	401 [color=aquamarine shape=rarrow style=filled]
	"61 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(O)C=O)cs1" -> 401 [label=0.000]
	402 [color=aquamarine shape=rarrow style=filled]
	"61 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(O)C=O)cs1" -> 402 [label=0.000]
	403 [color=aquamarine shape=rarrow style=filled]
	"62 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(Cl)C=O)cs1" -> 403 [label=0.000]
	404 [color=aquamarine shape=rarrow style=filled]
	"62 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(Cl)C=O)cs1" -> 404 [label=0.000]
	405 [color=aquamarine shape=rarrow style=filled]
	"62 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(Cl)C=O)cs1" -> 405 [label=0.000]
	406 [color=aquamarine shape=rarrow style=filled]
	"62 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(Cl)C=O)cs1" -> 406 [label=0.000]
	407 [color=aquamarine shape=rarrow style=filled]
	"62 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(Cl)C=O)cs1" -> 407 [label=0.000]
	408 [color=aquamarine shape=rarrow style=filled]
	"62 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(Cl)C=O)cs1" -> 408 [label=0.000]
	409 [color=aquamarine shape=rarrow style=filled]
	"62 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(Cl)C=O)cs1" -> 409 [label=0.000]
	410 [color=aquamarine shape=rarrow style=filled]
	"62 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(Cl)C=O)cs1" -> 410 [label=0.000]
	411 [color=aquamarine shape=rarrow style=filled]
	"62 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(Cl)C=O)cs1" -> 411 [label=0.000]
	412 [color=aquamarine shape=rarrow style=filled]
	"62 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(Cl)C=O)cs1" -> 412 [label=0.000]
	413 [color=aquamarine shape=rarrow style=filled]
	"63 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C=O)CS[C@H]23)cs1" -> 413 [label=0.000]
	414 [color=aquamarine shape=rarrow style=filled]
	"63 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C=O)CS[C@H]23)cs1" -> 414 [label=0.000]
	415 [color=aquamarine shape=rarrow style=filled]
	"63 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C=O)CS[C@H]23)cs1" -> 415 [label=0.000]
	416 [color=aquamarine shape=rarrow style=filled]
	"63 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C=O)CS[C@H]23)cs1" -> 416 [label=0.000]
	417 [color=aquamarine shape=rarrow style=filled]
	"63 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C=O)CS[C@H]23)cs1" -> 417 [label=0.000]
	418 [color=aquamarine shape=rarrow style=filled]
	"63 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C=O)CS[C@H]23)cs1" -> 418 [label=0.000]
	419 [color=aquamarine shape=rarrow style=filled]
	"63 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C=O)CS[C@H]23)cs1" -> 419 [label=0.000]
	420 [color=aquamarine shape=rarrow style=filled]
	"63 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C=O)CS[C@H]23)cs1" -> 420 [label=0.000]
	421 [color=aquamarine shape=rarrow style=filled]
	"63 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C=O)CS[C@H]23)cs1" -> 421 [label=0.000]
	422 [color=aquamarine shape=rarrow style=filled]
	"63 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C=O)CS[C@H]23)cs1" -> 422 [label=0.000]
	423 [color=lightblue shape=rarrow style=filled]
	"65 | CCC(C)(C)OC(=O)O" -> 423 [label=0.000]
	424 [color=lightblue shape=rarrow style=filled]
	"65 | CCC(C)(C)OC(=O)O" -> 424 [label=0.000]
	425 [color=lightblue shape=rarrow style=filled]
	"65 | CCC(C)(C)OC(=O)O" -> 425 [label=0.000]
	426 [color=aquamarine shape=rarrow style=filled]
	"65 | CCC(C)(C)OC(=O)O" -> 426 [label=0.000]
	427 [color=lightblue shape=rarrow style=filled]
	"65 | CCC(C)(C)OC(=O)O" -> 427 [label=0.000]
	428 [color=aquamarine shape=rarrow style=filled]
	"65 | CCC(C)(C)OC(=O)O" -> 428 [label=0.000]
	429 [color=aquamarine shape=rarrow style=filled]
	"65 | CCC(C)(C)OC(=O)O" -> 429 [label=0.000]
	430 [color=aquamarine shape=rarrow style=filled]
	"65 | CCC(C)(C)OC(=O)O" -> 430 [label=0.000]
	431 [color=aquamarine shape=rarrow style=filled]
	"66 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 431 [label=0.000]
	432 [color=aquamarine shape=rarrow style=filled]
	"66 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 432 [label=0.000]
	433 [color=aquamarine shape=rarrow style=filled]
	"66 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 433 [label=0.000]
	434 [color=aquamarine shape=rarrow style=filled]
	"66 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 434 [label=0.000]
	435 [color=aquamarine shape=rarrow style=filled]
	"66 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 435 [label=0.000]
	436 [color=aquamarine shape=rarrow style=filled]
	"66 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 436 [label=0.000]
	437 [color=aquamarine shape=rarrow style=filled]
	"66 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 437 [label=0.000]
	438 [color=aquamarine shape=rarrow style=filled]
	"66 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 438 [label=0.000]
	439 [color=aquamarine shape=rarrow style=filled]
	"66 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 439 [label=0.000]
	440 [color=aquamarine shape=rarrow style=filled]
	"66 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 440 [label=0.000]
	441 [color=aquamarine shape=rarrow style=filled]
	"67 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 441 [label=0.000]
	442 [color=aquamarine shape=rarrow style=filled]
	"67 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 442 [label=0.000]
	443 [color=aquamarine shape=rarrow style=filled]
	"67 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 443 [label=0.000]
	444 [color=aquamarine shape=rarrow style=filled]
	"67 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 444 [label=0.000]
	445 [color=aquamarine shape=rarrow style=filled]
	"67 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 445 [label=0.000]
	446 [color=aquamarine shape=rarrow style=filled]
	"67 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 446 [label=0.000]
	447 [color=aquamarine shape=rarrow style=filled]
	"67 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 447 [label=0.000]
	448 [color=aquamarine shape=rarrow style=filled]
	"67 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 448 [label=0.000]
	449 [color=aquamarine shape=rarrow style=filled]
	"67 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 449 [label=0.000]
	450 [color=aquamarine shape=rarrow style=filled]
	"67 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 450 [label=0.000]
	451 [color=aquamarine shape=rarrow style=filled]
	"68 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 451 [label=0.000]
	452 [color=aquamarine shape=rarrow style=filled]
	"68 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 452 [label=0.000]
	453 [color=aquamarine shape=rarrow style=filled]
	"68 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 453 [label=0.000]
	454 [color=aquamarine shape=rarrow style=filled]
	"68 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 454 [label=0.000]
	455 [color=aquamarine shape=rarrow style=filled]
	"68 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 455 [label=0.000]
	456 [color=aquamarine shape=rarrow style=filled]
	"68 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 456 [label=0.000]
	457 [color=aquamarine shape=rarrow style=filled]
	"68 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 457 [label=0.000]
	458 [color=aquamarine shape=rarrow style=filled]
	"68 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 458 [label=0.000]
	459 [color=aquamarine shape=rarrow style=filled]
	"68 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 459 [label=0.000]
	460 [color=aquamarine shape=rarrow style=filled]
	"69 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 460 [label=0.000]
	461 [color=aquamarine shape=rarrow style=filled]
	"69 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 461 [label=0.000]
	462 [color=aquamarine shape=rarrow style=filled]
	"69 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 462 [label=0.000]
	463 [color=aquamarine shape=rarrow style=filled]
	"69 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 463 [label=0.000]
	464 [color=aquamarine shape=rarrow style=filled]
	"69 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 464 [label=0.000]
	465 [color=aquamarine shape=rarrow style=filled]
	"69 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 465 [label=0.000]
	466 [color=aquamarine shape=rarrow style=filled]
	"69 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 466 [label=0.000]
	467 [color=aquamarine shape=rarrow style=filled]
	"69 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 467 [label=0.000]
	468 [color=aquamarine shape=rarrow style=filled]
	"69 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 468 [label=0.000]
	469 [color=aquamarine shape=rarrow style=filled]
	"69 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 469 [label=0.000]
	470 [color=aquamarine shape=rarrow style=filled]
	"70 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 470 [label=0.000]
	471 [color=aquamarine shape=rarrow style=filled]
	"70 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 471 [label=0.000]
	472 [color=aquamarine shape=rarrow style=filled]
	"70 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 472 [label=0.000]
	473 [color=aquamarine shape=rarrow style=filled]
	"70 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 473 [label=0.000]
	474 [color=aquamarine shape=rarrow style=filled]
	"70 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 474 [label=0.000]
	475 [color=aquamarine shape=rarrow style=filled]
	"70 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 475 [label=0.000]
	476 [color=aquamarine shape=rarrow style=filled]
	"70 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 476 [label=0.000]
	477 [color=aquamarine shape=rarrow style=filled]
	"70 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 477 [label=0.000]
	478 [color=aquamarine shape=rarrow style=filled]
	"70 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 478 [label=0.000]
	479 [color=aquamarine shape=rarrow style=filled]
	"70 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 479 [label=0.000]
	480 [color=aquamarine shape=rarrow style=filled]
	"73 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 480 [label=0.000]
	481 [color=aquamarine shape=rarrow style=filled]
	"73 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 481 [label=0.000]
	482 [color=aquamarine shape=rarrow style=filled]
	"73 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 482 [label=0.000]
	483 [color=aquamarine shape=rarrow style=filled]
	"73 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 483 [label=0.000]
	484 [color=aquamarine shape=rarrow style=filled]
	"73 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 484 [label=0.000]
	485 [color=aquamarine shape=rarrow style=filled]
	"73 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 485 [label=0.000]
	486 [color=aquamarine shape=rarrow style=filled]
	"73 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 486 [label=0.000]
	487 [color=aquamarine shape=rarrow style=filled]
	"73 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 487 [label=0.000]
	488 [color=aquamarine shape=rarrow style=filled]
	"73 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 488 [label=0.000]
	489 [color=aquamarine shape=rarrow style=filled]
	"73 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 489 [label=0.000]
	490 [color=lightblue shape=rarrow style=filled]
	"74 | CCC(C)(C)OC(=O)O" -> 490 [label=0.000]
	491 [color=lightblue shape=rarrow style=filled]
	"74 | CCC(C)(C)OC(=O)O" -> 491 [label=0.000]
	492 [color=lightblue shape=rarrow style=filled]
	"74 | CCC(C)(C)OC(=O)O" -> 492 [label=0.000]
	493 [color=aquamarine shape=rarrow style=filled]
	"74 | CCC(C)(C)OC(=O)O" -> 493 [label=0.000]
	494 [color=lightblue shape=rarrow style=filled]
	"74 | CCC(C)(C)OC(=O)O" -> 494 [label=0.000]
	495 [color=aquamarine shape=rarrow style=filled]
	"74 | CCC(C)(C)OC(=O)O" -> 495 [label=0.000]
	496 [color=aquamarine shape=rarrow style=filled]
	"74 | CCC(C)(C)OC(=O)O" -> 496 [label=0.000]
	497 [color=aquamarine shape=rarrow style=filled]
	"74 | CCC(C)(C)OC(=O)O" -> 497 [label=0.000]
	498 [color=lightblue shape=rarrow style=filled]
	"75 | Nc1nc(C(O)C(=O)O)cs1" -> 498 [label=0.000]
	499 [color=lightblue shape=rarrow style=filled]
	"75 | Nc1nc(C(O)C(=O)O)cs1" -> 499 [label=0.000]
	500 [color=lightblue shape=rarrow style=filled]
	"75 | Nc1nc(C(O)C(=O)O)cs1" -> 500 [label=0.000]
	501 [color=aquamarine shape=rarrow style=filled]
	"75 | Nc1nc(C(O)C(=O)O)cs1" -> 501 [label=0.000]
	502 [color=lightblue shape=rarrow style=filled]
	"75 | Nc1nc(C(O)C(=O)O)cs1" -> 502 [label=0.000]
	503 [color=lightblue shape=rarrow style=filled]
	"75 | Nc1nc(C(O)C(=O)O)cs1" -> 503 [label=0.000]
	504 [color=lightblue shape=rarrow style=filled]
	"75 | Nc1nc(C(O)C(=O)O)cs1" -> 504 [label=0.000]
	505 [color=lightblue shape=rarrow style=filled]
	"75 | Nc1nc(C(O)C(=O)O)cs1" -> 505 [label=0.000]
	506 [color=aquamarine shape=rarrow style=filled]
	"75 | Nc1nc(C(O)C(=O)O)cs1" -> 506 [label=0.000]
	507 [color=lightblue shape=rarrow style=filled]
	"75 | Nc1nc(C(O)C(=O)O)cs1" -> 507 [label=0.000]
	508 [color=aquamarine shape=rarrow style=filled]
	"76 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 508 [label=0.000]
	509 [color=aquamarine shape=rarrow style=filled]
	"76 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 509 [label=0.000]
	510 [color=aquamarine shape=rarrow style=filled]
	"76 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 510 [label=0.000]
	511 [color=aquamarine shape=rarrow style=filled]
	"76 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 511 [label=0.000]
	512 [color=aquamarine shape=rarrow style=filled]
	"76 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 512 [label=0.000]
	513 [color=aquamarine shape=rarrow style=filled]
	"76 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 513 [label=0.000]
	514 [color=aquamarine shape=rarrow style=filled]
	"76 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 514 [label=0.000]
	515 [color=aquamarine shape=rarrow style=filled]
	"76 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 515 [label=0.000]
	516 [color=aquamarine shape=rarrow style=filled]
	"76 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 516 [label=0.000]
	517 [color=aquamarine shape=rarrow style=filled]
	"76 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 517 [label=0.000]
	518 [color=lightblue shape=rarrow style=filled]
	"77 | CCC(C)(C)OC=O" -> 518 [label=0.000]
	519 [color=lightblue shape=rarrow style=filled]
	"77 | CCC(C)(C)OC=O" -> 519 [label=0.000]
	520 [color=lightblue shape=rarrow style=filled]
	"77 | CCC(C)(C)OC=O" -> 520 [label=0.000]
	521 [color=lightblue shape=rarrow style=filled]
	"77 | CCC(C)(C)OC=O" -> 521 [label=0.000]
	522 [color=lightblue shape=rarrow style=filled]
	"77 | CCC(C)(C)OC=O" -> 522 [label=0.000]
	523 [color=lightblue shape=rarrow style=filled]
	"77 | CCC(C)(C)OC=O" -> 523 [label=0.000]
	524 [color=lightblue shape=rarrow style=filled]
	"77 | CCC(C)(C)OC=O" -> 524 [label=0.000]
	525 [color=aquamarine shape=rarrow style=filled]
	"77 | CCC(C)(C)OC=O" -> 525 [label=0.000]
	526 [color=aquamarine shape=rarrow style=filled]
	"77 | CCC(C)(C)OC=O" -> 526 [label=0.000]
	527 [color=aquamarine shape=rarrow style=filled]
	"79 | CC(=O)C(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 527 [label=0.000]
	528 [color=aquamarine shape=rarrow style=filled]
	"79 | CC(=O)C(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 528 [label=0.000]
	529 [color=aquamarine shape=rarrow style=filled]
	"79 | CC(=O)C(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 529 [label=0.000]
	530 [color=aquamarine shape=rarrow style=filled]
	"79 | CC(=O)C(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 530 [label=0.000]
	531 [color=aquamarine shape=rarrow style=filled]
	"79 | CC(=O)C(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 531 [label=0.000]
	532 [color=aquamarine shape=rarrow style=filled]
	"79 | CC(=O)C(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 532 [label=0.000]
	533 [color=aquamarine shape=rarrow style=filled]
	"79 | CC(=O)C(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 533 [label=0.000]
	534 [color=aquamarine shape=rarrow style=filled]
	"79 | CC(=O)C(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 534 [label=0.000]
	535 [color=aquamarine shape=rarrow style=filled]
	"79 | CC(=O)C(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 535 [label=0.000]
	536 [color=aquamarine shape=rarrow style=filled]
	"79 | CC(=O)C(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 536 [label=0.000]
	537 [color=lightblue shape=rarrow style=filled]
	"80 | CCC(C)(C)OC(=O)O" -> 537 [label=0.000]
	538 [color=lightblue shape=rarrow style=filled]
	"80 | CCC(C)(C)OC(=O)O" -> 538 [label=0.000]
	539 [color=lightblue shape=rarrow style=filled]
	"80 | CCC(C)(C)OC(=O)O" -> 539 [label=0.000]
	540 [color=aquamarine shape=rarrow style=filled]
	"80 | CCC(C)(C)OC(=O)O" -> 540 [label=0.000]
	541 [color=lightblue shape=rarrow style=filled]
	"80 | CCC(C)(C)OC(=O)O" -> 541 [label=0.000]
	542 [color=aquamarine shape=rarrow style=filled]
	"80 | CCC(C)(C)OC(=O)O" -> 542 [label=0.000]
	543 [color=aquamarine shape=rarrow style=filled]
	"80 | CCC(C)(C)OC(=O)O" -> 543 [label=0.000]
	544 [color=aquamarine shape=rarrow style=filled]
	"80 | CCC(C)(C)OC(=O)O" -> 544 [label=0.000]
	545 [color=aquamarine shape=rarrow style=filled]
	"81 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 545 [label=0.000]
	546 [color=aquamarine shape=rarrow style=filled]
	"81 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 546 [label=0.000]
	547 [color=aquamarine shape=rarrow style=filled]
	"81 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 547 [label=0.000]
	548 [color=aquamarine shape=rarrow style=filled]
	"81 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 548 [label=0.000]
	549 [color=aquamarine shape=rarrow style=filled]
	"81 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 549 [label=0.000]
	550 [color=aquamarine shape=rarrow style=filled]
	"81 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 550 [label=0.000]
	551 [color=aquamarine shape=rarrow style=filled]
	"81 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 551 [label=0.000]
	552 [color=aquamarine shape=rarrow style=filled]
	"81 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 552 [label=0.000]
	553 [color=aquamarine shape=rarrow style=filled]
	"81 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 553 [label=0.000]
	554 [color=aquamarine shape=rarrow style=filled]
	"81 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 554 [label=0.000]
	555 [color=lightblue shape=rarrow style=filled]
	"82 | CCC(C)(C)OCO" -> 555 [label=0.000]
	556 [color=lightblue shape=rarrow style=filled]
	"82 | CCC(C)(C)OCO" -> 556 [label=0.000]
	557 [color=lightblue shape=rarrow style=filled]
	"82 | CCC(C)(C)OCO" -> 557 [label=0.000]
	558 [color=lightblue shape=rarrow style=filled]
	"82 | CCC(C)(C)OCO" -> 558 [label=0.000]
	559 [color=lightblue shape=rarrow style=filled]
	"82 | CCC(C)(C)OCO" -> 559 [label=0.000]
	560 [color=lightblue shape=rarrow style=filled]
	"82 | CCC(C)(C)OCO" -> 560 [label=0.000]
	561 [color=lightblue shape=rarrow style=filled]
	"82 | CCC(C)(C)OCO" -> 561 [label=0.000]
	562 [color=lightblue shape=rarrow style=filled]
	"82 | CCC(C)(C)OCO" -> 562 [label=0.000]
	563 [color=lightblue shape=rarrow style=filled]
	"82 | CCC(C)(C)OCO" -> 563 [label=0.000]
	564 [color=lightblue shape=rarrow style=filled]
	"82 | CCC(C)(C)OCO" -> 564 [label=0.000]
	565 [color=aquamarine shape=rarrow style=filled]
	"83 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 565 [label=0.000]
	566 [color=aquamarine shape=rarrow style=filled]
	"83 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 566 [label=0.000]
	567 [color=aquamarine shape=rarrow style=filled]
	"83 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 567 [label=0.000]
	568 [color=aquamarine shape=rarrow style=filled]
	"83 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 568 [label=0.000]
	569 [color=aquamarine shape=rarrow style=filled]
	"83 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 569 [label=0.000]
	570 [color=aquamarine shape=rarrow style=filled]
	"83 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 570 [label=0.000]
	571 [color=aquamarine shape=rarrow style=filled]
	"83 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 571 [label=0.000]
	572 [color=aquamarine shape=rarrow style=filled]
	"83 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 572 [label=0.000]
	573 [color=aquamarine shape=rarrow style=filled]
	"83 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 573 [label=0.000]
	574 [color=aquamarine shape=rarrow style=filled]
	"83 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 574 [label=0.000]
	575 [color=lightblue shape=rarrow style=filled]
	"84 | CC(C)(C)OC(=O)O" -> 575 [label=0.000]
	576 [color=lightblue shape=rarrow style=filled]
	"84 | CC(C)(C)OC(=O)O" -> 576 [label=0.000]
	577 [color=lightblue shape=rarrow style=filled]
	"84 | CC(C)(C)OC(=O)O" -> 577 [label=0.000]
	578 [color=aquamarine shape=rarrow style=filled]
	"84 | CC(C)(C)OC(=O)O" -> 578 [label=0.000]
	579 [color=lightblue shape=rarrow style=filled]
	"84 | CC(C)(C)OC(=O)O" -> 579 [label=0.000]
	580 [color=lightblue shape=rarrow style=filled]
	"84 | CC(C)(C)OC(=O)O" -> 580 [label=0.000]
	581 [color=aquamarine shape=rarrow style=filled]
	"84 | CC(C)(C)OC(=O)O" -> 581 [label=0.000]
	582 [color=lightblue shape=rarrow style=filled]
	"84 | CC(C)(C)OC(=O)O" -> 582 [label=0.000]
	583 [color=aquamarine shape=rarrow style=filled]
	"84 | CC(C)(C)OC(=O)O" -> 583 [label=0.000]
	584 [color=aquamarine shape=rarrow style=filled]
	"84 | CC(C)(C)OC(=O)O" -> 584 [label=0.000]
	585 [color=lightblue shape=rarrow style=filled]
	"85 | CCC(C)(C)OC(=O)O" -> 585 [label=0.000]
	586 [color=lightblue shape=rarrow style=filled]
	"85 | CCC(C)(C)OC(=O)O" -> 586 [label=0.000]
	587 [color=lightblue shape=rarrow style=filled]
	"85 | CCC(C)(C)OC(=O)O" -> 587 [label=0.000]
	588 [color=aquamarine shape=rarrow style=filled]
	"85 | CCC(C)(C)OC(=O)O" -> 588 [label=0.000]
	589 [color=lightblue shape=rarrow style=filled]
	"85 | CCC(C)(C)OC(=O)O" -> 589 [label=0.000]
	590 [color=aquamarine shape=rarrow style=filled]
	"85 | CCC(C)(C)OC(=O)O" -> 590 [label=0.000]
	591 [color=aquamarine shape=rarrow style=filled]
	"85 | CCC(C)(C)OC(=O)O" -> 591 [label=0.000]
	592 [color=aquamarine shape=rarrow style=filled]
	"85 | CCC(C)(C)OC(=O)O" -> 592 [label=0.000]
	593 [color=aquamarine shape=rarrow style=filled]
	"86 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 593 [label=0.000]
	594 [color=aquamarine shape=rarrow style=filled]
	"86 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 594 [label=0.000]
	595 [color=aquamarine shape=rarrow style=filled]
	"86 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 595 [label=0.000]
	596 [color=aquamarine shape=rarrow style=filled]
	"86 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 596 [label=0.000]
	597 [color=aquamarine shape=rarrow style=filled]
	"86 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 597 [label=0.000]
	598 [color=aquamarine shape=rarrow style=filled]
	"86 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 598 [label=0.000]
	599 [color=aquamarine shape=rarrow style=filled]
	"86 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 599 [label=0.000]
	600 [color=aquamarine shape=rarrow style=filled]
	"86 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 600 [label=0.000]
	601 [color=aquamarine shape=rarrow style=filled]
	"86 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 601 [label=0.000]
	602 [color=aquamarine shape=rarrow style=filled]
	"86 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 602 [label=0.000]
	603 [color=aquamarine shape=rarrow style=filled]
	"89 | BrSBr" -> 603 [label=0.000]
	604 [color=lightblue shape=rarrow style=filled]
	"90 | Cc1nncs1" -> 604 [label=0.000]
	605 [color=aquamarine shape=rarrow style=filled]
	"90 | Cc1nncs1" -> 605 [label=0.000]
	606 [color=aquamarine shape=rarrow style=filled]
	"90 | Cc1nncs1" -> 606 [label=0.000]
	607 [color=aquamarine shape=rarrow style=filled]
	"90 | Cc1nncs1" -> 607 [label=0.000]
	608 [color=aquamarine shape=rarrow style=filled]
	"90 | Cc1nncs1" -> 608 [label=0.000]
	609 [color=aquamarine shape=rarrow style=filled]
	"90 | Cc1nncs1" -> 609 [label=0.000]
	610 [color=aquamarine shape=rarrow style=filled]
	"90 | Cc1nncs1" -> 610 [label=0.000]
	611 [color=aquamarine shape=rarrow style=filled]
	"90 | Cc1nncs1" -> 611 [label=0.000]
	612 [color=aquamarine shape=rarrow style=filled]
	"90 | Cc1nncs1" -> 612 [label=0.000]
	613 [color=aquamarine shape=rarrow style=filled]
	"92 | SBr" -> 613 [label=0.000]
	614 [color=aquamarine shape=rarrow style=filled]
	"93 | NN=C=[S]Br" -> 614 [label=0.000]
	615 [color=aquamarine shape=rarrow style=filled]
	"93 | NN=C=[S]Br" -> 615 [label=0.000]
	616 [color=aquamarine shape=rarrow style=filled]
	"93 | NN=C=[S]Br" -> 616 [label=0.000]
	617 [color=aquamarine shape=rarrow style=filled]
	"93 | NN=C=[S]Br" -> 617 [label=0.000]
	618 [color=aquamarine shape=rarrow style=filled]
	"93 | NN=C=[S]Br" -> 618 [label=0.000]
	619 [color=aquamarine shape=rarrow style=filled]
	"93 | NN=C=[S]Br" -> 619 [label=0.000]
	620 [color=aquamarine shape=rarrow style=filled]
	"93 | NN=C=[S]Br" -> 620 [label=0.000]
	621 [color=aquamarine shape=rarrow style=filled]
	"93 | NN=C=[S]Br" -> 621 [label=0.000]
	622 [color=aquamarine shape=rarrow style=filled]
	"93 | NN=C=[S]Br" -> 622 [label=0.000]
	623 [color=aquamarine shape=rarrow style=filled]
	"93 | NN=C=[S]Br" -> 623 [label=0.000]
	624 [color=aquamarine shape=rarrow style=filled]
	"94 | CC[SH](=O)=O" -> 624 [label=0.000]
	625 [color=lightblue shape=rarrow style=filled]
	"94 | CC[SH](=O)=O" -> 625 [label=0.000]
	626 [color=lightblue shape=rarrow style=filled]
	"94 | CC[SH](=O)=O" -> 626 [label=0.000]
	627 [color=lightblue shape=rarrow style=filled]
	"94 | CC[SH](=O)=O" -> 627 [label=0.000]
	628 [color=aquamarine shape=rarrow style=filled]
	"94 | CC[SH](=O)=O" -> 628 [label=0.000]
	629 [color=aquamarine shape=rarrow style=filled]
	"94 | CC[SH](=O)=O" -> 629 [label=0.000]
	630 [color=aquamarine shape=rarrow style=filled]
	"94 | CC[SH](=O)=O" -> 630 [label=0.000]
	631 [color=aquamarine shape=rarrow style=filled]
	"94 | CC[SH](=O)=O" -> 631 [label=0.000]
	632 [color=aquamarine shape=rarrow style=filled]
	"94 | CC[SH](=O)=O" -> 632 [label=0.000]
	633 [color=lightblue shape=rarrow style=filled]
	"94 | CC[SH](=O)=O" -> 633 [label=0.000]
	634 [color=aquamarine shape=rarrow style=filled]
	"96 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 634 [label=0.000]
	635 [color=aquamarine shape=rarrow style=filled]
	"96 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 635 [label=0.000]
	636 [color=aquamarine shape=rarrow style=filled]
	"96 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 636 [label=0.000]
	637 [color=aquamarine shape=rarrow style=filled]
	"96 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 637 [label=0.000]
	638 [color=aquamarine shape=rarrow style=filled]
	"96 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 638 [label=0.000]
	639 [color=aquamarine shape=rarrow style=filled]
	"96 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 639 [label=0.000]
	640 [color=aquamarine shape=rarrow style=filled]
	"96 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 640 [label=0.000]
	641 [color=aquamarine shape=rarrow style=filled]
	"96 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 641 [label=0.000]
	642 [color=aquamarine shape=rarrow style=filled]
	"96 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 642 [label=0.000]
	643 [color=aquamarine shape=rarrow style=filled]
	"96 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 643 [label=0.000]
	644 [color=aquamarine shape=rarrow style=filled]
	"97 | NC1C(=O)N2C(C(=O)O)=C(CCl)CS[C@H]12" -> 644 [label=0.000]
	645 [color=aquamarine shape=rarrow style=filled]
	"97 | NC1C(=O)N2C(C(=O)O)=C(CCl)CS[C@H]12" -> 645 [label=0.000]
	646 [color=aquamarine shape=rarrow style=filled]
	"97 | NC1C(=O)N2C(C(=O)O)=C(CCl)CS[C@H]12" -> 646 [label=0.000]
	647 [color=aquamarine shape=rarrow style=filled]
	"97 | NC1C(=O)N2C(C(=O)O)=C(CCl)CS[C@H]12" -> 647 [label=0.000]
	648 [color=aquamarine shape=rarrow style=filled]
	"97 | NC1C(=O)N2C(C(=O)O)=C(CCl)CS[C@H]12" -> 648 [label=0.000]
	649 [color=aquamarine shape=rarrow style=filled]
	"97 | NC1C(=O)N2C(C(=O)O)=C(CCl)CS[C@H]12" -> 649 [label=0.000]
	650 [color=aquamarine shape=rarrow style=filled]
	"97 | NC1C(=O)N2C(C(=O)O)=C(CCl)CS[C@H]12" -> 650 [label=0.000]
	651 [color=aquamarine shape=rarrow style=filled]
	"97 | NC1C(=O)N2C(C(=O)O)=C(CCl)CS[C@H]12" -> 651 [label=0.000]
	652 [color=aquamarine shape=rarrow style=filled]
	"97 | NC1C(=O)N2C(C(=O)O)=C(CCl)CS[C@H]12" -> 652 [label=0.000]
	653 [color=aquamarine shape=rarrow style=filled]
	"98 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 653 [label=0.000]
	654 [color=aquamarine shape=rarrow style=filled]
	"98 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 654 [label=0.000]
	655 [color=aquamarine shape=rarrow style=filled]
	"98 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 655 [label=0.000]
	656 [color=aquamarine shape=rarrow style=filled]
	"98 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 656 [label=0.000]
	657 [color=aquamarine shape=rarrow style=filled]
	"98 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 657 [label=0.000]
	658 [color=aquamarine shape=rarrow style=filled]
	"98 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 658 [label=0.000]
	659 [color=aquamarine shape=rarrow style=filled]
	"98 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 659 [label=0.000]
	660 [color=aquamarine shape=rarrow style=filled]
	"98 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 660 [label=0.000]
	661 [color=aquamarine shape=rarrow style=filled]
	"98 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 661 [label=0.000]
	662 [color=aquamarine shape=rarrow style=filled]
	"100 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 662 [label=0.000]
	663 [color=aquamarine shape=rarrow style=filled]
	"100 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 663 [label=0.000]
	664 [color=aquamarine shape=rarrow style=filled]
	"100 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 664 [label=0.000]
	665 [color=aquamarine shape=rarrow style=filled]
	"100 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 665 [label=0.000]
	666 [color=aquamarine shape=rarrow style=filled]
	"100 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 666 [label=0.000]
	667 [color=aquamarine shape=rarrow style=filled]
	"100 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 667 [label=0.000]
	668 [color=aquamarine shape=rarrow style=filled]
	"100 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 668 [label=0.000]
	669 [color=aquamarine shape=rarrow style=filled]
	"100 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 669 [label=0.000]
	670 [color=aquamarine shape=rarrow style=filled]
	"100 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 670 [label=0.000]
	671 [color=aquamarine shape=rarrow style=filled]
	"102 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 671 [label=0.000]
	672 [color=aquamarine shape=rarrow style=filled]
	"102 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 672 [label=0.000]
	673 [color=aquamarine shape=rarrow style=filled]
	"102 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 673 [label=0.000]
	674 [color=aquamarine shape=rarrow style=filled]
	"102 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 674 [label=0.000]
	675 [color=aquamarine shape=rarrow style=filled]
	"102 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 675 [label=0.000]
	676 [color=aquamarine shape=rarrow style=filled]
	"102 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 676 [label=0.000]
	677 [color=aquamarine shape=rarrow style=filled]
	"102 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 677 [label=0.000]
	678 [color=aquamarine shape=rarrow style=filled]
	"102 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 678 [label=0.000]
	679 [color=aquamarine shape=rarrow style=filled]
	"102 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 679 [label=0.000]
	680 [color=aquamarine shape=rarrow style=filled]
	"103 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CCl)CS[C@H]23)cs1" -> 680 [label=0.000]
	681 [color=aquamarine shape=rarrow style=filled]
	"103 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CCl)CS[C@H]23)cs1" -> 681 [label=0.000]
	682 [color=aquamarine shape=rarrow style=filled]
	"103 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CCl)CS[C@H]23)cs1" -> 682 [label=0.000]
	683 [color=aquamarine shape=rarrow style=filled]
	"103 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CCl)CS[C@H]23)cs1" -> 683 [label=0.000]
	684 [color=aquamarine shape=rarrow style=filled]
	"103 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CCl)CS[C@H]23)cs1" -> 684 [label=0.000]
	685 [color=aquamarine shape=rarrow style=filled]
	"103 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CCl)CS[C@H]23)cs1" -> 685 [label=0.000]
	686 [color=aquamarine shape=rarrow style=filled]
	"103 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CCl)CS[C@H]23)cs1" -> 686 [label=0.000]
	687 [color=aquamarine shape=rarrow style=filled]
	"104 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CBr)CS[C@H]23)cs1" -> 687 [label=0.000]
	688 [color=aquamarine shape=rarrow style=filled]
	"104 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CBr)CS[C@H]23)cs1" -> 688 [label=0.000]
	689 [color=aquamarine shape=rarrow style=filled]
	"104 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CBr)CS[C@H]23)cs1" -> 689 [label=0.000]
	690 [color=aquamarine shape=rarrow style=filled]
	"104 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CBr)CS[C@H]23)cs1" -> 690 [label=0.000]
	691 [color=lightblue shape=rarrow style=filled]
	"107 | CCC(C)(C)OC(=O)O" -> 691 [label=0.000]
	692 [color=lightblue shape=rarrow style=filled]
	"107 | CCC(C)(C)OC(=O)O" -> 692 [label=0.000]
	693 [color=lightblue shape=rarrow style=filled]
	"107 | CCC(C)(C)OC(=O)O" -> 693 [label=0.000]
	694 [color=aquamarine shape=rarrow style=filled]
	"107 | CCC(C)(C)OC(=O)O" -> 694 [label=0.000]
	695 [color=lightblue shape=rarrow style=filled]
	"107 | CCC(C)(C)OC(=O)O" -> 695 [label=0.000]
	696 [color=aquamarine shape=rarrow style=filled]
	"107 | CCC(C)(C)OC(=O)O" -> 696 [label=0.000]
	697 [color=aquamarine shape=rarrow style=filled]
	"107 | CCC(C)(C)OC(=O)O" -> 697 [label=0.000]
	698 [color=aquamarine shape=rarrow style=filled]
	"107 | CCC(C)(C)OC(=O)O" -> 698 [label=0.000]
	699 [color=aquamarine shape=rarrow style=filled]
	"108 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CCl)CS[C@H]23)cs1" -> 699 [label=0.000]
	700 [color=aquamarine shape=rarrow style=filled]
	"108 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CCl)CS[C@H]23)cs1" -> 700 [label=0.000]
	701 [color=aquamarine shape=rarrow style=filled]
	"108 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CCl)CS[C@H]23)cs1" -> 701 [label=0.000]
	702 [color=aquamarine shape=rarrow style=filled]
	"108 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CCl)CS[C@H]23)cs1" -> 702 [label=0.000]
	703 [color=aquamarine shape=rarrow style=filled]
	"108 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CCl)CS[C@H]23)cs1" -> 703 [label=0.000]
	704 [color=aquamarine shape=rarrow style=filled]
	"108 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CCl)CS[C@H]23)cs1" -> 704 [label=0.000]
	705 [color=aquamarine shape=rarrow style=filled]
	"108 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CCl)CS[C@H]23)cs1" -> 705 [label=0.000]
	706 [color=aquamarine shape=rarrow style=filled]
	"110 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 706 [label=0.000]
	707 [color=aquamarine shape=rarrow style=filled]
	"110 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 707 [label=0.000]
	708 [color=aquamarine shape=rarrow style=filled]
	"110 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 708 [label=0.000]
	709 [color=aquamarine shape=rarrow style=filled]
	"110 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 709 [label=0.000]
	710 [color=aquamarine shape=rarrow style=filled]
	"110 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 710 [label=0.000]
	711 [color=aquamarine shape=rarrow style=filled]
	"110 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 711 [label=0.000]
	712 [color=aquamarine shape=rarrow style=filled]
	"110 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 712 [label=0.000]
	713 [color=aquamarine shape=rarrow style=filled]
	"110 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 713 [label=0.000]
	714 [color=aquamarine shape=rarrow style=filled]
	"110 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 714 [label=0.000]
	715 [color=aquamarine shape=rarrow style=filled]
	"111 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 715 [label=0.000]
	716 [color=aquamarine shape=rarrow style=filled]
	"111 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 716 [label=0.000]
	717 [color=aquamarine shape=rarrow style=filled]
	"111 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 717 [label=0.000]
	718 [color=aquamarine shape=rarrow style=filled]
	"111 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 718 [label=0.000]
	719 [color=aquamarine shape=rarrow style=filled]
	"111 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 719 [label=0.000]
	720 [color=aquamarine shape=rarrow style=filled]
	"111 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 720 [label=0.000]
	721 [color=aquamarine shape=rarrow style=filled]
	"111 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 721 [label=0.000]
	722 [color=aquamarine shape=rarrow style=filled]
	"111 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 722 [label=0.000]
	723 [color=aquamarine shape=rarrow style=filled]
	"111 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" -> 723 [label=0.000]
	724 [color=lightblue shape=rarrow style=filled]
	"114 | Nc1nc(C(O)C(=O)O)cs1" -> 724 [label=0.000]
	725 [color=lightblue shape=rarrow style=filled]
	"114 | Nc1nc(C(O)C(=O)O)cs1" -> 725 [label=0.000]
	726 [color=lightblue shape=rarrow style=filled]
	"114 | Nc1nc(C(O)C(=O)O)cs1" -> 726 [label=0.000]
	727 [color=aquamarine shape=rarrow style=filled]
	"114 | Nc1nc(C(O)C(=O)O)cs1" -> 727 [label=0.000]
	728 [color=lightblue shape=rarrow style=filled]
	"114 | Nc1nc(C(O)C(=O)O)cs1" -> 728 [label=0.000]
	729 [color=lightblue shape=rarrow style=filled]
	"114 | Nc1nc(C(O)C(=O)O)cs1" -> 729 [label=0.000]
	730 [color=lightblue shape=rarrow style=filled]
	"114 | Nc1nc(C(O)C(=O)O)cs1" -> 730 [label=0.000]
	731 [color=lightblue shape=rarrow style=filled]
	"114 | Nc1nc(C(O)C(=O)O)cs1" -> 731 [label=0.000]
	732 [color=aquamarine shape=rarrow style=filled]
	"114 | Nc1nc(C(O)C(=O)O)cs1" -> 732 [label=0.000]
	733 [color=lightblue shape=rarrow style=filled]
	"114 | Nc1nc(C(O)C(=O)O)cs1" -> 733 [label=0.000]
	734 [color=aquamarine shape=rarrow style=filled]
	"115 | NC1C(=O)N2C(C(=O)O)=C(CCl)CS[C@H]12" -> 734 [label=0.000]
	735 [color=aquamarine shape=rarrow style=filled]
	"115 | NC1C(=O)N2C(C(=O)O)=C(CCl)CS[C@H]12" -> 735 [label=0.000]
	736 [color=aquamarine shape=rarrow style=filled]
	"115 | NC1C(=O)N2C(C(=O)O)=C(CCl)CS[C@H]12" -> 736 [label=0.000]
	737 [color=aquamarine shape=rarrow style=filled]
	"115 | NC1C(=O)N2C(C(=O)O)=C(CCl)CS[C@H]12" -> 737 [label=0.000]
	738 [color=aquamarine shape=rarrow style=filled]
	"115 | NC1C(=O)N2C(C(=O)O)=C(CCl)CS[C@H]12" -> 738 [label=0.000]
	739 [color=aquamarine shape=rarrow style=filled]
	"115 | NC1C(=O)N2C(C(=O)O)=C(CCl)CS[C@H]12" -> 739 [label=0.000]
	740 [color=aquamarine shape=rarrow style=filled]
	"115 | NC1C(=O)N2C(C(=O)O)=C(CCl)CS[C@H]12" -> 740 [label=0.000]
	741 [color=aquamarine shape=rarrow style=filled]
	"115 | NC1C(=O)N2C(C(=O)O)=C(CCl)CS[C@H]12" -> 741 [label=0.000]
	742 [color=aquamarine shape=rarrow style=filled]
	"115 | NC1C(=O)N2C(C(=O)O)=C(CCl)CS[C@H]12" -> 742 [label=0.000]
	743 [color=lightblue shape=rarrow style=filled]
	"116 | CCC(C)(C)OC=O" -> 743 [label=0.000]
	744 [color=lightblue shape=rarrow style=filled]
	"116 | CCC(C)(C)OC=O" -> 744 [label=0.000]
	745 [color=lightblue shape=rarrow style=filled]
	"116 | CCC(C)(C)OC=O" -> 745 [label=0.000]
	746 [color=lightblue shape=rarrow style=filled]
	"116 | CCC(C)(C)OC=O" -> 746 [label=0.000]
	747 [color=lightblue shape=rarrow style=filled]
	"116 | CCC(C)(C)OC=O" -> 747 [label=0.000]
	748 [color=lightblue shape=rarrow style=filled]
	"116 | CCC(C)(C)OC=O" -> 748 [label=0.000]
	749 [color=lightblue shape=rarrow style=filled]
	"116 | CCC(C)(C)OC=O" -> 749 [label=0.000]
	750 [color=aquamarine shape=rarrow style=filled]
	"116 | CCC(C)(C)OC=O" -> 750 [label=0.000]
	751 [color=aquamarine shape=rarrow style=filled]
	"116 | CCC(C)(C)OC=O" -> 751 [label=0.000]
	752 [color=aquamarine shape=rarrow style=filled]
	"117 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CCl)CS[C@H]23)cs1" -> 752 [label=0.000]
	753 [color=aquamarine shape=rarrow style=filled]
	"117 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CCl)CS[C@H]23)cs1" -> 753 [label=0.000]
	754 [color=aquamarine shape=rarrow style=filled]
	"117 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CCl)CS[C@H]23)cs1" -> 754 [label=0.000]
	755 [color=aquamarine shape=rarrow style=filled]
	"117 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CCl)CS[C@H]23)cs1" -> 755 [label=0.000]
	756 [color=aquamarine shape=rarrow style=filled]
	"117 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CCl)CS[C@H]23)cs1" -> 756 [label=0.000]
	757 [color=aquamarine shape=rarrow style=filled]
	"117 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CCl)CS[C@H]23)cs1" -> 757 [label=0.000]
	758 [color=aquamarine shape=rarrow style=filled]
	"117 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CCl)CS[C@H]23)cs1" -> 758 [label=0.000]
	759 [color=lightblue shape=rarrow style=filled]
	"118 | CCC(C)(C)OC(=O)O" -> 759 [label=0.000]
	760 [color=lightblue shape=rarrow style=filled]
	"118 | CCC(C)(C)OC(=O)O" -> 760 [label=0.000]
	761 [color=lightblue shape=rarrow style=filled]
	"118 | CCC(C)(C)OC(=O)O" -> 761 [label=0.000]
	762 [color=aquamarine shape=rarrow style=filled]
	"118 | CCC(C)(C)OC(=O)O" -> 762 [label=0.000]
	763 [color=lightblue shape=rarrow style=filled]
	"118 | CCC(C)(C)OC(=O)O" -> 763 [label=0.000]
	764 [color=aquamarine shape=rarrow style=filled]
	"118 | CCC(C)(C)OC(=O)O" -> 764 [label=0.000]
	765 [color=aquamarine shape=rarrow style=filled]
	"118 | CCC(C)(C)OC(=O)O" -> 765 [label=0.000]
	766 [color=aquamarine shape=rarrow style=filled]
	"118 | CCC(C)(C)OC(=O)O" -> 766 [label=0.000]
	"119 | Nc1nc(C(O)C(=O)O)cs1" [color=lightblue shape=box style=filled]
	56 -> "119 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"120 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=aquamarine shape=box style=filled]
	56 -> "120 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"121 | Nc1nc(C(O)C(=O)O)cs1" [color=lightblue shape=box style=filled]
	57 -> "121 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"122 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	57 -> "122 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"123 | CCC(C)(C)OC(=O)O" [color=lightblue shape=box style=filled]
	57 -> "123 | CCC(C)(C)OC(=O)O" [label=""]
	"124 | CCC(C)(C)OC(=O)Nc1nccs1" [color=aquamarine shape=box style=filled]
	58 -> "124 | CCC(C)(C)OC(=O)Nc1nccs1" [label=""]
	"125 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	58 -> "125 | O=CC(=O)O" [label=""]
	"126 | Nc1nc(C(O)C(=O)O)cs1" [color=lightblue shape=box style=filled]
	59 -> "126 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"127 | CCC(C)(C)OC(=O)O" [color=lightblue shape=box style=filled]
	59 -> "127 | CCC(C)(C)OC(=O)O" [label=""]
	"128 | CCC(C)(C)OC(N)=O" [color=lightblue shape=box style=filled]
	60 -> "128 | CCC(C)(C)OC(N)=O" [label=""]
	"129 | O=C(O)C(O)c1csc(Br)n1" [color=lightyellow shape=box style=filled]
	60 -> "129 | O=C(O)C(O)c1csc(Br)n1" [label=""]
	"130 | Nc1nc(C(O)C(=O)O)cs1" [color=lightblue shape=box style=filled]
	61 -> "130 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"131 | CCC(C)(C)OCO" [color=lightblue shape=box style=filled]
	61 -> "131 | CCC(C)(C)OCO" [label=""]
	"132 | CCC(C)(C)OC(=O)Nc1nc(CO)cs1" [color=aquamarine shape=box style=filled]
	62 -> "132 | CCC(C)(C)OC(=O)Nc1nc(CO)cs1" [label=""]
	"133 | O=C=O" [color=lightyellow shape=box style=filled]
	62 -> "133 | O=C=O" [label=""]
	"134 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	63 -> "134 | O=C(O)CO" [label=""]
	"135 | CCC(C)(C)OC(=O)Nc1nc(Br)cs1" [color=aquamarine shape=box style=filled]
	63 -> "135 | CCC(C)(C)OC(=O)Nc1nc(Br)cs1" [label=""]
	"136 | CC(C)(C)OC(=O)O" [color=lightblue shape=box style=filled]
	64 -> "136 | CC(C)(C)OC(=O)O" [label=""]
	"137 | Nc1nc(C(O)C(=O)O)cs1" [color=lightblue shape=box style=filled]
	64 -> "137 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"138 | CCC(C)(C)OC(=O)O" [color=lightblue shape=box style=filled]
	64 -> "138 | CCC(C)(C)OC(=O)O" [label=""]
	"139 | O=C(O)C(=O)O" [color=lightyellow shape=box style=filled]
	65 -> "139 | O=C(O)C(=O)O" [label=""]
	"140 | CCC(C)(C)OC(=O)Nc1nccs1" [color=aquamarine shape=box style=filled]
	65 -> "140 | CCC(C)(C)OC(=O)Nc1nccs1" [label=""]
	"141 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	66 -> "141 | O=C1CCC(=O)N1Br" [label=""]
	"142 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [color=aquamarine shape=box style=filled]
	66 -> "142 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [label=""]
	"143 | NC1C(=O)N2C=C(CBr)CS[C@H]12" [color=aquamarine shape=box style=filled]
	67 -> "143 | NC1C(=O)N2C=C(CBr)CS[C@H]12" [label=""]
	"144 | O=C=O" [color=lightyellow shape=box style=filled]
	67 -> "144 | O=C=O" [label=""]
	"145 | NC1C(=O)N[C@@H]1SCC(=CC(=O)O)C(Br)Br" [color=aquamarine shape=box style=filled]
	68 -> "145 | NC1C(=O)N[C@@H]1SCC(=CC(=O)O)C(Br)Br" [label=""]
	"146 | NC(C(=O)O)[C@@H]1NC(C(=O)O)=C(CBr)CS1" [color=aquamarine shape=box style=filled]
	69 -> "146 | NC(C(=O)O)[C@@H]1NC(C(=O)O)=C(CBr)CS1" [label=""]
	"147 | NC1C(=O)N[C@@H]1SCC(CBr)=C(O)C(=O)O" [color=aquamarine shape=box style=filled]
	70 -> "147 | NC1C(=O)N[C@@H]1SCC(CBr)=C(O)C(=O)O" [label=""]
	"148 | NC1C(=O)N[C@@H]1SCC(CBr)=C(Cl)C(=O)O" [color=aquamarine shape=box style=filled]
	71 -> "148 | NC1C(=O)N[C@@H]1SCC(CBr)=C(Cl)C(=O)O" [label=""]
	"149 | NC1C(=O)N[C@@H]1SCC(CBr)C(=O)C(=O)O" [color=aquamarine shape=box style=filled]
	72 -> "149 | NC1C(=O)N[C@@H]1SCC(CBr)C(=O)C(=O)O" [label=""]
	"150 | NC1C(=O)N[C@@H]1SCC(CBr)CC(=O)O" [color=aquamarine shape=box style=filled]
	73 -> "150 | NC1C(=O)N[C@@H]1SCC(CBr)CC(=O)O" [label=""]
	"151 | NC1C(=O)N[C@@H]1SCCCBr" [color=aquamarine shape=box style=filled]
	74 -> "151 | NC1C(=O)N[C@@H]1SCCCBr" [label=""]
	"152 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	74 -> "152 | O=CC(=O)O" [label=""]
	"153 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=aquamarine shape=box style=filled]
	75 -> "153 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"154 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [color=aquamarine shape=box style=filled]
	75 -> "154 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [label=""]
	"155 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=aquamarine shape=box style=filled]
	76 -> "155 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"156 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=aquamarine shape=box style=filled]
	76 -> "156 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"157 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" [color=aquamarine shape=box style=filled]
	77 -> "157 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" [label=""]
	"158 | O=C=O" [color=lightyellow shape=box style=filled]
	77 -> "158 | O=C=O" [label=""]
	"159 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	78 -> "159 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"160 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=aquamarine shape=box style=filled]
	78 -> "160 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"161 | CCC(C)(C)OC(=O)O" [color=lightblue shape=box style=filled]
	78 -> "161 | CCC(C)(C)OC(=O)O" [label=""]
	"162 | Nc1nc(C(O)C(=O)O)cs1" [color=lightblue shape=box style=filled]
	79 -> "162 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"163 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [color=aquamarine shape=box style=filled]
	79 -> "163 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [label=""]
	"164 | CCC(C)(C)OC=O" [color=lightblue shape=box style=filled]
	79 -> "164 | CCC(C)(C)OC=O" [label=""]
	"165 | O=C=O" [color=lightyellow shape=box style=filled]
	80 -> "165 | O=C=O" [label=""]
	"166 | CC(=O)C(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" [color=aquamarine shape=box style=filled]
	80 -> "166 | CC(=O)C(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" [label=""]
	"167 | CCC(C)(C)OC(=O)O" [color=lightblue shape=box style=filled]
	81 -> "167 | CCC(C)(C)OC(=O)O" [label=""]
	"168 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=aquamarine shape=box style=filled]
	81 -> "168 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"169 | CCC(C)(C)OCO" [color=lightblue shape=box style=filled]
	82 -> "169 | CCC(C)(C)OCO" [label=""]
	"170 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=aquamarine shape=box style=filled]
	82 -> "170 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"171 | CC(C)(C)OC(=O)O" [color=lightblue shape=box style=filled]
	83 -> "171 | CC(C)(C)OC(=O)O" [label=""]
	"172 | CCC(C)(C)OC(=O)O" [color=lightblue shape=box style=filled]
	83 -> "172 | CCC(C)(C)OC(=O)O" [label=""]
	"173 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=aquamarine shape=box style=filled]
	83 -> "173 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"174 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=aquamarine shape=box style=filled]
	84 -> "174 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"175 | NC1C(=O)N[C@@H]1S(C=O)=[O+]Br" [color=aquamarine shape=box style=filled]
	84 -> "175 | NC1C(=O)N[C@@H]1S(C=O)=[O+]Br" [label=""]
	"176 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=[O+]Br)cs1" [color=aquamarine shape=box style=filled]
	85 -> "176 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=[O+]Br)cs1" [label=""]
	"177 | O=CO" [color=lightyellow shape=box style=filled]
	85 -> "177 | O=CO" [label=""]
	"178 | [O+][Br+]Cl" [color=aquamarine shape=box style=filled]
	86 -> "178 | [O+][Br+]Cl" [label=""]
	"179 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [color=aquamarine shape=box style=filled]
	86 -> "179 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [label=""]
	"180 | CC(Br)C(C)(C=O)OC(=O)Cl" [color=aquamarine shape=box style=filled]
	87 -> "180 | CC(Br)C(C)(C=O)OC(=O)Cl" [label=""]
	"181 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(C=O)=[O+]Br)cs1" [color=aquamarine shape=box style=filled]
	87 -> "181 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(C=O)=[O+]Br)cs1" [label=""]
	"182 | [O+][Br+]O" [color=aquamarine shape=box style=filled]
	88 -> "182 | [O+][Br+]O" [label=""]
	"183 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [color=aquamarine shape=box style=filled]
	88 -> "183 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [label=""]
	"184 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C=O)cs1" [color=aquamarine shape=box style=filled]
	89 -> "184 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C=O)cs1" [label=""]
	"185 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	89 -> "185 | O=C1CCC(=O)N1Br" [label=""]
	"186 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C=O)cs1" [color=aquamarine shape=box style=filled]
	90 -> "186 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C=O)cs1" [label=""]
	"187 | [O+]Br" [color=aquamarine shape=box style=filled]
	90 -> "187 | [O+]Br" [label=""]
	"188 | [O+][Br+]C(Cl)(Cl)Cl" [color=aquamarine shape=box style=filled]
	91 -> "188 | [O+][Br+]C(Cl)(Cl)Cl" [label=""]
	"189 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [color=aquamarine shape=box style=filled]
	91 -> "189 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [label=""]
	"190 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=[O+]Br)cs1" [color=aquamarine shape=box style=filled]
	92 -> "190 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=[O+]Br)cs1" [label=""]
	"191 | O=CCl" [color=lightblue shape=box style=filled]
	92 -> "191 | O=CCl" [label=""]
	"192 | [O+]Br" [color=aquamarine shape=box style=filled]
	93 -> "192 | [O+]Br" [label=""]
	"193 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S](Cl)C=O)cs1" [color=aquamarine shape=box style=filled]
	93 -> "193 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S](Cl)C=O)cs1" [label=""]
	"194 | CC(=O)Br" [color=lightblue shape=box style=filled]
	94 -> "194 | CC(=O)Br" [label=""]
	"195 | O=C(O)C(Cl)Cl" [color=lightyellow shape=box style=filled]
	94 -> "195 | O=C(O)C(Cl)Cl" [label=""]
	"196 | O=CC(=O)Br" [color=lightblue shape=box style=filled]
	95 -> "196 | O=CC(=O)Br" [label=""]
	"197 | O=C(O)CCl" [color=lightblue shape=box style=filled]
	95 -> "197 | O=C(O)CCl" [label=""]
	"198 | O=C(Br)CCl" [color=lightblue shape=box style=filled]
	96 -> "198 | O=C(Br)CCl" [label=""]
	"199 | O=C(O)CCl" [color=lightblue shape=box style=filled]
	96 -> "199 | O=C(O)CCl" [label=""]
	"200 | CC(=O)Br" [color=lightblue shape=box style=filled]
	97 -> "200 | CC(=O)Br" [label=""]
	"201 | O=C(O)C(=O)Cl" [color=lightblue shape=box style=filled]
	97 -> "201 | O=C(O)C(=O)Cl" [label=""]
	"202 | O=C(Br)CBr" [color=lightyellow shape=box style=filled]
	98 -> "202 | O=C(Br)CBr" [label=""]
	"203 | O=C(O)CCl" [color=lightblue shape=box style=filled]
	98 -> "203 | O=C(O)CCl" [label=""]
	"204 | O=CC(=O)Br" [color=lightblue shape=box style=filled]
	99 -> "204 | O=CC(=O)Br" [label=""]
	"205 | O=C(O)C(Cl)Cl" [color=lightyellow shape=box style=filled]
	99 -> "205 | O=C(O)C(Cl)Cl" [label=""]
	"206 | O=CC(=O)Br" [color=lightblue shape=box style=filled]
	100 -> "206 | O=CC(=O)Br" [label=""]
	"207 | O=C(O)C(=O)Cl" [color=lightblue shape=box style=filled]
	100 -> "207 | O=C(O)C(=O)Cl" [label=""]
	"208 | O=C(O)C=C(Cl)C(=O)[O+]=[O+]O" [color=aquamarine shape=box style=filled]
	101 -> "208 | O=C(O)C=C(Cl)C(=O)[O+]=[O+]O" [label=""]
	"209 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	101 -> "209 | O=C1CCC(=O)N1Br" [label=""]
	"210 | Br[Cl+]Br" [color=aquamarine shape=box style=filled]
	101 -> "210 | Br[Cl+]Br" [label=""]
	"211 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" [color=aquamarine shape=box style=filled]
	102 -> "211 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" [label=""]
	"212 | O=C(O)C(Cl)Cl" [color=lightyellow shape=box style=filled]
	102 -> "212 | O=C(O)C(Cl)Cl" [label=""]
	"213 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=lightblue shape=box style=filled]
	103 -> "213 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"214 | NC1C(=O)N[C@@H]1S(=O)C(=O)C(C(=O)Br)=C(Cl)C(=O)O" [color=aquamarine shape=box style=filled]
	103 -> "214 | NC1C(=O)N[C@@H]1S(=O)C(=O)C(C(=O)Br)=C(Cl)C(=O)O" [label=""]
	"215 | O=C(O)CCl" [color=lightblue shape=box style=filled]
	104 -> "215 | O=C(O)CCl" [label=""]
	"216 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(=O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" [color=aquamarine shape=box style=filled]
	104 -> "216 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(=O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" [label=""]
	"217 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" [color=aquamarine shape=box style=filled]
	105 -> "217 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" [label=""]
	"218 | O=C(O)C(=O)Cl" [color=lightblue shape=box style=filled]
	105 -> "218 | O=C(O)C(=O)Cl" [label=""]
	"219 | CC(=O)C(C)(C=O)OC(=O)Cl" [color=lightblue shape=box style=filled]
	106 -> "219 | CC(=O)C(C)(C=O)OC(=O)Cl" [label=""]
	"220 | O=C(O)CCl" [color=lightblue shape=box style=filled]
	106 -> "220 | O=C(O)CCl" [label=""]
	"221 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" [color=aquamarine shape=box style=filled]
	106 -> "221 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" [label=""]
	"222 | CC(=O)C(C)(C=O)OC(=O)Cl" [color=lightblue shape=box style=filled]
	107 -> "222 | CC(=O)C(C)(C=O)OC(=O)Cl" [label=""]
	"223 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)C(C(=O)Br)=C(Cl)C(=O)O)cs1" [color=aquamarine shape=box style=filled]
	107 -> "223 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)C(C(=O)Br)=C(Cl)C(=O)O)cs1" [label=""]
	"224 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" [color=aquamarine shape=box style=filled]
	108 -> "224 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" [label=""]
	"225 | O=C(O)C(Cl)Br" [color=lightyellow shape=box style=filled]
	108 -> "225 | O=C(O)C(Cl)Br" [label=""]
	"226 | [NH]c1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=[O+])C(=O)[C]C(=O)Br)cs1" [color=aquamarine shape=box style=filled]
	109 -> "226 | [NH]c1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=[O+])C(=O)[C]C(=O)Br)cs1" [label=""]
	"227 | O=C(O)[C]Cl" [color=lightblue shape=box style=filled]
	109 -> "227 | O=C(O)[C]Cl" [label=""]
	"228 | CC(=O)C(C)(C=O)O[C]=O" [color=lightblue shape=box style=filled]
	109 -> "228 | CC(=O)C(C)(C=O)O[C]=O" [label=""]
	"229 | O=C(O)CCl" [color=lightblue shape=box style=filled]
	110 -> "229 | O=C(O)CCl" [label=""]
	"230 | CC(=O)C(C)(C=O)OC(=O)OC(=O)OC(C)(C)C" [color=aquamarine shape=box style=filled]
	110 -> "230 | CC(=O)C(C)(C=O)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"231 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" [color=aquamarine shape=box style=filled]
	110 -> "231 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" [label=""]
	"232 | O=C(O)CCl" [color=lightblue shape=box style=filled]
	111 -> "232 | O=C(O)CCl" [label=""]
	"233 | CC(=O)C(C)(C=O)OC(=O)O" [color=lightblue shape=box style=filled]
	111 -> "233 | CC(=O)C(C)(C=O)OC(=O)O" [label=""]
	"234 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" [color=aquamarine shape=box style=filled]
	111 -> "234 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" [label=""]
	"235 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	112 -> "235 | O=C1CCC(=O)N1Br" [label=""]
	"236 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [color=aquamarine shape=box style=filled]
	112 -> "236 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [label=""]
	"237 | NC1C(=O)N2C=C(CBr)CS[C@H]12" [color=aquamarine shape=box style=filled]
	113 -> "237 | NC1C(=O)N2C=C(CBr)CS[C@H]12" [label=""]
	"238 | O=C=O" [color=lightyellow shape=box style=filled]
	113 -> "238 | O=C=O" [label=""]
	"239 | NC1C(=O)N[C@@H]1SCC(=CC(=O)O)C(Br)Br" [color=aquamarine shape=box style=filled]
	114 -> "239 | NC1C(=O)N[C@@H]1SCC(=CC(=O)O)C(Br)Br" [label=""]
	"240 | NC(C(=O)O)[C@@H]1NC(C(=O)O)=C(CBr)CS1" [color=aquamarine shape=box style=filled]
	115 -> "240 | NC(C(=O)O)[C@@H]1NC(C(=O)O)=C(CBr)CS1" [label=""]
	"241 | NC1C(=O)N[C@@H]1SCC(CBr)=C(O)C(=O)O" [color=aquamarine shape=box style=filled]
	116 -> "241 | NC1C(=O)N[C@@H]1SCC(CBr)=C(O)C(=O)O" [label=""]
	"242 | NC1C(=O)N[C@@H]1SCC(CBr)=C(Cl)C(=O)O" [color=aquamarine shape=box style=filled]
	117 -> "242 | NC1C(=O)N[C@@H]1SCC(CBr)=C(Cl)C(=O)O" [label=""]
	"243 | NC1C(=O)N[C@@H]1SCC(CBr)C(=O)C(=O)O" [color=aquamarine shape=box style=filled]
	118 -> "243 | NC1C(=O)N[C@@H]1SCC(CBr)C(=O)C(=O)O" [label=""]
	"244 | NC1C(=O)N[C@@H]1SCC(CBr)CC(=O)O" [color=aquamarine shape=box style=filled]
	119 -> "244 | NC1C(=O)N[C@@H]1SCC(CBr)CC(=O)O" [label=""]
	"245 | NC1C(=O)N[C@@H]1SCCCBr" [color=aquamarine shape=box style=filled]
	120 -> "245 | NC1C(=O)N[C@@H]1SCCCBr" [label=""]
	"246 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	120 -> "246 | O=CC(=O)O" [label=""]
	"247 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	121 -> "247 | O=C1CCC(=O)N1Br" [label=""]
	"248 | Cc1nnc(S)s1" [color=lightyellow shape=box style=filled]
	121 -> "248 | Cc1nnc(S)s1" [label=""]
	"249 | BrSBr" [color=aquamarine shape=box style=filled]
	122 -> "249 | BrSBr" [label=""]
	"250 | Cc1nncs1" [color=lightblue shape=box style=filled]
	122 -> "250 | Cc1nncs1" [label=""]
	"251 | Cc1nnc(Br)s1" [color=lightyellow shape=box style=filled]
	123 -> "251 | Cc1nnc(Br)s1" [label=""]
	"252 | SBr" [color=aquamarine shape=box style=filled]
	123 -> "252 | SBr" [label=""]
	"253 | NN=C=[S]Br" [color=aquamarine shape=box style=filled]
	124 -> "253 | NN=C=[S]Br" [label=""]
	"254 | CC[SH](=O)=O" [color=lightblue shape=box style=filled]
	124 -> "254 | CC[SH](=O)=O" [label=""]
	"255 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	124 -> "255 | O=C1CCC(=O)N1Br" [label=""]
	"256 | CC1=C(C(=O)O)N[C@@H](C(N)C(=O)O)SC1" [color=aquamarine shape=box style=filled]
	125 -> "256 | CC1=C(C(=O)O)N[C@@H](C(N)C(=O)O)SC1" [label=""]
	"257 | O=C=O" [color=lightyellow shape=box style=filled]
	126 -> "257 | O=C=O" [label=""]
	"258 | CC1=CN2C(=O)C(N)[C@H]2SC1" [color=lightblue shape=box style=filled]
	126 -> "258 | CC1=CN2C(=O)C(N)[C@H]2SC1" [label=""]
	"259 | CC(CS[C@H]1NC(=O)C1N)CC(=O)O" [color=lightgrey shape=box style=filled]
	127 -> "259 | CC(CS[C@H]1NC(=O)C1N)CC(=O)O" [label=""]
	"260 | CC(CS[C@H]1NC(=O)C1N)C(=O)C(=O)O" [color=lightgrey shape=box style=filled]
	128 -> "260 | CC(CS[C@H]1NC(=O)C1N)C(=O)C(=O)O" [label=""]
	"261 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)OC(C)(C)C)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	129 -> "261 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)OC(C)(C)C)[C@H]2SC1" [label=""]
	"262 | CCCS[C@H]1NC(=O)C1N" [color=lightgrey shape=box style=filled]
	130 -> "262 | CCCS[C@H]1NC(=O)C1N" [label=""]
	"263 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	130 -> "263 | O=CC(=O)O" [label=""]
	"264 | C[C]CS[C@H]1[N]C(=O)C1N" [color=lightgrey shape=box style=filled]
	131 -> "264 | C[C]CS[C@H]1[N]C(=O)C1N" [label=""]
	"265 | [C]C(=O)O" [color=lightgrey shape=box style=filled]
	131 -> "265 | [C]C(=O)O" [label=""]
	"266 | CCCS[C@H]1NC(=O)C1N" [color=lightgrey shape=box style=filled]
	132 -> "266 | CCCS[C@H]1NC(=O)C1N" [label=""]
	"267 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	132 -> "267 | O=C(O)CO" [label=""]
	"268 | CCCS[C@@H]1C(NC(=O)OC(C)(C)C)C(=O)N1CC(=O)O" [color=lightgrey shape=box style=filled]
	133 -> "268 | CCCS[C@@H]1C(NC(=O)OC(C)(C)C)C(=O)N1CC(=O)O" [label=""]
	"269 | CCCS[C@@H]1C(N)C(=O)N1C(O)C(=O)O" [color=lightgrey shape=box style=filled]
	134 -> "269 | CCCS[C@@H]1C(N)C(=O)N1C(O)C(=O)O" [label=""]
	"270 | Cc1nnc(S)s1" [color=lightyellow shape=box style=filled]
	135 -> "270 | Cc1nnc(S)s1" [label=""]
	"271 | NC1C(=O)[N+][C@@H]1SCC(=CC(=O)O)CBr" [color=lightgrey shape=box style=filled]
	135 -> "271 | NC1C(=O)[N+][C@@H]1SCC(=CC(=O)O)CBr" [label=""]
	"272 | Cc1nnc(SCC(=CC(=O)O)CS[C@@H]([N+])C(N)C(=O)O)s1" [color=lightgrey shape=box style=filled]
	136 -> "272 | Cc1nnc(SCC(=CC(=O)O)CS[C@@H]([N+])C(N)C(=O)O)s1" [label=""]
	"273 | CC(=CC(=O)O)CS[C@H]1[N+]C(=O)C1NC(=O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	137 -> "273 | CC(=CC(=O)O)CS[C@H]1[N+]C(=O)C1NC(=O)OC(C)(C)C" [label=""]
	"274 | Cc1nnc(S)s1" [color=lightyellow shape=box style=filled]
	137 -> "274 | Cc1nnc(S)s1" [label=""]
	"275 | CC(C)(C)OC(=O)NC1C[N+]C1=O" [color=lightgrey shape=box style=filled]
	138 -> "275 | CC(C)(C)OC(=O)NC1C[N+]C1=O" [label=""]
	"276 | Cc1nnc(SCC(=CC(=O)O)CS)s1" [color=lightgrey shape=box style=filled]
	138 -> "276 | Cc1nnc(SCC(=CC(=O)O)CS)s1" [label=""]
	"277 | Cc1nnc(SCC(=CC(=O)O)CS[C@@H]2CC(=O)[N+]2)s1" [color=lightgrey shape=box style=filled]
	139 -> "277 | Cc1nnc(SCC(=CC(=O)O)CS[C@@H]2CC(=O)[N+]2)s1" [label=""]
	"278 | CC(C)(C)OC(N)=O" [color=lightyellow shape=box style=filled]
	139 -> "278 | CC(C)(C)OC(N)=O" [label=""]
	"279 | NC1C(=O)[N+][C@@H]1SCC(=CC(=O)O)CO" [color=lightgrey shape=box style=filled]
	140 -> "279 | NC1C(=O)[N+][C@@H]1SCC(=CC(=O)O)CO" [label=""]
	"280 | Cc1nnc(S)s1" [color=lightyellow shape=box style=filled]
	140 -> "280 | Cc1nnc(S)s1" [label=""]
	"281 | Cc1nnc(Br)s1" [color=lightyellow shape=box style=filled]
	141 -> "281 | Cc1nnc(Br)s1" [label=""]
	"282 | NC1C(=O)[N+][C@@H]1SCC(=CC(=O)O)CS" [color=lightgrey shape=box style=filled]
	141 -> "282 | NC1C(=O)[N+][C@@H]1SCC(=CC(=O)O)CS" [label=""]
	"283 | NC1C(=O)[N+][C@@H]1SCC(=CC(=O)O)CCl" [color=lightgrey shape=box style=filled]
	142 -> "283 | NC1C(=O)[N+][C@@H]1SCC(=CC(=O)O)CCl" [label=""]
	"284 | Cc1nnc(S)s1" [color=lightyellow shape=box style=filled]
	142 -> "284 | Cc1nnc(S)s1" [label=""]
	"285 | CC(C)(C)OC(=O)NC1C(=O)[N+][C@@H]1SCC(=CC(=O)O)CS" [color=lightgrey shape=box style=filled]
	143 -> "285 | CC(C)(C)OC(=O)NC1C(=O)[N+][C@@H]1SCC(=CC(=O)O)CS" [label=""]
	"286 | Cc1nncs1" [color=lightgrey shape=box style=filled]
	143 -> "286 | Cc1nncs1" [label=""]
	"287 | NC1C(=O)[N+][C@@H]1SCC(C=O)=CC(=O)O" [color=lightgrey shape=box style=filled]
	144 -> "287 | NC1C(=O)[N+][C@@H]1SCC(C=O)=CC(=O)O" [label=""]
	"288 | Cc1nnc(S)s1" [color=lightyellow shape=box style=filled]
	144 -> "288 | Cc1nnc(S)s1" [label=""]
	"289 | ClC(Cl)(Cl)Cl" [color=lightyellow shape=box style=filled]
	145 -> "289 | ClC(Cl)(Cl)Cl" [label=""]
	"290 | Br" [color=lightyellow shape=box style=filled]
	145 -> "290 | Br" [label=""]
	"291 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	146 -> "291 | O=C1CCC(=O)N1Br" [label=""]
	"292 | Cl" [color=lightyellow shape=box style=filled]
	146 -> "292 | Cl" [label=""]
	"293 | O=C1CCC(=O)N1Cl" [color=lightyellow shape=box style=filled]
	147 -> "293 | O=C1CCC(=O)N1Cl" [label=""]
	"294 | Br" [color=lightyellow shape=box style=filled]
	147 -> "294 | Br" [label=""]
	"295 | BrC(Br)(Br)Br" [color=lightyellow shape=box style=filled]
	148 -> "295 | BrC(Br)(Br)Br" [label=""]
	"296 | Cl" [color=lightyellow shape=box style=filled]
	148 -> "296 | Cl" [label=""]
	"297 | BrC(Br)(Br)Br" [color=lightyellow shape=box style=filled]
	149 -> "297 | BrC(Br)(Br)Br" [label=""]
	"298 | OCl" [color=lightyellow shape=box style=filled]
	149 -> "298 | OCl" [label=""]
	"299 | BrC(Br)(Br)Br" [color=lightyellow shape=box style=filled]
	150 -> "299 | BrC(Br)(Br)Br" [label=""]
	"300 | CCCl" [color=lightgrey shape=box style=filled]
	150 -> "300 | CCCl" [label=""]
	"301 | BrC(Br)(Br)Br" [color=lightyellow shape=box style=filled]
	151 -> "301 | BrC(Br)(Br)Br" [label=""]
	"302 | O=C(OCl)c1cccc(Cl)c1" [color=lightgrey shape=box style=filled]
	151 -> "302 | O=C(OCl)c1cccc(Cl)c1" [label=""]
	"303 | BrC(Br)(Br)Br" [color=lightyellow shape=box style=filled]
	152 -> "303 | BrC(Br)(Br)Br" [label=""]
	"304 | [Cl]" [color=lightyellow shape=box style=filled]
	152 -> "304 | [Cl]" [label=""]
	"305 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	153 -> "305 | Nc1nccs1" [label=""]
	"306 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	153 -> "306 | O=CC(=O)O" [label=""]
	"307 | Nc1nc(CO)cs1" [color=lightyellow shape=box style=filled]
	154 -> "307 | Nc1nc(CO)cs1" [label=""]
	"308 | O=C=O" [color=lightyellow shape=box style=filled]
	154 -> "308 | O=C=O" [label=""]
	"309 | O=C(O)C(=O)O" [color=lightyellow shape=box style=filled]
	155 -> "309 | O=C(O)C(=O)O" [label=""]
	"310 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	155 -> "310 | Nc1nccs1" [label=""]
	"311 | O=C(O)C(O)c1csc([N+](=O)[O-])n1" [color=lightgrey shape=box style=filled]
	156 -> "311 | O=C(O)C(O)c1csc([N+](=O)[O-])n1" [label=""]
	"312 | Nc1nc(Br)cs1" [color=lightyellow shape=box style=filled]
	157 -> "312 | Nc1nc(Br)cs1" [label=""]
	"313 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	157 -> "313 | O=C(O)CO" [label=""]
	"314 | Nc1nc(C(=O)C(=O)O)cs1" [color=lightyellow shape=box style=filled]
	158 -> "314 | Nc1nc(C(=O)C(=O)O)cs1" [label=""]
	"315 | O" [color=lightyellow shape=box style=filled]
	158 -> "315 | O" [label=""]
	"316 | Nc1nc(Cl)cs1" [color=lightyellow shape=box style=filled]
	159 -> "316 | Nc1nc(Cl)cs1" [label=""]
	"317 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	159 -> "317 | O=C(O)CO" [label=""]
	"318 | O=CO" [color=lightyellow shape=box style=filled]
	160 -> "318 | O=CO" [label=""]
	"319 | Nc1nc(C=O)cs1" [color=lightyellow shape=box style=filled]
	160 -> "319 | Nc1nc(C=O)cs1" [label=""]
	"320 | O=C(O)C(O)c1csc(N[O-])n1" [color=lightgrey shape=box style=filled]
	161 -> "320 | O=C(O)C(O)c1csc(N[O-])n1" [label=""]
	"321 | Nc1nc(C(=O)C(=O)O)cs1" [color=lightyellow shape=box style=filled]
	162 -> "321 | Nc1nc(C(=O)C(=O)O)cs1" [label=""]
	"322 | OO" [color=lightyellow shape=box style=filled]
	162 -> "322 | OO" [label=""]
	"323 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	163 -> "323 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"324 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	163 -> "324 | CCC(C)(C)OC(=O)O" [label=""]
	"325 | CC(C)(C)OC(=O)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	164 -> "325 | CC(C)(C)OC(=O)OC(=O)Cl" [label=""]
	"326 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	164 -> "326 | CCC(C)(C)O" [label=""]
	"327 | CC(C)(C)OC(=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	165 -> "327 | CC(C)(C)OC(=O)OC(=O)O" [label=""]
	"328 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	165 -> "328 | CCC(C)(C)O" [label=""]
	"329 | CCC(C)(C)OC(=O)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	166 -> "329 | CCC(C)(C)OC(=O)OC(=O)Cl" [label=""]
	"330 | CC(C)(C)O" [color=lightyellow shape=box style=filled]
	166 -> "330 | CC(C)(C)O" [label=""]
	"331 | CC(C)(C)OC(=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	167 -> "331 | CC(C)(C)OC(=O)OC(=O)O" [label=""]
	"332 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	167 -> "332 | CCC(C)(C)O" [label=""]
	"333 | CC(C)(C)OC(=O)O[C]=O" [color=lightgrey shape=box style=filled]
	168 -> "333 | CC(C)(C)OC(=O)O[C]=O" [label=""]
	"334 | CCC(C)(C)[O]" [color=lightgrey shape=box style=filled]
	168 -> "334 | CCC(C)(C)[O]" [label=""]
	"335 | CC(C)(C)O" [color=lightyellow shape=box style=filled]
	169 -> "335 | CC(C)(C)O" [label=""]
	"336 | CCC(C)(C)OC(=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	169 -> "336 | CCC(C)(C)OC(=O)OC(=O)O" [label=""]
	"337 | CC(C)(C)OC(=O)OC=O" [color=lightgrey shape=box style=filled]
	170 -> "337 | CC(C)(C)OC(=O)OC=O" [label=""]
	"338 | CC(Br)C(C)(C)O" [color=lightyellow shape=box style=filled]
	170 -> "338 | CC(Br)C(C)(C)O" [label=""]
	"339 | CC(C)(C)OC(=O)OC(=O)Br" [color=lightgrey shape=box style=filled]
	171 -> "339 | CC(C)(C)OC(=O)OC(=O)Br" [label=""]
	"340 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	171 -> "340 | CCC(C)(C)O" [label=""]
	"341 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	172 -> "341 | Nc1nccs1" [label=""]
	"342 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	172 -> "342 | O=CC(=O)O" [label=""]
	"343 | Nc1nc(CO)cs1" [color=lightyellow shape=box style=filled]
	173 -> "343 | Nc1nc(CO)cs1" [label=""]
	"344 | O=C=O" [color=lightyellow shape=box style=filled]
	173 -> "344 | O=C=O" [label=""]
	"345 | O=C(O)C(=O)O" [color=lightyellow shape=box style=filled]
	174 -> "345 | O=C(O)C(=O)O" [label=""]
	"346 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	174 -> "346 | Nc1nccs1" [label=""]
	"347 | O=C(O)C(O)c1csc([N+](=O)[O-])n1" [color=lightgrey shape=box style=filled]
	175 -> "347 | O=C(O)C(O)c1csc([N+](=O)[O-])n1" [label=""]
	"348 | Nc1nc(Br)cs1" [color=lightyellow shape=box style=filled]
	176 -> "348 | Nc1nc(Br)cs1" [label=""]
	"349 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	176 -> "349 | O=C(O)CO" [label=""]
	"350 | Nc1nc(C(=O)C(=O)O)cs1" [color=lightyellow shape=box style=filled]
	177 -> "350 | Nc1nc(C(=O)C(=O)O)cs1" [label=""]
	"351 | O" [color=lightyellow shape=box style=filled]
	177 -> "351 | O" [label=""]
	"352 | Nc1nc(Cl)cs1" [color=lightyellow shape=box style=filled]
	178 -> "352 | Nc1nc(Cl)cs1" [label=""]
	"353 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	178 -> "353 | O=C(O)CO" [label=""]
	"354 | O=CO" [color=lightyellow shape=box style=filled]
	179 -> "354 | O=CO" [label=""]
	"355 | Nc1nc(C=O)cs1" [color=lightyellow shape=box style=filled]
	179 -> "355 | Nc1nc(C=O)cs1" [label=""]
	"356 | O=C(O)C(O)c1csc(N[O-])n1" [color=lightgrey shape=box style=filled]
	180 -> "356 | O=C(O)C(O)c1csc(N[O-])n1" [label=""]
	"357 | Nc1nc(C(=O)C(=O)O)cs1" [color=lightyellow shape=box style=filled]
	181 -> "357 | Nc1nc(C(=O)C(=O)O)cs1" [label=""]
	"358 | OO" [color=lightyellow shape=box style=filled]
	181 -> "358 | OO" [label=""]
	"359 | O=C=O" [color=lightyellow shape=box style=filled]
	182 -> "359 | O=C=O" [label=""]
	"360 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	182 -> "360 | CCC(C)(C)O" [label=""]
	"361 | O=C(O)O" [color=lightyellow shape=box style=filled]
	183 -> "361 | O=C(O)O" [label=""]
	"362 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	183 -> "362 | CCC(C)(C)O" [label=""]
	"363 | CCC(C)(C)Cl" [color=lightyellow shape=box style=filled]
	184 -> "363 | CCC(C)(C)Cl" [label=""]
	"364 | O=C(O)O" [color=lightyellow shape=box style=filled]
	184 -> "364 | O=C(O)O" [label=""]
	"365 | CC(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	185 -> "365 | CC(C)OC(=O)O" [label=""]
	"366 | CCI" [color=lightyellow shape=box style=filled]
	185 -> "366 | CCI" [label=""]
	"367 | O=C(O)O" [color=lightyellow shape=box style=filled]
	186 -> "367 | O=C(O)O" [label=""]
	"368 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	186 -> "368 | CCC(C)(C)O" [label=""]
	"369 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	187 -> "369 | O=C(O)Cl" [label=""]
	"370 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	187 -> "370 | CCC(C)(C)O" [label=""]
	"371 | CCO" [color=lightyellow shape=box style=filled]
	188 -> "371 | CCO" [label=""]
	"372 | CC(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	188 -> "372 | CC(C)OC(=O)O" [label=""]
	"373 | CCOP(=O)(OCC)OC(=O)OC(C)C" [color=lightgrey shape=box style=filled]
	189 -> "373 | CCOP(=O)(OCC)OC(=O)OC(C)C" [label=""]
	"374 | CCI" [color=lightyellow shape=box style=filled]
	189 -> "374 | CCI" [label=""]
	"375 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	190 -> "375 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"376 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	190 -> "376 | Nc1nccs1" [label=""]
	"377 | CCC(C)(C)OC(N)=O" [color=lightgrey shape=box style=filled]
	191 -> "377 | CCC(C)(C)OC(N)=O" [label=""]
	"378 | Brc1nccs1" [color=lightyellow shape=box style=filled]
	191 -> "378 | Brc1nccs1" [label=""]
	"379 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	192 -> "379 | Nc1nccs1" [label=""]
	"380 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	192 -> "380 | CCC(C)(C)OC(=O)O" [label=""]
	"381 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	193 -> "381 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"382 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	193 -> "382 | Nc1nccs1" [label=""]
	"383 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	193 -> "383 | CCC(C)(C)OC(=O)O" [label=""]
	"384 | CC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	194 -> "384 | CC(C)(C)OC(=O)O" [label=""]
	"385 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	194 -> "385 | Nc1nccs1" [label=""]
	"386 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	194 -> "386 | CCC(C)(C)OC(=O)O" [label=""]
	"387 | CCC(C)(C)OC(N)=O" [color=lightgrey shape=box style=filled]
	195 -> "387 | CCC(C)(C)OC(N)=O" [label=""]
	"388 | Clc1nccs1" [color=lightyellow shape=box style=filled]
	195 -> "388 | Clc1nccs1" [label=""]
	"389 | CC(C)(C)OC(=O)Cl" [color=lightyellow shape=box style=filled]
	196 -> "389 | CC(C)(C)OC(=O)Cl" [label=""]
	"390 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	196 -> "390 | Nc1nccs1" [label=""]
	"391 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	196 -> "391 | CCC(C)(C)OC(=O)O" [label=""]
	"392 | CC(C)(CC=O)OC(N)=O" [color=lightgrey shape=box style=filled]
	197 -> "392 | CC(C)(CC=O)OC(N)=O" [label=""]
	"393 | Brc1nccs1" [color=lightyellow shape=box style=filled]
	197 -> "393 | Brc1nccs1" [label=""]
	"394 | CC(C)(C)O[C]=O" [color=lightgrey shape=box style=filled]
	198 -> "394 | CC(C)(C)O[C]=O" [label=""]
	"395 | CCC(C)(C)OC([O])=O" [color=lightgrey shape=box style=filled]
	198 -> "395 | CCC(C)(C)OC([O])=O" [label=""]
	"396 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	198 -> "396 | Nc1nccs1" [label=""]
	"397 | CC(C)(C)O[C]=O" [color=lightgrey shape=box style=filled]
	199 -> "397 | CC(C)(C)O[C]=O" [label=""]
	"398 | CCC(C)(C)OC([O])=O" [color=lightgrey shape=box style=filled]
	199 -> "398 | CCC(C)(C)OC([O])=O" [label=""]
	"399 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	199 -> "399 | Nc1nccs1" [label=""]
	"400 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	200 -> "400 | Nc1nccs1" [label=""]
	"401 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	200 -> "401 | O=CC(=O)O" [label=""]
	"402 | Nc1nc(CO)cs1" [color=lightyellow shape=box style=filled]
	201 -> "402 | Nc1nc(CO)cs1" [label=""]
	"403 | O=C=O" [color=lightyellow shape=box style=filled]
	201 -> "403 | O=C=O" [label=""]
	"404 | O=C(O)C(=O)O" [color=lightyellow shape=box style=filled]
	202 -> "404 | O=C(O)C(=O)O" [label=""]
	"405 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	202 -> "405 | Nc1nccs1" [label=""]
	"406 | O=C(O)C(O)c1csc([N+](=O)[O-])n1" [color=lightgrey shape=box style=filled]
	203 -> "406 | O=C(O)C(O)c1csc([N+](=O)[O-])n1" [label=""]
	"407 | Nc1nc(Br)cs1" [color=lightyellow shape=box style=filled]
	204 -> "407 | Nc1nc(Br)cs1" [label=""]
	"408 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	204 -> "408 | O=C(O)CO" [label=""]
	"409 | Nc1nc(C(=O)C(=O)O)cs1" [color=lightyellow shape=box style=filled]
	205 -> "409 | Nc1nc(C(=O)C(=O)O)cs1" [label=""]
	"410 | O" [color=lightyellow shape=box style=filled]
	205 -> "410 | O" [label=""]
	"411 | Nc1nc(Cl)cs1" [color=lightyellow shape=box style=filled]
	206 -> "411 | Nc1nc(Cl)cs1" [label=""]
	"412 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	206 -> "412 | O=C(O)CO" [label=""]
	"413 | O=CO" [color=lightyellow shape=box style=filled]
	207 -> "413 | O=CO" [label=""]
	"414 | Nc1nc(C=O)cs1" [color=lightyellow shape=box style=filled]
	207 -> "414 | Nc1nc(C=O)cs1" [label=""]
	"415 | O=C(O)C(O)c1csc(N[O-])n1" [color=lightgrey shape=box style=filled]
	208 -> "415 | O=C(O)C(O)c1csc(N[O-])n1" [label=""]
	"416 | Nc1nc(C(=O)C(=O)O)cs1" [color=lightyellow shape=box style=filled]
	209 -> "416 | Nc1nc(C(=O)C(=O)O)cs1" [label=""]
	"417 | OO" [color=lightyellow shape=box style=filled]
	209 -> "417 | OO" [label=""]
	"418 | O=C=O" [color=lightyellow shape=box style=filled]
	210 -> "418 | O=C=O" [label=""]
	"419 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	210 -> "419 | CCC(C)(C)O" [label=""]
	"420 | O=C(O)O" [color=lightyellow shape=box style=filled]
	211 -> "420 | O=C(O)O" [label=""]
	"421 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	211 -> "421 | CCC(C)(C)O" [label=""]
	"422 | CCC(C)(C)Cl" [color=lightyellow shape=box style=filled]
	212 -> "422 | CCC(C)(C)Cl" [label=""]
	"423 | O=C(O)O" [color=lightyellow shape=box style=filled]
	212 -> "423 | O=C(O)O" [label=""]
	"424 | CC(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	213 -> "424 | CC(C)OC(=O)O" [label=""]
	"425 | CCI" [color=lightyellow shape=box style=filled]
	213 -> "425 | CCI" [label=""]
	"426 | O=C(O)O" [color=lightyellow shape=box style=filled]
	214 -> "426 | O=C(O)O" [label=""]
	"427 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	214 -> "427 | CCC(C)(C)O" [label=""]
	"428 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	215 -> "428 | O=C(O)Cl" [label=""]
	"429 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	215 -> "429 | CCC(C)(C)O" [label=""]
	"430 | CCO" [color=lightyellow shape=box style=filled]
	216 -> "430 | CCO" [label=""]
	"431 | CC(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	216 -> "431 | CC(C)OC(=O)O" [label=""]
	"432 | CCOP(=O)(OCC)OC(=O)OC(C)C" [color=lightgrey shape=box style=filled]
	217 -> "432 | CCOP(=O)(OCC)OC(=O)OC(C)C" [label=""]
	"433 | CCI" [color=lightyellow shape=box style=filled]
	217 -> "433 | CCI" [label=""]
	"434 | NC(=O)Cl" [color=lightgrey shape=box style=filled]
	218 -> "434 | NC(=O)Cl" [label=""]
	"435 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	218 -> "435 | CCC(C)(C)O" [label=""]
	"436 | NC(=O)O" [color=lightyellow shape=box style=filled]
	219 -> "436 | NC(=O)O" [label=""]
	"437 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	219 -> "437 | CCC(C)(C)O" [label=""]
	"438 | NC(=O)O" [color=lightyellow shape=box style=filled]
	220 -> "438 | NC(=O)O" [label=""]
	"439 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	220 -> "439 | CCC(C)(C)O" [label=""]
	"440 | NC=O" [color=lightyellow shape=box style=filled]
	221 -> "440 | NC=O" [label=""]
	"441 | O" [color=lightyellow shape=box style=filled]
	221 -> "441 | O" [label=""]
	"442 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	221 -> "442 | CCC(C)(C)O" [label=""]
	"443 | CCI" [color=lightyellow shape=box style=filled]
	222 -> "443 | CCI" [label=""]
	"444 | CC(C)OC(N)=O" [color=lightyellow shape=box style=filled]
	222 -> "444 | CC(C)OC(N)=O" [label=""]
	"445 | CCC(C)(C)Cl" [color=lightyellow shape=box style=filled]
	223 -> "445 | CCC(C)(C)Cl" [label=""]
	"446 | NC(=O)O" [color=lightyellow shape=box style=filled]
	223 -> "446 | NC(=O)O" [label=""]
	"447 | NC=O" [color=lightyellow shape=box style=filled]
	224 -> "447 | NC=O" [label=""]
	"448 | CC(Br)C(C)(C)O" [color=lightyellow shape=box style=filled]
	224 -> "448 | CC(Br)C(C)(C)O" [label=""]
	"449 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	225 -> "449 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"450 | N" [color=lightyellow shape=box style=filled]
	225 -> "450 | N" [label=""]
	"451 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	226 -> "451 | O=C1CCC(=O)N1Br" [label=""]
	"452 | NC=O" [color=lightyellow shape=box style=filled]
	226 -> "452 | NC=O" [label=""]
	"453 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	226 -> "453 | CCC(C)(C)O" [label=""]
	"454 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	227 -> "454 | Nc1nccs1" [label=""]
	"455 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	227 -> "455 | O=CC(=O)O" [label=""]
	"456 | Nc1nc(CO)cs1" [color=lightyellow shape=box style=filled]
	228 -> "456 | Nc1nc(CO)cs1" [label=""]
	"457 | O=C=O" [color=lightyellow shape=box style=filled]
	228 -> "457 | O=C=O" [label=""]
	"458 | O=C(O)C(=O)O" [color=lightyellow shape=box style=filled]
	229 -> "458 | O=C(O)C(=O)O" [label=""]
	"459 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	229 -> "459 | Nc1nccs1" [label=""]
	"460 | O=C(O)C(O)c1csc([N+](=O)[O-])n1" [color=lightgrey shape=box style=filled]
	230 -> "460 | O=C(O)C(O)c1csc([N+](=O)[O-])n1" [label=""]
	"461 | Nc1nc(Br)cs1" [color=lightyellow shape=box style=filled]
	231 -> "461 | Nc1nc(Br)cs1" [label=""]
	"462 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	231 -> "462 | O=C(O)CO" [label=""]
	"463 | Nc1nc(C(=O)C(=O)O)cs1" [color=lightyellow shape=box style=filled]
	232 -> "463 | Nc1nc(C(=O)C(=O)O)cs1" [label=""]
	"464 | O" [color=lightyellow shape=box style=filled]
	232 -> "464 | O" [label=""]
	"465 | Nc1nc(Cl)cs1" [color=lightyellow shape=box style=filled]
	233 -> "465 | Nc1nc(Cl)cs1" [label=""]
	"466 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	233 -> "466 | O=C(O)CO" [label=""]
	"467 | O=CO" [color=lightyellow shape=box style=filled]
	234 -> "467 | O=CO" [label=""]
	"468 | Nc1nc(C=O)cs1" [color=lightyellow shape=box style=filled]
	234 -> "468 | Nc1nc(C=O)cs1" [label=""]
	"469 | O=C(O)C(O)c1csc(N[O-])n1" [color=lightgrey shape=box style=filled]
	235 -> "469 | O=C(O)C(O)c1csc(N[O-])n1" [label=""]
	"470 | Nc1nc(C(=O)C(=O)O)cs1" [color=lightyellow shape=box style=filled]
	236 -> "470 | Nc1nc(C(=O)C(=O)O)cs1" [label=""]
	"471 | OO" [color=lightyellow shape=box style=filled]
	236 -> "471 | OO" [label=""]
	"472 | C=O" [color=lightyellow shape=box style=filled]
	237 -> "472 | C=O" [label=""]
	"473 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	237 -> "473 | CCC(C)(C)O" [label=""]
	"474 | O=CO" [color=lightyellow shape=box style=filled]
	238 -> "474 | O=CO" [label=""]
	"475 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	238 -> "475 | CCC(C)(C)O" [label=""]
	"476 | OCO" [color=lightyellow shape=box style=filled]
	239 -> "476 | OCO" [label=""]
	"477 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	239 -> "477 | CCC(C)(C)O" [label=""]
	"478 | CCC(C)(C)Cl" [color=lightyellow shape=box style=filled]
	240 -> "478 | CCC(C)(C)Cl" [label=""]
	"479 | OCO" [color=lightyellow shape=box style=filled]
	240 -> "479 | OCO" [label=""]
	"480 | CO" [color=lightyellow shape=box style=filled]
	241 -> "480 | CO" [label=""]
	"481 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	241 -> "481 | CCC(C)(C)O" [label=""]
	"482 | CO" [color=lightyellow shape=box style=filled]
	242 -> "482 | CO" [label=""]
	"483 | O" [color=lightyellow shape=box style=filled]
	242 -> "483 | O" [label=""]
	"484 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	242 -> "484 | CCC(C)(C)O" [label=""]
	"485 | O=CO" [color=lightyellow shape=box style=filled]
	243 -> "485 | O=CO" [label=""]
	"486 | CCC(C)C" [color=lightyellow shape=box style=filled]
	243 -> "486 | CCC(C)C" [label=""]
	"487 | OC[P+](c1ccccc1)(c1ccccc1)c1ccccc1" [color=lightyellow shape=box style=filled]
	244 -> "487 | OC[P+](c1ccccc1)(c1ccccc1)c1ccccc1" [label=""]
	"488 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	244 -> "488 | CCC(C)(C)O" [label=""]
	"489 | C=O" [color=lightyellow shape=box style=filled]
	245 -> "489 | C=O" [label=""]
	"490 | CC(=O)C(C)(C)O" [color=lightyellow shape=box style=filled]
	245 -> "490 | CC(=O)C(C)(C)O" [label=""]
	"491 | O=CO" [color=lightyellow shape=box style=filled]
	246 -> "491 | O=CO" [label=""]
	"492 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	246 -> "492 | CCC(C)(C)O" [label=""]
	"493 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	247 -> "493 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"494 | Nc1nc(CO)cs1" [color=lightyellow shape=box style=filled]
	247 -> "494 | Nc1nc(CO)cs1" [label=""]
	"495 | CCC(C)(C)OC(=O)Nc1nc(C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	248 -> "495 | CCC(C)(C)OC(=O)Nc1nc(C(=O)O)cs1" [label=""]
	"496 | CCC(C)(C)OC(N)=O" [color=lightgrey shape=box style=filled]
	249 -> "496 | CCC(C)(C)OC(N)=O" [label=""]
	"497 | OCc1csc(Br)n1" [color=lightyellow shape=box style=filled]
	249 -> "497 | OCc1csc(Br)n1" [label=""]
	"498 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	250 -> "498 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"499 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	250 -> "499 | CCC(C)(C)OC(=O)O" [label=""]
	"500 | Nc1nc(CO)cs1" [color=lightyellow shape=box style=filled]
	250 -> "500 | Nc1nc(CO)cs1" [label=""]
	"501 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	251 -> "501 | CCC(C)(C)OC(=O)O" [label=""]
	"502 | Nc1nc(CO)cs1" [color=lightyellow shape=box style=filled]
	251 -> "502 | Nc1nc(CO)cs1" [label=""]
	"503 | CCC(C)(C)OCO" [color=lightgrey shape=box style=filled]
	252 -> "503 | CCC(C)(C)OCO" [label=""]
	"504 | Nc1nc(CO)cs1" [color=lightyellow shape=box style=filled]
	252 -> "504 | Nc1nc(CO)cs1" [label=""]
	"505 | CCC(C)(C)OC(N)=O" [color=lightgrey shape=box style=filled]
	253 -> "505 | CCC(C)(C)OC(N)=O" [label=""]
	"506 | OCc1csc(Cl)n1" [color=lightyellow shape=box style=filled]
	253 -> "506 | OCc1csc(Cl)n1" [label=""]
	"507 | CC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	254 -> "507 | CC(C)(C)OC(=O)O" [label=""]
	"508 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	254 -> "508 | CCC(C)(C)OC(=O)O" [label=""]
	"509 | Nc1nc(CO)cs1" [color=lightyellow shape=box style=filled]
	254 -> "509 | Nc1nc(CO)cs1" [label=""]
	"510 | CC(C)(C)OC(=O)Cl" [color=lightyellow shape=box style=filled]
	255 -> "510 | CC(C)(C)OC(=O)Cl" [label=""]
	"511 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	255 -> "511 | CCC(C)(C)OC(=O)O" [label=""]
	"512 | Nc1nc(CO)cs1" [color=lightyellow shape=box style=filled]
	255 -> "512 | Nc1nc(CO)cs1" [label=""]
	"513 | CCC(C)(C)OC(=O)Nc1nc(C=O)cs1" [color=lightgrey shape=box style=filled]
	256 -> "513 | CCC(C)(C)OC(=O)Nc1nc(C=O)cs1" [label=""]
	"514 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	257 -> "514 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"515 | Nc1nc(Br)cs1" [color=lightyellow shape=box style=filled]
	257 -> "515 | Nc1nc(Br)cs1" [label=""]
	"516 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	258 -> "516 | O=C1CCC(=O)N1Br" [label=""]
	"517 | CCC(C)(C)OC(=O)Nc1nccs1" [color=lightgrey shape=box style=filled]
	258 -> "517 | CCC(C)(C)OC(=O)Nc1nccs1" [label=""]
	"518 | CCC(C)(C)OC(N)=O" [color=lightgrey shape=box style=filled]
	259 -> "518 | CCC(C)(C)OC(N)=O" [label=""]
	"519 | Brc1csc(Br)n1" [color=lightyellow shape=box style=filled]
	259 -> "519 | Brc1csc(Br)n1" [label=""]
	"520 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	260 -> "520 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"521 | Nc1nc(Br)cs1" [color=lightyellow shape=box style=filled]
	260 -> "521 | Nc1nc(Br)cs1" [label=""]
	"522 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	260 -> "522 | CCC(C)(C)OC(=O)O" [label=""]
	"523 | CC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	261 -> "523 | CC(C)(C)OC(=O)O" [label=""]
	"524 | Nc1nc(Br)cs1" [color=lightyellow shape=box style=filled]
	261 -> "524 | Nc1nc(Br)cs1" [label=""]
	"525 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	261 -> "525 | CCC(C)(C)OC(=O)O" [label=""]
	"526 | CCC(C)(C)OC(N)=O" [color=lightgrey shape=box style=filled]
	262 -> "526 | CCC(C)(C)OC(N)=O" [label=""]
	"527 | Clc1nc(Br)cs1" [color=lightyellow shape=box style=filled]
	262 -> "527 | Clc1nc(Br)cs1" [label=""]
	"528 | CC(C)(C)OC(=O)Cl" [color=lightyellow shape=box style=filled]
	263 -> "528 | CC(C)(C)OC(=O)Cl" [label=""]
	"529 | Nc1nc(Br)cs1" [color=lightyellow shape=box style=filled]
	263 -> "529 | Nc1nc(Br)cs1" [label=""]
	"530 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	263 -> "530 | CCC(C)(C)OC(=O)O" [label=""]
	"531 | Nc1nc(Br)cs1" [color=lightyellow shape=box style=filled]
	264 -> "531 | Nc1nc(Br)cs1" [label=""]
	"532 | CC(C)(C)O[C]=O" [color=lightgrey shape=box style=filled]
	264 -> "532 | CC(C)(C)O[C]=O" [label=""]
	"533 | CCC(C)(C)OC([O])=O" [color=lightgrey shape=box style=filled]
	264 -> "533 | CCC(C)(C)OC([O])=O" [label=""]
	"534 | CC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	265 -> "534 | CC(C)(C)OC(=O)O" [label=""]
	"535 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	265 -> "535 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"536 | Nc1nc(Br)cs1" [color=lightyellow shape=box style=filled]
	265 -> "536 | Nc1nc(Br)cs1" [label=""]
	"537 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	265 -> "537 | CCC(C)(C)OC(=O)O" [label=""]
	"538 | CC(C)(C)O" [color=lightyellow shape=box style=filled]
	266 -> "538 | CC(C)(C)O" [label=""]
	"539 | O=C=O" [color=lightyellow shape=box style=filled]
	266 -> "539 | O=C=O" [label=""]
	"540 | CC(C)(C)Cl" [color=lightyellow shape=box style=filled]
	267 -> "540 | CC(C)(C)Cl" [label=""]
	"541 | O=C(O)O" [color=lightyellow shape=box style=filled]
	267 -> "541 | O=C(O)O" [label=""]
	"542 | O=C(O)O" [color=lightyellow shape=box style=filled]
	268 -> "542 | O=C(O)O" [label=""]
	"543 | CC(C)(C)Br" [color=lightyellow shape=box style=filled]
	268 -> "543 | CC(C)(C)Br" [label=""]
	"544 | O=C(OO)c1cccc(Cl)c1" [color=lightyellow shape=box style=filled]
	269 -> "544 | O=C(OO)c1cccc(Cl)c1" [label=""]
	"545 | CC(C)(C)OCO" [color=lightgrey shape=box style=filled]
	269 -> "545 | CC(C)(C)OCO" [label=""]
	"546 | CC(C)(C)O" [color=lightyellow shape=box style=filled]
	270 -> "546 | CC(C)(C)O" [label=""]
	"547 | O=C(O)O" [color=lightyellow shape=box style=filled]
	270 -> "547 | O=C(O)O" [label=""]
	"548 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	271 -> "548 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"549 | O" [color=lightyellow shape=box style=filled]
	271 -> "549 | O" [label=""]
	"550 | CI" [color=lightyellow shape=box style=filled]
	272 -> "550 | CI" [label=""]
	"551 | CCOP(=O)(OCC)OC(=O)OC(C)C" [color=lightgrey shape=box style=filled]
	272 -> "551 | CCOP(=O)(OCC)OC(=O)OC(C)C" [label=""]
	"552 | CC(C)(C)O" [color=lightyellow shape=box style=filled]
	273 -> "552 | CC(C)(C)O" [label=""]
	"553 | O=C(O)O" [color=lightyellow shape=box style=filled]
	273 -> "553 | O=C(O)O" [label=""]
	"554 | CC(C)(C)OC(=O)OC(O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	274 -> "554 | CC(C)(C)OC(=O)OC(O)OC(C)(C)C" [label=""]
	"555 | O" [color=lightyellow shape=box style=filled]
	274 -> "555 | O" [label=""]
	"556 | CO" [color=lightyellow shape=box style=filled]
	275 -> "556 | CO" [label=""]
	"557 | CC(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	275 -> "557 | CC(C)OC(=O)O" [label=""]
	"558 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	276 -> "558 | Nc1nccs1" [label=""]
	"559 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	276 -> "559 | O=CC(=O)O" [label=""]
	"560 | Nc1nc(CO)cs1" [color=lightyellow shape=box style=filled]
	277 -> "560 | Nc1nc(CO)cs1" [label=""]
	"561 | O=C=O" [color=lightyellow shape=box style=filled]
	277 -> "561 | O=C=O" [label=""]
	"562 | O=C(O)C(=O)O" [color=lightyellow shape=box style=filled]
	278 -> "562 | O=C(O)C(=O)O" [label=""]
	"563 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	278 -> "563 | Nc1nccs1" [label=""]
	"564 | O=C(O)C(O)c1csc([N+](=O)[O-])n1" [color=lightgrey shape=box style=filled]
	279 -> "564 | O=C(O)C(O)c1csc([N+](=O)[O-])n1" [label=""]
	"565 | Nc1nc(Br)cs1" [color=lightyellow shape=box style=filled]
	280 -> "565 | Nc1nc(Br)cs1" [label=""]
	"566 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	280 -> "566 | O=C(O)CO" [label=""]
	"567 | Nc1nc(C(=O)C(=O)O)cs1" [color=lightyellow shape=box style=filled]
	281 -> "567 | Nc1nc(C(=O)C(=O)O)cs1" [label=""]
	"568 | O" [color=lightyellow shape=box style=filled]
	281 -> "568 | O" [label=""]
	"569 | Nc1nc(Cl)cs1" [color=lightyellow shape=box style=filled]
	282 -> "569 | Nc1nc(Cl)cs1" [label=""]
	"570 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	282 -> "570 | O=C(O)CO" [label=""]
	"571 | O=CO" [color=lightyellow shape=box style=filled]
	283 -> "571 | O=CO" [label=""]
	"572 | Nc1nc(C=O)cs1" [color=lightyellow shape=box style=filled]
	283 -> "572 | Nc1nc(C=O)cs1" [label=""]
	"573 | O=C(O)C(O)c1csc(N[O-])n1" [color=lightgrey shape=box style=filled]
	284 -> "573 | O=C(O)C(O)c1csc(N[O-])n1" [label=""]
	"574 | Nc1nc(C(=O)C(=O)O)cs1" [color=lightyellow shape=box style=filled]
	285 -> "574 | Nc1nc(C(=O)C(=O)O)cs1" [label=""]
	"575 | OO" [color=lightyellow shape=box style=filled]
	285 -> "575 | OO" [label=""]
	"576 | O=C=O" [color=lightyellow shape=box style=filled]
	286 -> "576 | O=C=O" [label=""]
	"577 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	286 -> "577 | CCC(C)(C)O" [label=""]
	"578 | O=C(O)O" [color=lightyellow shape=box style=filled]
	287 -> "578 | O=C(O)O" [label=""]
	"579 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	287 -> "579 | CCC(C)(C)O" [label=""]
	"580 | CCC(C)(C)Cl" [color=lightyellow shape=box style=filled]
	288 -> "580 | CCC(C)(C)Cl" [label=""]
	"581 | O=C(O)O" [color=lightyellow shape=box style=filled]
	288 -> "581 | O=C(O)O" [label=""]
	"582 | CC(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	289 -> "582 | CC(C)OC(=O)O" [label=""]
	"583 | CCI" [color=lightyellow shape=box style=filled]
	289 -> "583 | CCI" [label=""]
	"584 | O=C(O)O" [color=lightyellow shape=box style=filled]
	290 -> "584 | O=C(O)O" [label=""]
	"585 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	290 -> "585 | CCC(C)(C)O" [label=""]
	"586 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	291 -> "586 | O=C(O)Cl" [label=""]
	"587 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	291 -> "587 | CCC(C)(C)O" [label=""]
	"588 | CCO" [color=lightyellow shape=box style=filled]
	292 -> "588 | CCO" [label=""]
	"589 | CC(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	292 -> "589 | CC(C)OC(=O)O" [label=""]
	"590 | CCOP(=O)(OCC)OC(=O)OC(C)C" [color=lightgrey shape=box style=filled]
	293 -> "590 | CCOP(=O)(OCC)OC(=O)OC(C)C" [label=""]
	"591 | CCI" [color=lightyellow shape=box style=filled]
	293 -> "591 | CCI" [label=""]
	"592 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	294 -> "592 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"593 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	294 -> "593 | Nc1nccs1" [label=""]
	"594 | CCC(C)(C)OC(N)=O" [color=lightgrey shape=box style=filled]
	295 -> "594 | CCC(C)(C)OC(N)=O" [label=""]
	"595 | Brc1nccs1" [color=lightyellow shape=box style=filled]
	295 -> "595 | Brc1nccs1" [label=""]
	"596 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	296 -> "596 | Nc1nccs1" [label=""]
	"597 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	296 -> "597 | CCC(C)(C)OC(=O)O" [label=""]
	"598 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	297 -> "598 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"599 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	297 -> "599 | Nc1nccs1" [label=""]
	"600 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	297 -> "600 | CCC(C)(C)OC(=O)O" [label=""]
	"601 | CC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	298 -> "601 | CC(C)(C)OC(=O)O" [label=""]
	"602 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	298 -> "602 | Nc1nccs1" [label=""]
	"603 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	298 -> "603 | CCC(C)(C)OC(=O)O" [label=""]
	"604 | CCC(C)(C)OC(N)=O" [color=lightgrey shape=box style=filled]
	299 -> "604 | CCC(C)(C)OC(N)=O" [label=""]
	"605 | Clc1nccs1" [color=lightyellow shape=box style=filled]
	299 -> "605 | Clc1nccs1" [label=""]
	"606 | CC(C)(C)OC(=O)Cl" [color=lightyellow shape=box style=filled]
	300 -> "606 | CC(C)(C)OC(=O)Cl" [label=""]
	"607 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	300 -> "607 | Nc1nccs1" [label=""]
	"608 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	300 -> "608 | CCC(C)(C)OC(=O)O" [label=""]
	"609 | CC(C)(CC=O)OC(N)=O" [color=lightgrey shape=box style=filled]
	301 -> "609 | CC(C)(CC=O)OC(N)=O" [label=""]
	"610 | Brc1nccs1" [color=lightyellow shape=box style=filled]
	301 -> "610 | Brc1nccs1" [label=""]
	"611 | CC(C)(C)O[C]=O" [color=lightgrey shape=box style=filled]
	302 -> "611 | CC(C)(C)O[C]=O" [label=""]
	"612 | CCC(C)(C)OC([O])=O" [color=lightgrey shape=box style=filled]
	302 -> "612 | CCC(C)(C)OC([O])=O" [label=""]
	"613 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	302 -> "613 | Nc1nccs1" [label=""]
	"614 | CC(C)(C)O[C]=O" [color=lightgrey shape=box style=filled]
	303 -> "614 | CC(C)(C)O[C]=O" [label=""]
	"615 | CCC(C)(C)OC([O])=O" [color=lightgrey shape=box style=filled]
	303 -> "615 | CCC(C)(C)OC([O])=O" [label=""]
	"616 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	303 -> "616 | Nc1nccs1" [label=""]
	"617 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	304 -> "617 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"618 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	304 -> "618 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"619 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	305 -> "619 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"620 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	305 -> "620 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"621 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	305 -> "621 | CCC(C)(C)OC(=O)O" [label=""]
	"622 | CCC(C)(C)OC(=O)Nc1nccs1" [color=lightgrey shape=box style=filled]
	306 -> "622 | CCC(C)(C)OC(=O)Nc1nccs1" [label=""]
	"623 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	306 -> "623 | O=CC(=O)O" [label=""]
	"624 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	307 -> "624 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"625 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	307 -> "625 | CCC(C)(C)OC(=O)O" [label=""]
	"626 | CCC(C)(C)OC(N)=O" [color=lightgrey shape=box style=filled]
	308 -> "626 | CCC(C)(C)OC(N)=O" [label=""]
	"627 | O=C(O)C(O)c1csc(Br)n1" [color=lightyellow shape=box style=filled]
	308 -> "627 | O=C(O)C(O)c1csc(Br)n1" [label=""]
	"628 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	309 -> "628 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"629 | CCC(C)(C)OCO" [color=lightgrey shape=box style=filled]
	309 -> "629 | CCC(C)(C)OCO" [label=""]
	"630 | CCC(C)(C)OC(=O)Nc1nc(CO)cs1" [color=lightgrey shape=box style=filled]
	310 -> "630 | CCC(C)(C)OC(=O)Nc1nc(CO)cs1" [label=""]
	"631 | O=C=O" [color=lightyellow shape=box style=filled]
	310 -> "631 | O=C=O" [label=""]
	"632 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	311 -> "632 | O=C(O)CO" [label=""]
	"633 | CCC(C)(C)OC(=O)Nc1nc(Br)cs1" [color=lightgrey shape=box style=filled]
	311 -> "633 | CCC(C)(C)OC(=O)Nc1nc(Br)cs1" [label=""]
	"634 | CC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	312 -> "634 | CC(C)(C)OC(=O)O" [label=""]
	"635 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	312 -> "635 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"636 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	312 -> "636 | CCC(C)(C)OC(=O)O" [label=""]
	"637 | O=C(O)C(=O)O" [color=lightyellow shape=box style=filled]
	313 -> "637 | O=C(O)C(=O)O" [label=""]
	"638 | CCC(C)(C)OC(=O)Nc1nccs1" [color=lightgrey shape=box style=filled]
	313 -> "638 | CCC(C)(C)OC(=O)Nc1nccs1" [label=""]
	"639 | O=CO" [color=lightyellow shape=box style=filled]
	314 -> "639 | O=CO" [label=""]
	"640 | NC1C(=O)N2C(C(=O)O)=CCS[C@H]12" [color=lightgrey shape=box style=filled]
	314 -> "640 | NC1C(=O)N2C(C(=O)O)=CCS[C@H]12" [label=""]
	"641 | CN(C)C=O" [color=lightyellow shape=box style=filled]
	315 -> "641 | CN(C)C=O" [label=""]
	"642 | NC1C(=O)N2C(C(=O)O)=CCS[C@H]12" [color=lightgrey shape=box style=filled]
	315 -> "642 | NC1C(=O)N2C(C(=O)O)=CCS[C@H]12" [label=""]
	"643 | NC1C(=O)N(CC(=O)O)[C@@H]1SCC(=O)C=O" [color=lightgrey shape=box style=filled]
	316 -> "643 | NC1C(=O)N(CC(=O)O)[C@@H]1SCC(=O)C=O" [label=""]
	"644 | NC1C(=O)N2C=C(C=O)CS[C@H]12" [color=lightgrey shape=box style=filled]
	317 -> "644 | NC1C(=O)N2C=C(C=O)CS[C@H]12" [label=""]
	"645 | O=C=O" [color=lightyellow shape=box style=filled]
	317 -> "645 | O=C=O" [label=""]
	"646 | CC(C)(C)OC(=O)NC1C(=O)N(CC(=O)O)[C@@H]1SCCC=O" [color=lightgrey shape=box style=filled]
	318 -> "646 | CC(C)(C)OC(=O)NC1C(=O)N(CC(=O)O)[C@@H]1SCCC=O" [label=""]
	"647 | NC1C(=O)N(CC(=O)O)[C@@H]1SCC(O)C=O" [color=lightgrey shape=box style=filled]
	319 -> "647 | NC1C(=O)N(CC(=O)O)[C@@H]1SCC(O)C=O" [label=""]
	"648 | C=O" [color=lightyellow shape=box style=filled]
	320 -> "648 | C=O" [label=""]
	"649 | NC1C(=O)N2C(C(=O)O)=C(Br)CS[C@H]12" [color=lightgrey shape=box style=filled]
	320 -> "649 | NC1C(=O)N2C(C(=O)O)=C(Br)CS[C@H]12" [label=""]
	"650 | NC1C(=O)N[C@@H]1SCC(C=O)C(=O)C(=O)O" [color=lightgrey shape=box style=filled]
	321 -> "650 | NC1C(=O)N[C@@H]1SCC(C=O)C(=O)C(=O)O" [label=""]
	"651 | NC1C(=O)N(CC(=O)O)[C@@H]1SCC(Br)C=O" [color=lightgrey shape=box style=filled]
	322 -> "651 | NC1C(=O)N(CC(=O)O)[C@@H]1SCC(Br)C=O" [label=""]
	"652 | NC1C(=O)N(CC(=O)O)[C@@H]1SCC(Cl)C=O" [color=lightgrey shape=box style=filled]
	323 -> "652 | NC1C(=O)N(CC(=O)O)[C@@H]1SCC(Cl)C=O" [label=""]
	"653 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	324 -> "653 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"654 | NC1C(=O)N2C(C(=O)O)=CCS[C@H]12" [color=lightgrey shape=box style=filled]
	324 -> "654 | NC1C(=O)N2C(C(=O)O)=CCS[C@H]12" [label=""]
	"655 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	325 -> "655 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"656 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" [color=lightgrey shape=box style=filled]
	325 -> "656 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" [label=""]
	"657 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCCC(=O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	326 -> "657 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCCC(=O)C(=O)O)cs1" [label=""]
	"658 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCCCC(=O)O)cs1" [color=lightgrey shape=box style=filled]
	327 -> "658 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCCCC(=O)O)cs1" [label=""]
	"659 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	328 -> "659 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"660 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	328 -> "660 | CCC(C)(C)OC(=O)O" [label=""]
	"661 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" [color=lightgrey shape=box style=filled]
	328 -> "661 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" [label=""]
	"662 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCCC(Br)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	329 -> "662 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCCC(Br)C(=O)O)cs1" [label=""]
	"663 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCC=CC(=O)O)cs1" [color=lightgrey shape=box style=filled]
	330 -> "663 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCC=CC(=O)O)cs1" [label=""]
	"664 | CCOP(=O)(OCC)C(CCS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(NC(=O)OC(C)(C)CC)n1)C(=O)O" [color=lightgrey shape=box style=filled]
	331 -> "664 | CCOP(=O)(OCC)C(CCS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(NC(=O)OC(C)(C)CC)n1)C(=O)O" [label=""]
	"665 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	332 -> "665 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"666 | NC1C(=O)N[C@@H]1SCC=CC(=O)O" [color=lightgrey shape=box style=filled]
	332 -> "666 | NC1C(=O)N[C@@H]1SCC=CC(=O)O" [label=""]
	"667 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	333 -> "667 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"668 | NC1C(=O)N2C(C(=O)O)=CCS[C@H]12" [color=lightgrey shape=box style=filled]
	333 -> "668 | NC1C(=O)N2C(C(=O)O)=CCS[C@H]12" [label=""]
	"669 | CCC(C)(C)OC=O" [color=lightgrey shape=box style=filled]
	333 -> "669 | CCC(C)(C)OC=O" [label=""]
	"670 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	334 -> "670 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"671 | NC1C(=O)N2C(C(=O)O)=CCS[C@H]12" [color=lightgrey shape=box style=filled]
	334 -> "671 | NC1C(=O)N2C(C(=O)O)=CCS[C@H]12" [label=""]
	"672 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	335 -> "672 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"673 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" [color=lightgrey shape=box style=filled]
	335 -> "673 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" [label=""]
	"674 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCCC(=O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	336 -> "674 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCCC(=O)C(=O)O)cs1" [label=""]
	"675 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCCCC(=O)O)cs1" [color=lightgrey shape=box style=filled]
	337 -> "675 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCCCC(=O)O)cs1" [label=""]
	"676 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	338 -> "676 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"677 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	338 -> "677 | CCC(C)(C)OC(=O)O" [label=""]
	"678 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" [color=lightgrey shape=box style=filled]
	338 -> "678 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" [label=""]
	"679 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCCC(Br)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	339 -> "679 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCCC(Br)C(=O)O)cs1" [label=""]
	"680 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCC=CC(=O)O)cs1" [color=lightgrey shape=box style=filled]
	340 -> "680 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCC=CC(=O)O)cs1" [label=""]
	"681 | CCOP(=O)(OCC)C(CCS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(NC(=O)OC(C)(C)CC)n1)C(=O)O" [color=lightgrey shape=box style=filled]
	341 -> "681 | CCOP(=O)(OCC)C(CCS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(NC(=O)OC(C)(C)CC)n1)C(=O)O" [label=""]
	"682 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	342 -> "682 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"683 | NC1C(=O)N[C@@H]1SCC=CC(=O)O" [color=lightgrey shape=box style=filled]
	342 -> "683 | NC1C(=O)N[C@@H]1SCC=CC(=O)O" [label=""]
	"684 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	343 -> "684 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"685 | NC1C(=O)N2C(C(=O)O)=CCS[C@H]12" [color=lightgrey shape=box style=filled]
	343 -> "685 | NC1C(=O)N2C(C(=O)O)=CCS[C@H]12" [label=""]
	"686 | CCC(C)(C)OC=O" [color=lightgrey shape=box style=filled]
	343 -> "686 | CCC(C)(C)OC=O" [label=""]
	"687 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	344 -> "687 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"688 | NC1C(=O)N2C(C(=O)O)=C(C=O)CS[C@H]12" [color=lightgrey shape=box style=filled]
	344 -> "688 | NC1C(=O)N2C(C(=O)O)=C(C=O)CS[C@H]12" [label=""]
	"689 | CN(C)C=O" [color=lightyellow shape=box style=filled]
	345 -> "689 | CN(C)C=O" [label=""]
	"690 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" [color=lightgrey shape=box style=filled]
	345 -> "690 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" [label=""]
	"691 | O=CO" [color=lightyellow shape=box style=filled]
	346 -> "691 | O=CO" [label=""]
	"692 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" [color=lightgrey shape=box style=filled]
	346 -> "692 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" [label=""]
	"693 | Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(=O)C=O)cs1" [color=lightgrey shape=box style=filled]
	347 -> "693 | Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(=O)C=O)cs1" [label=""]
	"694 | Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(Br)C=O)cs1" [color=lightgrey shape=box style=filled]
	348 -> "694 | Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(Br)C=O)cs1" [label=""]
	"695 | Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(O)C=O)cs1" [color=lightgrey shape=box style=filled]
	349 -> "695 | Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(O)C=O)cs1" [label=""]
	"696 | Nc1nc(C(O)C(=O)NC2C(=O)N(C(Cl)C(=O)O)[C@@H]2SCCC=O)cs1" [color=lightgrey shape=box style=filled]
	350 -> "696 | Nc1nc(C(O)C(=O)NC2C(=O)N(C(Cl)C(=O)O)[C@@H]2SCCC=O)cs1" [label=""]
	"697 | Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(Cl)C=O)cs1" [color=lightgrey shape=box style=filled]
	351 -> "697 | Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(Cl)C=O)cs1" [label=""]
	"698 | Nc1nc(C(O)C(=O)NC2C(=O)N(C(=O)C(=O)O)[C@@H]2SCC(O)C=O)cs1" [color=lightgrey shape=box style=filled]
	352 -> "698 | Nc1nc(C(O)C(=O)NC2C(=O)N(C(=O)C(=O)O)[C@@H]2SCC(O)C=O)cs1" [label=""]
	"699 | Nc1nc(C(O)C(=O)NC2C(=O)N(C(=O)C(=O)O)[C@@H]2SCC(Br)C=O)cs1" [color=lightgrey shape=box style=filled]
	353 -> "699 | Nc1nc(C(O)C(=O)NC2C(=O)N(C(=O)C(=O)O)[C@@H]2SCC(Br)C=O)cs1" [label=""]
	"700 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	354 -> "700 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"701 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	354 -> "701 | CCC(C)(C)OC(=O)O" [label=""]
	"702 | CC(C)(C)OC(=O)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	355 -> "702 | CC(C)(C)OC(=O)OC(=O)Cl" [label=""]
	"703 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	355 -> "703 | CCC(C)(C)O" [label=""]
	"704 | CC(C)(C)OC(=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	356 -> "704 | CC(C)(C)OC(=O)OC(=O)O" [label=""]
	"705 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	356 -> "705 | CCC(C)(C)O" [label=""]
	"706 | CCC(C)(C)OC(=O)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	357 -> "706 | CCC(C)(C)OC(=O)OC(=O)Cl" [label=""]
	"707 | CC(C)(C)O" [color=lightyellow shape=box style=filled]
	357 -> "707 | CC(C)(C)O" [label=""]
	"708 | CC(C)(C)OC(=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	358 -> "708 | CC(C)(C)OC(=O)OC(=O)O" [label=""]
	"709 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	358 -> "709 | CCC(C)(C)O" [label=""]
	"710 | CC(C)(C)OC(=O)O[C]=O" [color=lightgrey shape=box style=filled]
	359 -> "710 | CC(C)(C)OC(=O)O[C]=O" [label=""]
	"711 | CCC(C)(C)[O]" [color=lightgrey shape=box style=filled]
	359 -> "711 | CCC(C)(C)[O]" [label=""]
	"712 | CC(C)(C)O" [color=lightyellow shape=box style=filled]
	360 -> "712 | CC(C)(C)O" [label=""]
	"713 | CCC(C)(C)OC(=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	360 -> "713 | CCC(C)(C)OC(=O)OC(=O)O" [label=""]
	"714 | CC(C)(C)OC(=O)OC=O" [color=lightgrey shape=box style=filled]
	361 -> "714 | CC(C)(C)OC(=O)OC=O" [label=""]
	"715 | CC(Br)C(C)(C)O" [color=lightyellow shape=box style=filled]
	361 -> "715 | CC(Br)C(C)(C)O" [label=""]
	"716 | CC(C)(C)OC(=O)OC(=O)Br" [color=lightgrey shape=box style=filled]
	362 -> "716 | CC(C)(C)OC(=O)OC(=O)Br" [label=""]
	"717 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	362 -> "717 | CCC(C)(C)O" [label=""]
	"718 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2S)cs1" [color=lightgrey shape=box style=filled]
	363 -> "718 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2S)cs1" [label=""]
	"719 | O=CC(=O)CBr" [color=lightgrey shape=box style=filled]
	363 -> "719 | O=CC(=O)CBr" [label=""]
	"720 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	364 -> "720 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"721 | NC1C(=O)N(CC(=O)O)[C@@H]1SCC(=O)C=O" [color=lightgrey shape=box style=filled]
	364 -> "721 | NC1C(=O)N(CC(=O)O)[C@@H]1SCC(=O)C=O" [label=""]
	"722 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCC(=O)C=O)cs1" [color=lightgrey shape=box style=filled]
	365 -> "722 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCC(=O)C=O)cs1" [label=""]
	"723 | O=C(O)CBr" [color=lightyellow shape=box style=filled]
	365 -> "723 | O=C(O)CBr" [label=""]
	"724 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2S)cs1" [color=lightgrey shape=box style=filled]
	366 -> "724 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2S)cs1" [label=""]
	"725 | O=CC(=O)CCl" [color=lightgrey shape=box style=filled]
	366 -> "725 | O=CC(=O)CCl" [label=""]
	"726 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	367 -> "726 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"727 | Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(=O)C=O)cs1" [color=lightgrey shape=box style=filled]
	367 -> "727 | Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(=O)C=O)cs1" [label=""]
	"728 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCC(=O)C=O)cs1" [color=lightgrey shape=box style=filled]
	368 -> "728 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCC(=O)C=O)cs1" [label=""]
	"729 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	368 -> "729 | O=CC(=O)O" [label=""]
	"730 | CC(=O)C=O" [color=lightyellow shape=box style=filled]
	369 -> "730 | CC(=O)C=O" [label=""]
	"731 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	369 -> "731 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"732 | NC1C(=O)N(CC(=O)O)[C@@H]1S" [color=lightgrey shape=box style=filled]
	369 -> "732 | NC1C(=O)N(CC(=O)O)[C@@H]1S" [label=""]
	"733 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC(C(=O)O)[C@H](NCC(=O)O)SCC(=O)C=O)cs1" [color=lightgrey shape=box style=filled]
	370 -> "733 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC(C(=O)O)[C@H](NCC(=O)O)SCC(=O)C=O)cs1" [label=""]
	"734 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCC(=O)C=O)cs1" [color=lightgrey shape=box style=filled]
	371 -> "734 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCC(=O)C=O)cs1" [label=""]
	"735 | O=C(O)CCl" [color=lightgrey shape=box style=filled]
	371 -> "735 | O=C(O)CCl" [label=""]
	"736 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCC(=O)C=O)cs1" [color=lightgrey shape=box style=filled]
	372 -> "736 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCC(=O)C=O)cs1" [label=""]
	"737 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	372 -> "737 | O=C(O)CO" [label=""]
	"738 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	373 -> "738 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"739 | NC1C(=O)N(CC(=O)O)[C@@H]1SCC(Br)C=O" [color=lightgrey shape=box style=filled]
	373 -> "739 | NC1C(=O)N(CC(=O)O)[C@@H]1SCC(Br)C=O" [label=""]
	"740 | O=C(O)CBr" [color=lightyellow shape=box style=filled]
	374 -> "740 | O=C(O)CBr" [label=""]
	"741 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCC(Br)C=O)cs1" [color=lightgrey shape=box style=filled]
	374 -> "741 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCC(Br)C=O)cs1" [label=""]
	"742 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2S)cs1" [color=lightgrey shape=box style=filled]
	375 -> "742 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2S)cs1" [label=""]
	"743 | O=CC(Br)CBr" [color=lightyellow shape=box style=filled]
	375 -> "743 | O=CC(Br)CBr" [label=""]
	"744 | Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(Br)C=O)cs1" [color=lightgrey shape=box style=filled]
	376 -> "744 | Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(Br)C=O)cs1" [label=""]
	"745 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	376 -> "745 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"746 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2S)cs1" [color=lightgrey shape=box style=filled]
	377 -> "746 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2S)cs1" [label=""]
	"747 | O=CC(Br)CI" [color=lightgrey shape=box style=filled]
	377 -> "747 | O=CC(Br)CI" [label=""]
	"748 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2S)cs1" [color=lightgrey shape=box style=filled]
	378 -> "748 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2S)cs1" [label=""]
	"749 | O=CC(Br)C[Mg+]" [color=lightgrey shape=box style=filled]
	378 -> "749 | O=CC(Br)C[Mg+]" [label=""]
	"750 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	379 -> "750 | O=CC(=O)O" [label=""]
	"751 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCC(Br)C=O)cs1" [color=lightgrey shape=box style=filled]
	379 -> "751 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCC(Br)C=O)cs1" [label=""]
	"752 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2S)cs1" [color=lightgrey shape=box style=filled]
	380 -> "752 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2S)cs1" [label=""]
	"753 | O=CC(Br)CCl" [color=lightgrey shape=box style=filled]
	380 -> "753 | O=CC(Br)CCl" [label=""]
	"754 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2S)cs1" [color=lightgrey shape=box style=filled]
	381 -> "754 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2S)cs1" [label=""]
	"755 | O=CC(Br)C=O" [color=lightyellow shape=box style=filled]
	381 -> "755 | O=CC(Br)C=O" [label=""]
	"756 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	382 -> "756 | O=C(O)CO" [label=""]
	"757 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCC(Br)C=O)cs1" [color=lightgrey shape=box style=filled]
	382 -> "757 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCC(Br)C=O)cs1" [label=""]
	"758 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	383 -> "758 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"759 | NC1C(=O)N(C(Cl)C(=O)O)[C@@H]1SCCC=O" [color=lightgrey shape=box style=filled]
	383 -> "759 | NC1C(=O)N(C(Cl)C(=O)O)[C@@H]1SCCC=O" [label=""]
	"760 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(C(Cl)C(=O)O)[C@@H]2S)cs1" [color=lightgrey shape=box style=filled]
	384 -> "760 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(C(Cl)C(=O)O)[C@@H]2S)cs1" [label=""]
	"761 | O=CCCBr" [color=lightyellow shape=box style=filled]
	384 -> "761 | O=CCCBr" [label=""]
	"762 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCCC=O)cs1" [color=lightgrey shape=box style=filled]
	385 -> "762 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCCC=O)cs1" [label=""]
	"763 | O=C(O)C(Cl)Cl" [color=lightyellow shape=box style=filled]
	385 -> "763 | O=C(O)C(Cl)Cl" [label=""]
	"764 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	386 -> "764 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"765 | Nc1nc(C(O)C(=O)NC2C(=O)N(C(Cl)C(=O)O)[C@@H]2SCCC=O)cs1" [color=lightgrey shape=box style=filled]
	386 -> "765 | Nc1nc(C(O)C(=O)NC2C(=O)N(C(Cl)C(=O)O)[C@@H]2SCCC=O)cs1" [label=""]
	"766 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	387 -> "766 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"767 | NC1C(=O)N[C@@H]1SCCC=O" [color=lightgrey shape=box style=filled]
	387 -> "767 | NC1C(=O)N[C@@H]1SCCC=O" [label=""]
	"768 | O=C(O)CCl" [color=lightgrey shape=box style=filled]
	387 -> "768 | O=C(O)CCl" [label=""]
	"769 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCCC=O)cs1" [color=lightgrey shape=box style=filled]
	388 -> "769 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCCC=O)cs1" [label=""]
	"770 | O=C(O)C(=O)Cl" [color=lightgrey shape=box style=filled]
	388 -> "770 | O=C(O)C(=O)Cl" [label=""]
	"771 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCCC=O)cs1" [color=lightgrey shape=box style=filled]
	389 -> "771 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCCC=O)cs1" [label=""]
	"772 | O=C(O)C(O)Cl" [color=lightgrey shape=box style=filled]
	389 -> "772 | O=C(O)C(O)Cl" [label=""]
	"773 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCCC=O)cs1" [color=lightgrey shape=box style=filled]
	390 -> "773 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCCC=O)cs1" [label=""]
	"774 | O=C(O)C(Cl)Br" [color=lightyellow shape=box style=filled]
	390 -> "774 | O=C(O)C(Cl)Br" [label=""]
	"775 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCCC=O)cs1" [color=lightgrey shape=box style=filled]
	391 -> "775 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCCC=O)cs1" [label=""]
	"776 | ClC(Cl)(Cl)Cl" [color=lightyellow shape=box style=filled]
	391 -> "776 | ClC(Cl)(Cl)Cl" [label=""]
	"777 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	392 -> "777 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"778 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	392 -> "778 | CCC(C)(C)OC(=O)O" [label=""]
	"779 | Nc1nc(C(O)C(=O)NC2C(=O)N(C(Cl)C(=O)O)[C@@H]2SCCC=O)cs1" [color=lightgrey shape=box style=filled]
	392 -> "779 | Nc1nc(C(O)C(=O)NC2C(=O)N(C(Cl)C(=O)O)[C@@H]2SCCC=O)cs1" [label=""]
	"780 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	393 -> "780 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"781 | NC1C(=O)N(CC(=O)O)[C@@H]1SCC(O)C=O" [color=lightgrey shape=box style=filled]
	393 -> "781 | NC1C(=O)N(CC(=O)O)[C@@H]1SCC(O)C=O" [label=""]
	"782 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCC(O)C=O)cs1" [color=lightgrey shape=box style=filled]
	394 -> "782 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCC(O)C=O)cs1" [label=""]
	"783 | O=C(O)CBr" [color=lightyellow shape=box style=filled]
	394 -> "783 | O=C(O)CBr" [label=""]
	"784 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2S)cs1" [color=lightgrey shape=box style=filled]
	395 -> "784 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2S)cs1" [label=""]
	"785 | O=CC(O)CBr" [color=lightgrey shape=box style=filled]
	395 -> "785 | O=CC(O)CBr" [label=""]
	"786 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	396 -> "786 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"787 | Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(O)C=O)cs1" [color=lightgrey shape=box style=filled]
	396 -> "787 | Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(O)C=O)cs1" [label=""]
	"788 | CC(=O)C=O" [color=lightyellow shape=box style=filled]
	397 -> "788 | CC(=O)C=O" [label=""]
	"789 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2S)cs1" [color=lightgrey shape=box style=filled]
	397 -> "789 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2S)cs1" [label=""]
	"790 | O=CC(O)CI" [color=lightgrey shape=box style=filled]
	398 -> "790 | O=CC(O)CI" [label=""]
	"791 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2S)cs1" [color=lightgrey shape=box style=filled]
	398 -> "791 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2S)cs1" [label=""]
	"792 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCC(O)C=O)cs1" [color=lightgrey shape=box style=filled]
	399 -> "792 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCC(O)C=O)cs1" [label=""]
	"793 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	399 -> "793 | O=CC(=O)O" [label=""]
	"794 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCC(O)C=O)cs1" [color=lightgrey shape=box style=filled]
	400 -> "794 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCC(O)C=O)cs1" [label=""]
	"795 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	400 -> "795 | O=C(O)CO" [label=""]
	"796 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCC(=O)C=O)cs1" [color=lightgrey shape=box style=filled]
	401 -> "796 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCC(=O)C=O)cs1" [label=""]
	"797 | CC(=O)O" [color=lightyellow shape=box style=filled]
	401 -> "797 | CC(=O)O" [label=""]
	"798 | CC(=O)O" [color=lightyellow shape=box style=filled]
	402 -> "798 | CC(=O)O" [label=""]
	"799 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	402 -> "799 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"800 | NC1C(=O)N[C@@H]1SCC(O)C=O" [color=lightgrey shape=box style=filled]
	402 -> "800 | NC1C(=O)N[C@@H]1SCC(O)C=O" [label=""]
	"801 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	403 -> "801 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"802 | NC1C(=O)N(CC(=O)O)[C@@H]1SCC(Cl)C=O" [color=lightgrey shape=box style=filled]
	403 -> "802 | NC1C(=O)N(CC(=O)O)[C@@H]1SCC(Cl)C=O" [label=""]
	"803 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2S)cs1" [color=lightgrey shape=box style=filled]
	404 -> "803 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2S)cs1" [label=""]
	"804 | O=CC(Cl)CBr" [color=lightgrey shape=box style=filled]
	404 -> "804 | O=CC(Cl)CBr" [label=""]
	"805 | O=C(O)CBr" [color=lightyellow shape=box style=filled]
	405 -> "805 | O=C(O)CBr" [label=""]
	"806 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCC(Cl)C=O)cs1" [color=lightgrey shape=box style=filled]
	405 -> "806 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCC(Cl)C=O)cs1" [label=""]
	"807 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2S)cs1" [color=lightgrey shape=box style=filled]
	406 -> "807 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2S)cs1" [label=""]
	"808 | O=CC(Cl)C=O" [color=lightyellow shape=box style=filled]
	406 -> "808 | O=CC(Cl)C=O" [label=""]
	"809 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2S)cs1" [color=lightgrey shape=box style=filled]
	407 -> "809 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2S)cs1" [label=""]
	"810 | O=CC(Cl)CCl" [color=lightgrey shape=box style=filled]
	407 -> "810 | O=CC(Cl)CCl" [label=""]
	"811 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	408 -> "811 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"812 | Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(Cl)C=O)cs1" [color=lightgrey shape=box style=filled]
	408 -> "812 | Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(Cl)C=O)cs1" [label=""]
	"813 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2S)cs1" [color=lightgrey shape=box style=filled]
	409 -> "813 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2S)cs1" [label=""]
	"814 | CO" [color=lightyellow shape=box style=filled]
	409 -> "814 | CO" [label=""]
	"815 | O=CCCl" [color=lightyellow shape=box style=filled]
	409 -> "815 | O=CCCl" [label=""]
	"816 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2S)cs1" [color=lightgrey shape=box style=filled]
	410 -> "816 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2S)cs1" [label=""]
	"817 | O=CC(Cl)CI" [color=lightgrey shape=box style=filled]
	410 -> "817 | O=CC(Cl)CI" [label=""]
	"818 | O=CCCl" [color=lightyellow shape=box style=filled]
	411 -> "818 | O=CCCl" [label=""]
	"819 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2S)cs1" [color=lightgrey shape=box style=filled]
	411 -> "819 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2S)cs1" [label=""]
	"820 | CI" [color=lightyellow shape=box style=filled]
	411 -> "820 | CI" [label=""]
	"821 | O=C(O)CCl" [color=lightgrey shape=box style=filled]
	412 -> "821 | O=C(O)CCl" [label=""]
	"822 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCC(Cl)C=O)cs1" [color=lightgrey shape=box style=filled]
	412 -> "822 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCC(Cl)C=O)cs1" [label=""]
	"823 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	413 -> "823 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"824 | NC1C(=O)N2C(C(=O)O)=C(C=O)CS[C@H]12" [color=lightgrey shape=box style=filled]
	413 -> "824 | NC1C(=O)N2C(C(=O)O)=C(C=O)CS[C@H]12" [label=""]
	"825 | CN(C)C=O" [color=lightyellow shape=box style=filled]
	414 -> "825 | CN(C)C=O" [label=""]
	"826 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" [color=lightgrey shape=box style=filled]
	414 -> "826 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" [label=""]
	"827 | O=CO" [color=lightyellow shape=box style=filled]
	415 -> "827 | O=CO" [label=""]
	"828 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" [color=lightgrey shape=box style=filled]
	415 -> "828 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=CCS[C@H]23)cs1" [label=""]
	"829 | Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(=O)C=O)cs1" [color=lightgrey shape=box style=filled]
	416 -> "829 | Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(=O)C=O)cs1" [label=""]
	"830 | Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(Br)C=O)cs1" [color=lightgrey shape=box style=filled]
	417 -> "830 | Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(Br)C=O)cs1" [label=""]
	"831 | Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(O)C=O)cs1" [color=lightgrey shape=box style=filled]
	418 -> "831 | Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(O)C=O)cs1" [label=""]
	"832 | Nc1nc(C(O)C(=O)NC2C(=O)N(C(Cl)C(=O)O)[C@@H]2SCCC=O)cs1" [color=lightgrey shape=box style=filled]
	419 -> "832 | Nc1nc(C(O)C(=O)NC2C(=O)N(C(Cl)C(=O)O)[C@@H]2SCCC=O)cs1" [label=""]
	"833 | Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(Cl)C=O)cs1" [color=lightgrey shape=box style=filled]
	420 -> "833 | Nc1nc(C(O)C(=O)NC2C(=O)N(CC(=O)O)[C@@H]2SCC(Cl)C=O)cs1" [label=""]
	"834 | Nc1nc(C(O)C(=O)NC2C(=O)N(C(=O)C(=O)O)[C@@H]2SCC(O)C=O)cs1" [color=lightgrey shape=box style=filled]
	421 -> "834 | Nc1nc(C(O)C(=O)NC2C(=O)N(C(=O)C(=O)O)[C@@H]2SCC(O)C=O)cs1" [label=""]
	"835 | Nc1nc(C(O)C(=O)NC2C(=O)N(C(=O)C(=O)O)[C@@H]2SCC(Br)C=O)cs1" [color=lightgrey shape=box style=filled]
	422 -> "835 | Nc1nc(C(O)C(=O)NC2C(=O)N(C(=O)C(=O)O)[C@@H]2SCC(Br)C=O)cs1" [label=""]
	"836 | O=C=O" [color=lightyellow shape=box style=filled]
	423 -> "836 | O=C=O" [label=""]
	"837 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	423 -> "837 | CCC(C)(C)O" [label=""]
	"838 | O=C(O)O" [color=lightyellow shape=box style=filled]
	424 -> "838 | O=C(O)O" [label=""]
	"839 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	424 -> "839 | CCC(C)(C)O" [label=""]
	"840 | CCC(C)(C)Cl" [color=lightyellow shape=box style=filled]
	425 -> "840 | CCC(C)(C)Cl" [label=""]
	"841 | O=C(O)O" [color=lightyellow shape=box style=filled]
	425 -> "841 | O=C(O)O" [label=""]
	"842 | CC(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	426 -> "842 | CC(C)OC(=O)O" [label=""]
	"843 | CCI" [color=lightyellow shape=box style=filled]
	426 -> "843 | CCI" [label=""]
	"844 | O=C(O)O" [color=lightyellow shape=box style=filled]
	427 -> "844 | O=C(O)O" [label=""]
	"845 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	427 -> "845 | CCC(C)(C)O" [label=""]
	"846 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	428 -> "846 | O=C(O)Cl" [label=""]
	"847 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	428 -> "847 | CCC(C)(C)O" [label=""]
	"848 | CCO" [color=lightyellow shape=box style=filled]
	429 -> "848 | CCO" [label=""]
	"849 | CC(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	429 -> "849 | CC(C)OC(=O)O" [label=""]
	"850 | CCOP(=O)(OCC)OC(=O)OC(C)C" [color=lightgrey shape=box style=filled]
	430 -> "850 | CCOP(=O)(OCC)OC(=O)OC(C)C" [label=""]
	"851 | CCI" [color=lightyellow shape=box style=filled]
	430 -> "851 | CCI" [label=""]
	"852 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	431 -> "852 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"853 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	431 -> "853 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"854 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	432 -> "854 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"855 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	432 -> "855 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"856 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	432 -> "856 | CCC(C)(C)OC(=O)O" [label=""]
	"857 | CCC(C)(C)OC(=O)Nc1nccs1" [color=lightgrey shape=box style=filled]
	433 -> "857 | CCC(C)(C)OC(=O)Nc1nccs1" [label=""]
	"858 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	433 -> "858 | O=CC(=O)O" [label=""]
	"859 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	434 -> "859 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"860 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	434 -> "860 | CCC(C)(C)OC(=O)O" [label=""]
	"861 | CCC(C)(C)OC(N)=O" [color=lightgrey shape=box style=filled]
	435 -> "861 | CCC(C)(C)OC(N)=O" [label=""]
	"862 | O=C(O)C(O)c1csc(Br)n1" [color=lightyellow shape=box style=filled]
	435 -> "862 | O=C(O)C(O)c1csc(Br)n1" [label=""]
	"863 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	436 -> "863 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"864 | CCC(C)(C)OCO" [color=lightgrey shape=box style=filled]
	436 -> "864 | CCC(C)(C)OCO" [label=""]
	"865 | CCC(C)(C)OC(=O)Nc1nc(CO)cs1" [color=lightgrey shape=box style=filled]
	437 -> "865 | CCC(C)(C)OC(=O)Nc1nc(CO)cs1" [label=""]
	"866 | O=C=O" [color=lightyellow shape=box style=filled]
	437 -> "866 | O=C=O" [label=""]
	"867 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	438 -> "867 | O=C(O)CO" [label=""]
	"868 | CCC(C)(C)OC(=O)Nc1nc(Br)cs1" [color=lightgrey shape=box style=filled]
	438 -> "868 | CCC(C)(C)OC(=O)Nc1nc(Br)cs1" [label=""]
	"869 | CC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	439 -> "869 | CC(C)(C)OC(=O)O" [label=""]
	"870 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	439 -> "870 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"871 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	439 -> "871 | CCC(C)(C)OC(=O)O" [label=""]
	"872 | O=C(O)C(=O)O" [color=lightyellow shape=box style=filled]
	440 -> "872 | O=C(O)C(=O)O" [label=""]
	"873 | CCC(C)(C)OC(=O)Nc1nccs1" [color=lightgrey shape=box style=filled]
	440 -> "873 | CCC(C)(C)OC(=O)Nc1nccs1" [label=""]
	"874 | CC1=C(C(=O)O)N[C@@H](C(N)C(=O)O)SC1" [color=lightgrey shape=box style=filled]
	441 -> "874 | CC1=C(C(=O)O)N[C@@H](C(N)C(=O)O)SC1" [label=""]
	"875 | O=C=O" [color=lightyellow shape=box style=filled]
	442 -> "875 | O=C=O" [label=""]
	"876 | CC1=CN2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	442 -> "876 | CC1=CN2C(=O)C(N)[C@H]2SC1" [label=""]
	"877 | CC(CS[C@H]1NC(=O)C1N)CC(=O)O" [color=lightgrey shape=box style=filled]
	443 -> "877 | CC(CS[C@H]1NC(=O)C1N)CC(=O)O" [label=""]
	"878 | CC(CS[C@H]1NC(=O)C1N)C(=O)C(=O)O" [color=lightgrey shape=box style=filled]
	444 -> "878 | CC(CS[C@H]1NC(=O)C1N)C(=O)C(=O)O" [label=""]
	"879 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)OC(C)(C)C)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	445 -> "879 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)OC(C)(C)C)[C@H]2SC1" [label=""]
	"880 | CCCS[C@H]1NC(=O)C1N" [color=lightgrey shape=box style=filled]
	446 -> "880 | CCCS[C@H]1NC(=O)C1N" [label=""]
	"881 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	446 -> "881 | O=CC(=O)O" [label=""]
	"882 | C[C]CS[C@H]1[N]C(=O)C1N" [color=lightgrey shape=box style=filled]
	447 -> "882 | C[C]CS[C@H]1[N]C(=O)C1N" [label=""]
	"883 | [C]C(=O)O" [color=lightgrey shape=box style=filled]
	447 -> "883 | [C]C(=O)O" [label=""]
	"884 | CCCS[C@H]1NC(=O)C1N" [color=lightgrey shape=box style=filled]
	448 -> "884 | CCCS[C@H]1NC(=O)C1N" [label=""]
	"885 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	448 -> "885 | O=C(O)CO" [label=""]
	"886 | CCCS[C@@H]1C(NC(=O)OC(C)(C)C)C(=O)N1CC(=O)O" [color=lightgrey shape=box style=filled]
	449 -> "886 | CCCS[C@@H]1C(NC(=O)OC(C)(C)C)C(=O)N1CC(=O)O" [label=""]
	"887 | CCCS[C@@H]1C(N)C(=O)N1C(O)C(=O)O" [color=lightgrey shape=box style=filled]
	450 -> "887 | CCCS[C@@H]1C(N)C(=O)N1C(O)C(=O)O" [label=""]
	"888 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	451 -> "888 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"889 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	451 -> "889 | CCC(C)(C)OC(=O)O" [label=""]
	"890 | CC(C)(C)OC(=O)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	452 -> "890 | CC(C)(C)OC(=O)OC(=O)Cl" [label=""]
	"891 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	452 -> "891 | CCC(C)(C)O" [label=""]
	"892 | CC(C)(C)OC(=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	453 -> "892 | CC(C)(C)OC(=O)OC(=O)O" [label=""]
	"893 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	453 -> "893 | CCC(C)(C)O" [label=""]
	"894 | CCC(C)(C)OC(=O)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	454 -> "894 | CCC(C)(C)OC(=O)OC(=O)Cl" [label=""]
	"895 | CC(C)(C)O" [color=lightyellow shape=box style=filled]
	454 -> "895 | CC(C)(C)O" [label=""]
	"896 | CC(C)(C)OC(=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	455 -> "896 | CC(C)(C)OC(=O)OC(=O)O" [label=""]
	"897 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	455 -> "897 | CCC(C)(C)O" [label=""]
	"898 | CC(C)(C)OC(=O)O[C]=O" [color=lightgrey shape=box style=filled]
	456 -> "898 | CC(C)(C)OC(=O)O[C]=O" [label=""]
	"899 | CCC(C)(C)[O]" [color=lightgrey shape=box style=filled]
	456 -> "899 | CCC(C)(C)[O]" [label=""]
	"900 | CC(C)(C)O" [color=lightyellow shape=box style=filled]
	457 -> "900 | CC(C)(C)O" [label=""]
	"901 | CCC(C)(C)OC(=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	457 -> "901 | CCC(C)(C)OC(=O)OC(=O)O" [label=""]
	"902 | CC(C)(C)OC(=O)OC=O" [color=lightgrey shape=box style=filled]
	458 -> "902 | CC(C)(C)OC(=O)OC=O" [label=""]
	"903 | CC(Br)C(C)(C)O" [color=lightyellow shape=box style=filled]
	458 -> "903 | CC(Br)C(C)(C)O" [label=""]
	"904 | CC(C)(C)OC(=O)OC(=O)Br" [color=lightgrey shape=box style=filled]
	459 -> "904 | CC(C)(C)OC(=O)OC(=O)Br" [label=""]
	"905 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	459 -> "905 | CCC(C)(C)O" [label=""]
	"906 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	460 -> "906 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"907 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	460 -> "907 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [label=""]
	"908 | Nc1nc(C(O)C(=O)Cl)cs1" [color=lightgrey shape=box style=filled]
	461 -> "908 | Nc1nc(C(O)C(=O)Cl)cs1" [label=""]
	"909 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	461 -> "909 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [label=""]
	"910 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	462 -> "910 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [label=""]
	"911 | Nc1nc(C=O)cs1" [color=lightyellow shape=box style=filled]
	462 -> "911 | Nc1nc(C=O)cs1" [label=""]
	"912 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)C(=O)C(=O)O" [color=lightgrey shape=box style=filled]
	463 -> "912 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)C(=O)C(=O)O" [label=""]
	"913 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)CC(=O)O" [color=lightgrey shape=box style=filled]
	464 -> "913 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)CC(=O)O" [label=""]
	"914 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	465 -> "914 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)O)[C@H]2SC1" [label=""]
	"915 | Nc1nc(C=O)cs1" [color=lightyellow shape=box style=filled]
	465 -> "915 | Nc1nc(C=O)cs1" [label=""]
	"916 | Nc1nc(CO)cs1" [color=lightyellow shape=box style=filled]
	466 -> "916 | Nc1nc(CO)cs1" [label=""]
	"917 | CC1=C(C(=O)O)N2C(=O)C(N=C=O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	466 -> "917 | CC1=C(C(=O)O)N2C(=O)C(N=C=O)[C@H]2SC1" [label=""]
	"918 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	467 -> "918 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [label=""]
	"919 | Nc1nc(C(=O)O)cs1" [color=lightyellow shape=box style=filled]
	467 -> "919 | Nc1nc(C(=O)O)cs1" [label=""]
	"920 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(O)C(=O)O" [color=lightgrey shape=box style=filled]
	468 -> "920 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(O)C(=O)O" [label=""]
	"921 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(Cl)C(=O)O" [color=lightgrey shape=box style=filled]
	469 -> "921 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(Cl)C(=O)O" [label=""]
	"922 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	470 -> "922 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"923 | CC1=CN2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	470 -> "923 | CC1=CN2C(=O)C(N)[C@H]2SC1" [label=""]
	"924 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	471 -> "924 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"925 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	471 -> "925 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"926 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	472 -> "926 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"927 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	472 -> "927 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"928 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	472 -> "928 | CCC(C)(C)OC(=O)O" [label=""]
	"929 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	473 -> "929 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"930 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	473 -> "930 | CCC(C)(C)OC(=O)O" [label=""]
	"931 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	474 -> "931 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"932 | CCC(C)(C)OCO" [color=lightgrey shape=box style=filled]
	474 -> "932 | CCC(C)(C)OCO" [label=""]
	"933 | CC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	475 -> "933 | CC(C)(C)OC(=O)O" [label=""]
	"934 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	475 -> "934 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"935 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	475 -> "935 | CCC(C)(C)OC(=O)O" [label=""]
	"936 | CC(C)(C)OC(=O)Cl" [color=lightyellow shape=box style=filled]
	476 -> "936 | CC(C)(C)OC(=O)Cl" [label=""]
	"937 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	476 -> "937 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"938 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	476 -> "938 | CCC(C)(C)OC(=O)O" [label=""]
	"939 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	477 -> "939 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"940 | CC(C)(C)O[C]=O" [color=lightgrey shape=box style=filled]
	477 -> "940 | CC(C)(C)O[C]=O" [label=""]
	"941 | CCC(C)(C)OC([O])=O" [color=lightgrey shape=box style=filled]
	477 -> "941 | CCC(C)(C)OC([O])=O" [label=""]
	"942 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	478 -> "942 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"943 | CC(C)(C)O[C]=O" [color=lightgrey shape=box style=filled]
	478 -> "943 | CC(C)(C)O[C]=O" [label=""]
	"944 | CCC(C)(C)OC([O])=O" [color=lightgrey shape=box style=filled]
	478 -> "944 | CCC(C)(C)OC([O])=O" [label=""]
	"945 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	479 -> "945 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"946 | CC(C)(C)OC([O])=O" [color=lightgrey shape=box style=filled]
	479 -> "946 | CC(C)(C)OC([O])=O" [label=""]
	"947 | CC(C)(C)O[C]=O" [color=lightgrey shape=box style=filled]
	479 -> "947 | CC(C)(C)O[C]=O" [label=""]
	"948 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	479 -> "948 | CCC(C)(C)OC(=O)O" [label=""]
	"949 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	480 -> "949 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"950 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	480 -> "950 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [label=""]
	"951 | Nc1nc(C(O)C(=O)Cl)cs1" [color=lightgrey shape=box style=filled]
	481 -> "951 | Nc1nc(C(O)C(=O)Cl)cs1" [label=""]
	"952 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	481 -> "952 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [label=""]
	"953 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	482 -> "953 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [label=""]
	"954 | Nc1nc(C=O)cs1" [color=lightyellow shape=box style=filled]
	482 -> "954 | Nc1nc(C=O)cs1" [label=""]
	"955 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)C(=O)C(=O)O" [color=lightgrey shape=box style=filled]
	483 -> "955 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)C(=O)C(=O)O" [label=""]
	"956 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)CC(=O)O" [color=lightgrey shape=box style=filled]
	484 -> "956 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)CC(=O)O" [label=""]
	"957 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	485 -> "957 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)O)[C@H]2SC1" [label=""]
	"958 | Nc1nc(C=O)cs1" [color=lightyellow shape=box style=filled]
	485 -> "958 | Nc1nc(C=O)cs1" [label=""]
	"959 | Nc1nc(CO)cs1" [color=lightyellow shape=box style=filled]
	486 -> "959 | Nc1nc(CO)cs1" [label=""]
	"960 | CC1=C(C(=O)O)N2C(=O)C(N=C=O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	486 -> "960 | CC1=C(C(=O)O)N2C(=O)C(N=C=O)[C@H]2SC1" [label=""]
	"961 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	487 -> "961 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [label=""]
	"962 | Nc1nc(C(=O)O)cs1" [color=lightyellow shape=box style=filled]
	487 -> "962 | Nc1nc(C(=O)O)cs1" [label=""]
	"963 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(O)C(=O)O" [color=lightgrey shape=box style=filled]
	488 -> "963 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(O)C(=O)O" [label=""]
	"964 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(Cl)C(=O)O" [color=lightgrey shape=box style=filled]
	489 -> "964 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(Cl)C(=O)O" [label=""]
	"965 | O=C=O" [color=lightyellow shape=box style=filled]
	490 -> "965 | O=C=O" [label=""]
	"966 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	490 -> "966 | CCC(C)(C)O" [label=""]
	"967 | O=C(O)O" [color=lightyellow shape=box style=filled]
	491 -> "967 | O=C(O)O" [label=""]
	"968 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	491 -> "968 | CCC(C)(C)O" [label=""]
	"969 | CCC(C)(C)Cl" [color=lightyellow shape=box style=filled]
	492 -> "969 | CCC(C)(C)Cl" [label=""]
	"970 | O=C(O)O" [color=lightyellow shape=box style=filled]
	492 -> "970 | O=C(O)O" [label=""]
	"971 | CC(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	493 -> "971 | CC(C)OC(=O)O" [label=""]
	"972 | CCI" [color=lightyellow shape=box style=filled]
	493 -> "972 | CCI" [label=""]
	"973 | O=C(O)O" [color=lightyellow shape=box style=filled]
	494 -> "973 | O=C(O)O" [label=""]
	"974 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	494 -> "974 | CCC(C)(C)O" [label=""]
	"975 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	495 -> "975 | O=C(O)Cl" [label=""]
	"976 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	495 -> "976 | CCC(C)(C)O" [label=""]
	"977 | CCO" [color=lightyellow shape=box style=filled]
	496 -> "977 | CCO" [label=""]
	"978 | CC(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	496 -> "978 | CC(C)OC(=O)O" [label=""]
	"979 | CCOP(=O)(OCC)OC(=O)OC(C)C" [color=lightgrey shape=box style=filled]
	497 -> "979 | CCOP(=O)(OCC)OC(=O)OC(C)C" [label=""]
	"980 | CCI" [color=lightyellow shape=box style=filled]
	497 -> "980 | CCI" [label=""]
	"981 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	498 -> "981 | Nc1nccs1" [label=""]
	"982 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	498 -> "982 | O=CC(=O)O" [label=""]
	"983 | Nc1nc(CO)cs1" [color=lightyellow shape=box style=filled]
	499 -> "983 | Nc1nc(CO)cs1" [label=""]
	"984 | O=C=O" [color=lightyellow shape=box style=filled]
	499 -> "984 | O=C=O" [label=""]
	"985 | O=C(O)C(=O)O" [color=lightyellow shape=box style=filled]
	500 -> "985 | O=C(O)C(=O)O" [label=""]
	"986 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	500 -> "986 | Nc1nccs1" [label=""]
	"987 | O=C(O)C(O)c1csc([N+](=O)[O-])n1" [color=lightgrey shape=box style=filled]
	501 -> "987 | O=C(O)C(O)c1csc([N+](=O)[O-])n1" [label=""]
	"988 | Nc1nc(Br)cs1" [color=lightyellow shape=box style=filled]
	502 -> "988 | Nc1nc(Br)cs1" [label=""]
	"989 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	502 -> "989 | O=C(O)CO" [label=""]
	"990 | Nc1nc(C(=O)C(=O)O)cs1" [color=lightyellow shape=box style=filled]
	503 -> "990 | Nc1nc(C(=O)C(=O)O)cs1" [label=""]
	"991 | O" [color=lightyellow shape=box style=filled]
	503 -> "991 | O" [label=""]
	"992 | Nc1nc(Cl)cs1" [color=lightyellow shape=box style=filled]
	504 -> "992 | Nc1nc(Cl)cs1" [label=""]
	"993 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	504 -> "993 | O=C(O)CO" [label=""]
	"994 | O=CO" [color=lightyellow shape=box style=filled]
	505 -> "994 | O=CO" [label=""]
	"995 | Nc1nc(C=O)cs1" [color=lightyellow shape=box style=filled]
	505 -> "995 | Nc1nc(C=O)cs1" [label=""]
	"996 | O=C(O)C(O)c1csc(N[O-])n1" [color=lightgrey shape=box style=filled]
	506 -> "996 | O=C(O)C(O)c1csc(N[O-])n1" [label=""]
	"997 | Nc1nc(C(=O)C(=O)O)cs1" [color=lightyellow shape=box style=filled]
	507 -> "997 | Nc1nc(C(=O)C(=O)O)cs1" [label=""]
	"998 | OO" [color=lightyellow shape=box style=filled]
	507 -> "998 | OO" [label=""]
	"999 | CC1=C(C(=O)O)N[C@@H](C(N)C(=O)O)SC1" [color=lightgrey shape=box style=filled]
	508 -> "999 | CC1=C(C(=O)O)N[C@@H](C(N)C(=O)O)SC1" [label=""]
	"1000 | O=C=O" [color=lightyellow shape=box style=filled]
	509 -> "1000 | O=C=O" [label=""]
	"1001 | CC1=CN2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	509 -> "1001 | CC1=CN2C(=O)C(N)[C@H]2SC1" [label=""]
	"1002 | CC(CS[C@H]1NC(=O)C1N)CC(=O)O" [color=lightgrey shape=box style=filled]
	510 -> "1002 | CC(CS[C@H]1NC(=O)C1N)CC(=O)O" [label=""]
	"1003 | CC(CS[C@H]1NC(=O)C1N)C(=O)C(=O)O" [color=lightgrey shape=box style=filled]
	511 -> "1003 | CC(CS[C@H]1NC(=O)C1N)C(=O)C(=O)O" [label=""]
	"1004 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)OC(C)(C)C)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	512 -> "1004 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)OC(C)(C)C)[C@H]2SC1" [label=""]
	"1005 | CCCS[C@H]1NC(=O)C1N" [color=lightgrey shape=box style=filled]
	513 -> "1005 | CCCS[C@H]1NC(=O)C1N" [label=""]
	"1006 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	513 -> "1006 | O=CC(=O)O" [label=""]
	"1007 | C[C]CS[C@H]1[N]C(=O)C1N" [color=lightgrey shape=box style=filled]
	514 -> "1007 | C[C]CS[C@H]1[N]C(=O)C1N" [label=""]
	"1008 | [C]C(=O)O" [color=lightgrey shape=box style=filled]
	514 -> "1008 | [C]C(=O)O" [label=""]
	"1009 | CCCS[C@H]1NC(=O)C1N" [color=lightgrey shape=box style=filled]
	515 -> "1009 | CCCS[C@H]1NC(=O)C1N" [label=""]
	"1010 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	515 -> "1010 | O=C(O)CO" [label=""]
	"1011 | CCCS[C@@H]1C(NC(=O)OC(C)(C)C)C(=O)N1CC(=O)O" [color=lightgrey shape=box style=filled]
	516 -> "1011 | CCCS[C@@H]1C(NC(=O)OC(C)(C)C)C(=O)N1CC(=O)O" [label=""]
	"1012 | CCCS[C@@H]1C(N)C(=O)N1C(O)C(=O)O" [color=lightgrey shape=box style=filled]
	517 -> "1012 | CCCS[C@@H]1C(N)C(=O)N1C(O)C(=O)O" [label=""]
	"1013 | O=CO" [color=lightyellow shape=box style=filled]
	518 -> "1013 | O=CO" [label=""]
	"1014 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	518 -> "1014 | CCC(C)(C)O" [label=""]
	"1015 | CCI" [color=lightyellow shape=box style=filled]
	519 -> "1015 | CCI" [label=""]
	"1016 | CC(C)OC=O" [color=lightyellow shape=box style=filled]
	519 -> "1016 | CC(C)OC=O" [label=""]
	"1017 | CN(C)C=O" [color=lightyellow shape=box style=filled]
	520 -> "1017 | CN(C)C=O" [label=""]
	"1018 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	520 -> "1018 | CCC(C)(C)O" [label=""]
	"1019 | O=C(OO)c1cccc(Cl)c1" [color=lightyellow shape=box style=filled]
	521 -> "1019 | O=C(OO)c1cccc(Cl)c1" [label=""]
	"1020 | CCC(C)(C)OC" [color=lightyellow shape=box style=filled]
	521 -> "1020 | CCC(C)(C)OC" [label=""]
	"1021 | CCBr" [color=lightyellow shape=box style=filled]
	522 -> "1021 | CCBr" [label=""]
	"1022 | CC(C)OC=O" [color=lightyellow shape=box style=filled]
	522 -> "1022 | CC(C)OC=O" [label=""]
	"1023 | CCC(C)(C)Cl" [color=lightyellow shape=box style=filled]
	523 -> "1023 | CCC(C)(C)Cl" [label=""]
	"1024 | O=CO" [color=lightyellow shape=box style=filled]
	523 -> "1024 | O=CO" [label=""]
	"1025 | CCO" [color=lightyellow shape=box style=filled]
	524 -> "1025 | CCO" [label=""]
	"1026 | CC(C)OC=O" [color=lightyellow shape=box style=filled]
	524 -> "1026 | CC(C)OC=O" [label=""]
	"1027 | O=CO" [color=lightyellow shape=box style=filled]
	525 -> "1027 | O=CO" [label=""]
	"1028 | C=C(C)CC" [color=lightgrey shape=box style=filled]
	525 -> "1028 | C=C(C)CC" [label=""]
	"1029 | O=CO" [color=lightyellow shape=box style=filled]
	526 -> "1029 | O=CO" [label=""]
	"1030 | C=C(C)CC" [color=lightgrey shape=box style=filled]
	526 -> "1030 | C=C(C)CC" [label=""]
	"1031 | CC(=O)C(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	527 -> "1031 | CC(=O)C(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"1032 | CC1=CN2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	527 -> "1032 | CC1=CN2C(=O)C(N)[C@H]2SC1" [label=""]
	"1033 | CC(=O)C(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	528 -> "1033 | CC(=O)C(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"1034 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	528 -> "1034 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1035 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	529 -> "1035 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"1036 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	529 -> "1036 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1037 | CC(=O)C(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	529 -> "1037 | CC(=O)C(C)(C)OC(=O)O" [label=""]
	"1038 | CC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	530 -> "1038 | CC(C)(C)OC(=O)O" [label=""]
	"1039 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	530 -> "1039 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1040 | CC(=O)C(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	530 -> "1040 | CC(=O)C(C)(C)OC(=O)O" [label=""]
	"1041 | CC(C)(C)OC(=O)Cl" [color=lightyellow shape=box style=filled]
	531 -> "1041 | CC(C)(C)OC(=O)Cl" [label=""]
	"1042 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	531 -> "1042 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1043 | CC(=O)C(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	531 -> "1043 | CC(=O)C(C)(C)OC(=O)O" [label=""]
	"1044 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	532 -> "1044 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1045 | CC(C)(C)O[C]=O" [color=lightgrey shape=box style=filled]
	532 -> "1045 | CC(C)(C)O[C]=O" [label=""]
	"1046 | CC(=O)C(C)(C)OC([O])=O" [color=lightgrey shape=box style=filled]
	532 -> "1046 | CC(=O)C(C)(C)OC([O])=O" [label=""]
	"1047 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	533 -> "1047 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1048 | CC(=O)C(C)(C)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	533 -> "1048 | CC(=O)C(C)(C)OC(=O)Cl" [label=""]
	"1049 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	534 -> "1049 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1050 | CC(C)(C)O[C]=O" [color=lightgrey shape=box style=filled]
	534 -> "1050 | CC(C)(C)O[C]=O" [label=""]
	"1051 | CC(=O)C(C)(C)OC([O])=O" [color=lightgrey shape=box style=filled]
	534 -> "1051 | CC(=O)C(C)(C)OC([O])=O" [label=""]
	"1052 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	535 -> "1052 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1053 | CC(C)(C)OC([O])=O" [color=lightgrey shape=box style=filled]
	535 -> "1053 | CC(C)(C)OC([O])=O" [label=""]
	"1054 | CC(C)(C)O[C]=O" [color=lightgrey shape=box style=filled]
	535 -> "1054 | CC(C)(C)O[C]=O" [label=""]
	"1055 | CC(=O)C(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	535 -> "1055 | CC(=O)C(C)(C)OC(=O)O" [label=""]
	"1056 | CC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	536 -> "1056 | CC(C)(C)OC(=O)O" [label=""]
	"1057 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	536 -> "1057 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"1058 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	536 -> "1058 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1059 | CC(=O)C(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	536 -> "1059 | CC(=O)C(C)(C)OC(=O)O" [label=""]
	"1060 | O=C=O" [color=lightyellow shape=box style=filled]
	537 -> "1060 | O=C=O" [label=""]
	"1061 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	537 -> "1061 | CCC(C)(C)O" [label=""]
	"1062 | O=C(O)O" [color=lightyellow shape=box style=filled]
	538 -> "1062 | O=C(O)O" [label=""]
	"1063 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	538 -> "1063 | CCC(C)(C)O" [label=""]
	"1064 | CCC(C)(C)Cl" [color=lightyellow shape=box style=filled]
	539 -> "1064 | CCC(C)(C)Cl" [label=""]
	"1065 | O=C(O)O" [color=lightyellow shape=box style=filled]
	539 -> "1065 | O=C(O)O" [label=""]
	"1066 | CC(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	540 -> "1066 | CC(C)OC(=O)O" [label=""]
	"1067 | CCI" [color=lightyellow shape=box style=filled]
	540 -> "1067 | CCI" [label=""]
	"1068 | O=C(O)O" [color=lightyellow shape=box style=filled]
	541 -> "1068 | O=C(O)O" [label=""]
	"1069 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	541 -> "1069 | CCC(C)(C)O" [label=""]
	"1070 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	542 -> "1070 | O=C(O)Cl" [label=""]
	"1071 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	542 -> "1071 | CCC(C)(C)O" [label=""]
	"1072 | CCO" [color=lightyellow shape=box style=filled]
	543 -> "1072 | CCO" [label=""]
	"1073 | CC(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	543 -> "1073 | CC(C)OC(=O)O" [label=""]
	"1074 | CCOP(=O)(OCC)OC(=O)OC(C)C" [color=lightgrey shape=box style=filled]
	544 -> "1074 | CCOP(=O)(OCC)OC(=O)OC(C)C" [label=""]
	"1075 | CCI" [color=lightyellow shape=box style=filled]
	544 -> "1075 | CCI" [label=""]
	"1076 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	545 -> "1076 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"1077 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	545 -> "1077 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [label=""]
	"1078 | Nc1nc(C(O)C(=O)Cl)cs1" [color=lightgrey shape=box style=filled]
	546 -> "1078 | Nc1nc(C(O)C(=O)Cl)cs1" [label=""]
	"1079 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	546 -> "1079 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [label=""]
	"1080 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	547 -> "1080 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [label=""]
	"1081 | Nc1nc(C=O)cs1" [color=lightyellow shape=box style=filled]
	547 -> "1081 | Nc1nc(C=O)cs1" [label=""]
	"1082 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)C(=O)C(=O)O" [color=lightgrey shape=box style=filled]
	548 -> "1082 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)C(=O)C(=O)O" [label=""]
	"1083 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)CC(=O)O" [color=lightgrey shape=box style=filled]
	549 -> "1083 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)CC(=O)O" [label=""]
	"1084 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	550 -> "1084 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)O)[C@H]2SC1" [label=""]
	"1085 | Nc1nc(C=O)cs1" [color=lightyellow shape=box style=filled]
	550 -> "1085 | Nc1nc(C=O)cs1" [label=""]
	"1086 | Nc1nc(CO)cs1" [color=lightyellow shape=box style=filled]
	551 -> "1086 | Nc1nc(CO)cs1" [label=""]
	"1087 | CC1=C(C(=O)O)N2C(=O)C(N=C=O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	551 -> "1087 | CC1=C(C(=O)O)N2C(=O)C(N=C=O)[C@H]2SC1" [label=""]
	"1088 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	552 -> "1088 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [label=""]
	"1089 | Nc1nc(C(=O)O)cs1" [color=lightyellow shape=box style=filled]
	552 -> "1089 | Nc1nc(C(=O)O)cs1" [label=""]
	"1090 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(O)C(=O)O" [color=lightgrey shape=box style=filled]
	553 -> "1090 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(O)C(=O)O" [label=""]
	"1091 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(Cl)C(=O)O" [color=lightgrey shape=box style=filled]
	554 -> "1091 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(Cl)C(=O)O" [label=""]
	"1092 | C=O" [color=lightyellow shape=box style=filled]
	555 -> "1092 | C=O" [label=""]
	"1093 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	555 -> "1093 | CCC(C)(C)O" [label=""]
	"1094 | O=CO" [color=lightyellow shape=box style=filled]
	556 -> "1094 | O=CO" [label=""]
	"1095 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	556 -> "1095 | CCC(C)(C)O" [label=""]
	"1096 | OCO" [color=lightyellow shape=box style=filled]
	557 -> "1096 | OCO" [label=""]
	"1097 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	557 -> "1097 | CCC(C)(C)O" [label=""]
	"1098 | CCC(C)(C)Cl" [color=lightyellow shape=box style=filled]
	558 -> "1098 | CCC(C)(C)Cl" [label=""]
	"1099 | OCO" [color=lightyellow shape=box style=filled]
	558 -> "1099 | OCO" [label=""]
	"1100 | CO" [color=lightyellow shape=box style=filled]
	559 -> "1100 | CO" [label=""]
	"1101 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	559 -> "1101 | CCC(C)(C)O" [label=""]
	"1102 | CO" [color=lightyellow shape=box style=filled]
	560 -> "1102 | CO" [label=""]
	"1103 | O" [color=lightyellow shape=box style=filled]
	560 -> "1103 | O" [label=""]
	"1104 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	560 -> "1104 | CCC(C)(C)O" [label=""]
	"1105 | O=CO" [color=lightyellow shape=box style=filled]
	561 -> "1105 | O=CO" [label=""]
	"1106 | CCC(C)C" [color=lightyellow shape=box style=filled]
	561 -> "1106 | CCC(C)C" [label=""]
	"1107 | OC[P+](c1ccccc1)(c1ccccc1)c1ccccc1" [color=lightyellow shape=box style=filled]
	562 -> "1107 | OC[P+](c1ccccc1)(c1ccccc1)c1ccccc1" [label=""]
	"1108 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	562 -> "1108 | CCC(C)(C)O" [label=""]
	"1109 | C=O" [color=lightyellow shape=box style=filled]
	563 -> "1109 | C=O" [label=""]
	"1110 | CC(=O)C(C)(C)O" [color=lightyellow shape=box style=filled]
	563 -> "1110 | CC(=O)C(C)(C)O" [label=""]
	"1111 | O=CO" [color=lightyellow shape=box style=filled]
	564 -> "1111 | O=CO" [label=""]
	"1112 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	564 -> "1112 | CCC(C)(C)O" [label=""]
	"1113 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	565 -> "1113 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"1114 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	565 -> "1114 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [label=""]
	"1115 | Nc1nc(C(O)C(=O)Cl)cs1" [color=lightgrey shape=box style=filled]
	566 -> "1115 | Nc1nc(C(O)C(=O)Cl)cs1" [label=""]
	"1116 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	566 -> "1116 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [label=""]
	"1117 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	567 -> "1117 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [label=""]
	"1118 | Nc1nc(C=O)cs1" [color=lightyellow shape=box style=filled]
	567 -> "1118 | Nc1nc(C=O)cs1" [label=""]
	"1119 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)C(=O)C(=O)O" [color=lightgrey shape=box style=filled]
	568 -> "1119 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)C(=O)C(=O)O" [label=""]
	"1120 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)CC(=O)O" [color=lightgrey shape=box style=filled]
	569 -> "1120 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)CC(=O)O" [label=""]
	"1121 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	570 -> "1121 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)O)[C@H]2SC1" [label=""]
	"1122 | Nc1nc(C=O)cs1" [color=lightyellow shape=box style=filled]
	570 -> "1122 | Nc1nc(C=O)cs1" [label=""]
	"1123 | Nc1nc(CO)cs1" [color=lightyellow shape=box style=filled]
	571 -> "1123 | Nc1nc(CO)cs1" [label=""]
	"1124 | CC1=C(C(=O)O)N2C(=O)C(N=C=O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	571 -> "1124 | CC1=C(C(=O)O)N2C(=O)C(N=C=O)[C@H]2SC1" [label=""]
	"1125 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	572 -> "1125 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [label=""]
	"1126 | Nc1nc(C(=O)O)cs1" [color=lightyellow shape=box style=filled]
	572 -> "1126 | Nc1nc(C(=O)O)cs1" [label=""]
	"1127 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(O)C(=O)O" [color=lightgrey shape=box style=filled]
	573 -> "1127 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(O)C(=O)O" [label=""]
	"1128 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(Cl)C(=O)O" [color=lightgrey shape=box style=filled]
	574 -> "1128 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(Cl)C(=O)O" [label=""]
	"1129 | CC(C)(C)O" [color=lightyellow shape=box style=filled]
	575 -> "1129 | CC(C)(C)O" [label=""]
	"1130 | O=C=O" [color=lightyellow shape=box style=filled]
	575 -> "1130 | O=C=O" [label=""]
	"1131 | CC(C)(C)Cl" [color=lightyellow shape=box style=filled]
	576 -> "1131 | CC(C)(C)Cl" [label=""]
	"1132 | O=C(O)O" [color=lightyellow shape=box style=filled]
	576 -> "1132 | O=C(O)O" [label=""]
	"1133 | O=C(O)O" [color=lightyellow shape=box style=filled]
	577 -> "1133 | O=C(O)O" [label=""]
	"1134 | CC(C)(C)Br" [color=lightyellow shape=box style=filled]
	577 -> "1134 | CC(C)(C)Br" [label=""]
	"1135 | O=C(OO)c1cccc(Cl)c1" [color=lightyellow shape=box style=filled]
	578 -> "1135 | O=C(OO)c1cccc(Cl)c1" [label=""]
	"1136 | CC(C)(C)OCO" [color=lightgrey shape=box style=filled]
	578 -> "1136 | CC(C)(C)OCO" [label=""]
	"1137 | CC(C)(C)O" [color=lightyellow shape=box style=filled]
	579 -> "1137 | CC(C)(C)O" [label=""]
	"1138 | O=C(O)O" [color=lightyellow shape=box style=filled]
	579 -> "1138 | O=C(O)O" [label=""]
	"1139 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	580 -> "1139 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"1140 | O" [color=lightyellow shape=box style=filled]
	580 -> "1140 | O" [label=""]
	"1141 | CI" [color=lightyellow shape=box style=filled]
	581 -> "1141 | CI" [label=""]
	"1142 | CCOP(=O)(OCC)OC(=O)OC(C)C" [color=lightgrey shape=box style=filled]
	581 -> "1142 | CCOP(=O)(OCC)OC(=O)OC(C)C" [label=""]
	"1143 | CC(C)(C)O" [color=lightyellow shape=box style=filled]
	582 -> "1143 | CC(C)(C)O" [label=""]
	"1144 | O=C(O)O" [color=lightyellow shape=box style=filled]
	582 -> "1144 | O=C(O)O" [label=""]
	"1145 | CC(C)(C)OC(=O)OC(O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	583 -> "1145 | CC(C)(C)OC(=O)OC(O)OC(C)(C)C" [label=""]
	"1146 | O" [color=lightyellow shape=box style=filled]
	583 -> "1146 | O" [label=""]
	"1147 | CO" [color=lightyellow shape=box style=filled]
	584 -> "1147 | CO" [label=""]
	"1148 | CC(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	584 -> "1148 | CC(C)OC(=O)O" [label=""]
	"1149 | O=C=O" [color=lightyellow shape=box style=filled]
	585 -> "1149 | O=C=O" [label=""]
	"1150 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	585 -> "1150 | CCC(C)(C)O" [label=""]
	"1151 | O=C(O)O" [color=lightyellow shape=box style=filled]
	586 -> "1151 | O=C(O)O" [label=""]
	"1152 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	586 -> "1152 | CCC(C)(C)O" [label=""]
	"1153 | CCC(C)(C)Cl" [color=lightyellow shape=box style=filled]
	587 -> "1153 | CCC(C)(C)Cl" [label=""]
	"1154 | O=C(O)O" [color=lightyellow shape=box style=filled]
	587 -> "1154 | O=C(O)O" [label=""]
	"1155 | CC(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	588 -> "1155 | CC(C)OC(=O)O" [label=""]
	"1156 | CCI" [color=lightyellow shape=box style=filled]
	588 -> "1156 | CCI" [label=""]
	"1157 | O=C(O)O" [color=lightyellow shape=box style=filled]
	589 -> "1157 | O=C(O)O" [label=""]
	"1158 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	589 -> "1158 | CCC(C)(C)O" [label=""]
	"1159 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	590 -> "1159 | O=C(O)Cl" [label=""]
	"1160 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	590 -> "1160 | CCC(C)(C)O" [label=""]
	"1161 | CCO" [color=lightyellow shape=box style=filled]
	591 -> "1161 | CCO" [label=""]
	"1162 | CC(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	591 -> "1162 | CC(C)OC(=O)O" [label=""]
	"1163 | CCOP(=O)(OCC)OC(=O)OC(C)C" [color=lightgrey shape=box style=filled]
	592 -> "1163 | CCOP(=O)(OCC)OC(=O)OC(C)C" [label=""]
	"1164 | CCI" [color=lightyellow shape=box style=filled]
	592 -> "1164 | CCI" [label=""]
	"1165 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	593 -> "1165 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"1166 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	593 -> "1166 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [label=""]
	"1167 | Nc1nc(C(O)C(=O)Cl)cs1" [color=lightgrey shape=box style=filled]
	594 -> "1167 | Nc1nc(C(O)C(=O)Cl)cs1" [label=""]
	"1168 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	594 -> "1168 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [label=""]
	"1169 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	595 -> "1169 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [label=""]
	"1170 | Nc1nc(C=O)cs1" [color=lightyellow shape=box style=filled]
	595 -> "1170 | Nc1nc(C=O)cs1" [label=""]
	"1171 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)C(=O)C(=O)O" [color=lightgrey shape=box style=filled]
	596 -> "1171 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)C(=O)C(=O)O" [label=""]
	"1172 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)CC(=O)O" [color=lightgrey shape=box style=filled]
	597 -> "1172 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)CC(=O)O" [label=""]
	"1173 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	598 -> "1173 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)O)[C@H]2SC1" [label=""]
	"1174 | Nc1nc(C=O)cs1" [color=lightyellow shape=box style=filled]
	598 -> "1174 | Nc1nc(C=O)cs1" [label=""]
	"1175 | Nc1nc(CO)cs1" [color=lightyellow shape=box style=filled]
	599 -> "1175 | Nc1nc(CO)cs1" [label=""]
	"1176 | CC1=C(C(=O)O)N2C(=O)C(N=C=O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	599 -> "1176 | CC1=C(C(=O)O)N2C(=O)C(N=C=O)[C@H]2SC1" [label=""]
	"1177 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	600 -> "1177 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [label=""]
	"1178 | Nc1nc(C(=O)O)cs1" [color=lightyellow shape=box style=filled]
	600 -> "1178 | Nc1nc(C(=O)O)cs1" [label=""]
	"1179 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(O)C(=O)O" [color=lightgrey shape=box style=filled]
	601 -> "1179 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(O)C(=O)O" [label=""]
	"1180 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(Cl)C(=O)O" [color=lightgrey shape=box style=filled]
	602 -> "1180 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(Cl)C(=O)O" [label=""]
	"1181 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	603 -> "1181 | O=C1CCC(=O)N1Br" [label=""]
	"1182 | SBr" [color=lightgrey shape=box style=filled]
	603 -> "1182 | SBr" [label=""]
	"1183 | CI" [color=lightyellow shape=box style=filled]
	604 -> "1183 | CI" [label=""]
	"1184 | c1nncs1" [color=lightyellow shape=box style=filled]
	604 -> "1184 | c1nncs1" [label=""]
	"1185 | CC(S)=NN" [color=lightgrey shape=box style=filled]
	605 -> "1185 | CC(S)=NN" [label=""]
	"1186 | C=O" [color=lightyellow shape=box style=filled]
	605 -> "1186 | C=O" [label=""]
	"1187 | CC(=N)S" [color=lightgrey shape=box style=filled]
	606 -> "1187 | CC(=N)S" [label=""]
	"1188 | NC=O" [color=lightyellow shape=box style=filled]
	606 -> "1188 | NC=O" [label=""]
	"1189 | CC(=N)SCN" [color=lightgrey shape=box style=filled]
	607 -> "1189 | CC(=N)SCN" [label=""]
	"1190 | CC(=N)S" [color=lightgrey shape=box style=filled]
	608 -> "1190 | CC(=N)S" [label=""]
	"1191 | NC=O" [color=lightyellow shape=box style=filled]
	608 -> "1191 | NC=O" [label=""]
	"1192 | N" [color=lightyellow shape=box style=filled]
	609 -> "1192 | N" [label=""]
	"1193 | CSC(C)N" [color=lightgrey shape=box style=filled]
	609 -> "1193 | CSC(C)N" [label=""]
	"1194 | N=CS" [color=lightgrey shape=box style=filled]
	610 -> "1194 | N=CS" [label=""]
	"1195 | CC(N)=O" [color=lightyellow shape=box style=filled]
	610 -> "1195 | CC(N)=O" [label=""]
	"1196 | CC(=N)SC=N" [color=lightgrey shape=box style=filled]
	611 -> "1196 | CC(=N)SC=N" [label=""]
	"1197 | CC(O)S" [color=lightgrey shape=box style=filled]
	612 -> "1197 | CC(O)S" [label=""]
	"1198 | C=NN" [color=lightgrey shape=box style=filled]
	612 -> "1198 | C=NN" [label=""]
	"1199 | [SH]" [color=lightgrey shape=box style=filled]
	613 -> "1199 | [SH]" [label=""]
	"1200 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	613 -> "1200 | O=C1CCC(=O)N1Br" [label=""]
	"1201 | O=C=[S]Br" [color=lightgrey shape=box style=filled]
	614 -> "1201 | O=C=[S]Br" [label=""]
	"1202 | NN" [color=lightyellow shape=box style=filled]
	614 -> "1202 | NN" [label=""]
	"1203 | C=NNC(=O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	615 -> "1203 | C=NNC(=O)OC(C)(C)C" [label=""]
	"1204 | SBr" [color=lightgrey shape=box style=filled]
	615 -> "1204 | SBr" [label=""]
	"1205 | [N]N" [color=lightgrey shape=box style=filled]
	616 -> "1205 | [N]N" [label=""]
	"1206 | [C]=[S]Br" [color=lightgrey shape=box style=filled]
	616 -> "1206 | [C]=[S]Br" [label=""]
	"1207 | NN" [color=lightyellow shape=box style=filled]
	617 -> "1207 | NN" [label=""]
	"1208 | BrC=[S]Br" [color=lightgrey shape=box style=filled]
	617 -> "1208 | BrC=[S]Br" [label=""]
	"1209 | BrSBr" [color=lightgrey shape=box style=filled]
	618 -> "1209 | BrSBr" [label=""]
	"1210 | C=NN" [color=lightgrey shape=box style=filled]
	618 -> "1210 | C=NN" [label=""]
	"1211 | CCOP(=O)(C=[S]Br)OCC" [color=lightgrey shape=box style=filled]
	619 -> "1211 | CCOP(=O)(C=[S]Br)OCC" [label=""]
	"1212 | NN" [color=lightyellow shape=box style=filled]
	619 -> "1212 | NN" [label=""]
	"1213 | ClC=[S]Br" [color=lightgrey shape=box style=filled]
	620 -> "1213 | ClC=[S]Br" [label=""]
	"1214 | NN" [color=lightyellow shape=box style=filled]
	620 -> "1214 | NN" [label=""]
	"1215 | SBr" [color=lightgrey shape=box style=filled]
	621 -> "1215 | SBr" [label=""]
	"1216 | NN=CCl" [color=lightgrey shape=box style=filled]
	621 -> "1216 | NN=CCl" [label=""]
	"1217 | [C]=NN" [color=lightgrey shape=box style=filled]
	622 -> "1217 | [C]=NN" [label=""]
	"1218 | [S]Br" [color=lightgrey shape=box style=filled]
	622 -> "1218 | [S]Br" [label=""]
	"1219 | SBr" [color=lightgrey shape=box style=filled]
	623 -> "1219 | SBr" [label=""]
	"1220 | CNN" [color=lightgrey shape=box style=filled]
	623 -> "1220 | CNN" [label=""]
	"1221 | O=[SH](=O)Cl" [color=lightgrey shape=box style=filled]
	624 -> "1221 | O=[SH](=O)Cl" [label=""]
	"1222 | CCI" [color=lightyellow shape=box style=filled]
	624 -> "1222 | CCI" [label=""]
	"1223 | O=S=O" [color=lightyellow shape=box style=filled]
	625 -> "1223 | O=S=O" [label=""]
	"1224 | CCI" [color=lightyellow shape=box style=filled]
	625 -> "1224 | CCI" [label=""]
	"1225 | CC" [color=lightyellow shape=box style=filled]
	626 -> "1225 | CC" [label=""]
	"1226 | O=[SH](=O)O" [color=lightyellow shape=box style=filled]
	626 -> "1226 | O=[SH](=O)O" [label=""]
	"1227 | O=[SH](=O)O" [color=lightyellow shape=box style=filled]
	627 -> "1227 | O=[SH](=O)O" [label=""]
	"1228 | CCI" [color=lightyellow shape=box style=filled]
	627 -> "1228 | CCI" [label=""]
	"1229 | CC" [color=lightyellow shape=box style=filled]
	628 -> "1229 | CC" [label=""]
	"1230 | O=[SH](=O)Cl" [color=lightgrey shape=box style=filled]
	628 -> "1230 | O=[SH](=O)Cl" [label=""]
	"1231 | O=C(OO)c1cccc(Cl)c1" [color=lightyellow shape=box style=filled]
	629 -> "1231 | O=C(OO)c1cccc(Cl)c1" [label=""]
	"1232 | CC[SH]=O" [color=lightgrey shape=box style=filled]
	629 -> "1232 | CC[SH]=O" [label=""]
	"1233 | O=C(OO)c1cccc(Cl)c1" [color=lightyellow shape=box style=filled]
	630 -> "1233 | O=C(OO)c1cccc(Cl)c1" [label=""]
	"1234 | CC[SH]=O" [color=lightgrey shape=box style=filled]
	630 -> "1234 | CC[SH]=O" [label=""]
	"1235 | O=[S](=O)O" [color=lightgrey shape=box style=filled]
	631 -> "1235 | O=[S](=O)O" [label=""]
	"1236 | CCI" [color=lightyellow shape=box style=filled]
	631 -> "1236 | CCI" [label=""]
	"1237 | O=[SH](=O)Cl" [color=lightgrey shape=box style=filled]
	632 -> "1237 | O=[SH](=O)Cl" [label=""]
	"1238 | CCO" [color=lightyellow shape=box style=filled]
	632 -> "1238 | CCO" [label=""]
	"1239 | CCBr" [color=lightyellow shape=box style=filled]
	633 -> "1239 | CCBr" [label=""]
	"1240 | O=S=O" [color=lightyellow shape=box style=filled]
	633 -> "1240 | O=S=O" [label=""]
	"1241 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	634 -> "1241 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"1242 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	634 -> "1242 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"1243 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	635 -> "1243 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"1244 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	635 -> "1244 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"1245 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	635 -> "1245 | CCC(C)(C)OC(=O)O" [label=""]
	"1246 | CCC(C)(C)OC(=O)Nc1nccs1" [color=lightgrey shape=box style=filled]
	636 -> "1246 | CCC(C)(C)OC(=O)Nc1nccs1" [label=""]
	"1247 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	636 -> "1247 | O=CC(=O)O" [label=""]
	"1248 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	637 -> "1248 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"1249 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	637 -> "1249 | CCC(C)(C)OC(=O)O" [label=""]
	"1250 | CCC(C)(C)OC(N)=O" [color=lightgrey shape=box style=filled]
	638 -> "1250 | CCC(C)(C)OC(N)=O" [label=""]
	"1251 | O=C(O)C(O)c1csc(Br)n1" [color=lightyellow shape=box style=filled]
	638 -> "1251 | O=C(O)C(O)c1csc(Br)n1" [label=""]
	"1252 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	639 -> "1252 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"1253 | CCC(C)(C)OCO" [color=lightgrey shape=box style=filled]
	639 -> "1253 | CCC(C)(C)OCO" [label=""]
	"1254 | CCC(C)(C)OC(=O)Nc1nc(CO)cs1" [color=lightgrey shape=box style=filled]
	640 -> "1254 | CCC(C)(C)OC(=O)Nc1nc(CO)cs1" [label=""]
	"1255 | O=C=O" [color=lightyellow shape=box style=filled]
	640 -> "1255 | O=C=O" [label=""]
	"1256 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	641 -> "1256 | O=C(O)CO" [label=""]
	"1257 | CCC(C)(C)OC(=O)Nc1nc(Br)cs1" [color=lightgrey shape=box style=filled]
	641 -> "1257 | CCC(C)(C)OC(=O)Nc1nc(Br)cs1" [label=""]
	"1258 | CC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	642 -> "1258 | CC(C)(C)OC(=O)O" [label=""]
	"1259 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	642 -> "1259 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"1260 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	642 -> "1260 | CCC(C)(C)OC(=O)O" [label=""]
	"1261 | O=C(O)C(=O)O" [color=lightyellow shape=box style=filled]
	643 -> "1261 | O=C(O)C(=O)O" [label=""]
	"1262 | CCC(C)(C)OC(=O)Nc1nccs1" [color=lightgrey shape=box style=filled]
	643 -> "1262 | CCC(C)(C)OC(=O)Nc1nccs1" [label=""]
	"1263 | NC1C(=O)N2C(C(=O)O)=C(CBr)CS[C@H]12" [color=lightgrey shape=box style=filled]
	644 -> "1263 | NC1C(=O)N2C(C(=O)O)=C(CBr)CS[C@H]12" [label=""]
	"1264 | Cl" [color=lightyellow shape=box style=filled]
	644 -> "1264 | Cl" [label=""]
	"1265 | ClC(Cl)(Cl)Cl" [color=lightyellow shape=box style=filled]
	645 -> "1265 | ClC(Cl)(Cl)Cl" [label=""]
	"1266 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	645 -> "1266 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [label=""]
	"1267 | O=C1CCC(=O)N1Cl" [color=lightyellow shape=box style=filled]
	646 -> "1267 | O=C1CCC(=O)N1Cl" [label=""]
	"1268 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	646 -> "1268 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [label=""]
	"1269 | NC1C(=O)N2C=C(CCl)CS[C@H]12" [color=lightgrey shape=box style=filled]
	647 -> "1269 | NC1C(=O)N2C=C(CCl)CS[C@H]12" [label=""]
	"1270 | O=C=O" [color=lightyellow shape=box style=filled]
	647 -> "1270 | O=C=O" [label=""]
	"1271 | NC1C(=O)N2C(C(=O)O)=C(CBr)CS[C@H]12" [color=lightgrey shape=box style=filled]
	648 -> "1271 | NC1C(=O)N2C(C(=O)O)=C(CBr)CS[C@H]12" [label=""]
	"1272 | OCl" [color=lightyellow shape=box style=filled]
	648 -> "1272 | OCl" [label=""]
	"1273 | CC(C)(C)OC(=O)NC1C(=O)N(CC(=O)O)[C@@H]1SCCCCl" [color=lightgrey shape=box style=filled]
	649 -> "1273 | CC(C)(C)OC(=O)NC1C(=O)N(CC(=O)O)[C@@H]1SCCCCl" [label=""]
	"1274 | NC1C(=O)N2C(C(=O)O)=CCS[C@H]12" [color=lightgrey shape=box style=filled]
	650 -> "1274 | NC1C(=O)N2C(C(=O)O)=CCS[C@H]12" [label=""]
	"1275 | ClCCl" [color=lightyellow shape=box style=filled]
	650 -> "1275 | ClCCl" [label=""]
	"1276 | NC1C(=O)N[C@@H]1SCC(CCl)C(=O)C(=O)O" [color=lightgrey shape=box style=filled]
	651 -> "1276 | NC1C(=O)N[C@@H]1SCC(CCl)C(=O)C(=O)O" [label=""]
	"1277 | NC1C(=O)N[C@@H]1SCC(CCl)=C(O)C(=O)O" [color=lightgrey shape=box style=filled]
	652 -> "1277 | NC1C(=O)N[C@@H]1SCC(CCl)=C(O)C(=O)O" [label=""]
	"1278 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	653 -> "1278 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"1279 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	653 -> "1279 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [label=""]
	"1280 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	654 -> "1280 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"1281 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	654 -> "1281 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1282 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" [color=lightgrey shape=box style=filled]
	655 -> "1282 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" [label=""]
	"1283 | O=C=O" [color=lightyellow shape=box style=filled]
	655 -> "1283 | O=C=O" [label=""]
	"1284 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	656 -> "1284 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"1285 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	656 -> "1285 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1286 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	656 -> "1286 | CCC(C)(C)OC(=O)O" [label=""]
	"1287 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	657 -> "1287 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"1288 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	657 -> "1288 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [label=""]
	"1289 | CCC(C)(C)OC=O" [color=lightgrey shape=box style=filled]
	657 -> "1289 | CCC(C)(C)OC=O" [label=""]
	"1290 | O=C=O" [color=lightyellow shape=box style=filled]
	658 -> "1290 | O=C=O" [label=""]
	"1291 | CC(=O)C(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" [color=lightgrey shape=box style=filled]
	658 -> "1291 | CC(=O)C(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" [label=""]
	"1292 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	659 -> "1292 | CCC(C)(C)OC(=O)O" [label=""]
	"1293 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	659 -> "1293 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1294 | CCC(C)(C)OCO" [color=lightgrey shape=box style=filled]
	660 -> "1294 | CCC(C)(C)OCO" [label=""]
	"1295 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	660 -> "1295 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1296 | CC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	661 -> "1296 | CC(C)(C)OC(=O)O" [label=""]
	"1297 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	661 -> "1297 | CCC(C)(C)OC(=O)O" [label=""]
	"1298 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	661 -> "1298 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1299 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	662 -> "1299 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"1300 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	662 -> "1300 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [label=""]
	"1301 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	663 -> "1301 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"1302 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	663 -> "1302 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1303 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" [color=lightgrey shape=box style=filled]
	664 -> "1303 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" [label=""]
	"1304 | O=C=O" [color=lightyellow shape=box style=filled]
	664 -> "1304 | O=C=O" [label=""]
	"1305 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	665 -> "1305 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"1306 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	665 -> "1306 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1307 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	665 -> "1307 | CCC(C)(C)OC(=O)O" [label=""]
	"1308 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	666 -> "1308 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"1309 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	666 -> "1309 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [label=""]
	"1310 | CCC(C)(C)OC=O" [color=lightgrey shape=box style=filled]
	666 -> "1310 | CCC(C)(C)OC=O" [label=""]
	"1311 | O=C=O" [color=lightyellow shape=box style=filled]
	667 -> "1311 | O=C=O" [label=""]
	"1312 | CC(=O)C(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" [color=lightgrey shape=box style=filled]
	667 -> "1312 | CC(=O)C(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" [label=""]
	"1313 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	668 -> "1313 | CCC(C)(C)OC(=O)O" [label=""]
	"1314 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	668 -> "1314 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1315 | CCC(C)(C)OCO" [color=lightgrey shape=box style=filled]
	669 -> "1315 | CCC(C)(C)OCO" [label=""]
	"1316 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	669 -> "1316 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1317 | CC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	670 -> "1317 | CC(C)(C)OC(=O)O" [label=""]
	"1318 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	670 -> "1318 | CCC(C)(C)OC(=O)O" [label=""]
	"1319 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	670 -> "1319 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1320 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	671 -> "1320 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"1321 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	671 -> "1321 | CCC(C)(C)OC(=O)O" [label=""]
	"1322 | CC(C)(C)OC(=O)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	672 -> "1322 | CC(C)(C)OC(=O)OC(=O)Cl" [label=""]
	"1323 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	672 -> "1323 | CCC(C)(C)O" [label=""]
	"1324 | CC(C)(C)OC(=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	673 -> "1324 | CC(C)(C)OC(=O)OC(=O)O" [label=""]
	"1325 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	673 -> "1325 | CCC(C)(C)O" [label=""]
	"1326 | CCC(C)(C)OC(=O)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	674 -> "1326 | CCC(C)(C)OC(=O)OC(=O)Cl" [label=""]
	"1327 | CC(C)(C)O" [color=lightyellow shape=box style=filled]
	674 -> "1327 | CC(C)(C)O" [label=""]
	"1328 | CC(C)(C)OC(=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	675 -> "1328 | CC(C)(C)OC(=O)OC(=O)O" [label=""]
	"1329 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	675 -> "1329 | CCC(C)(C)O" [label=""]
	"1330 | CC(C)(C)OC(=O)O[C]=O" [color=lightgrey shape=box style=filled]
	676 -> "1330 | CC(C)(C)OC(=O)O[C]=O" [label=""]
	"1331 | CCC(C)(C)[O]" [color=lightgrey shape=box style=filled]
	676 -> "1331 | CCC(C)(C)[O]" [label=""]
	"1332 | CC(C)(C)O" [color=lightyellow shape=box style=filled]
	677 -> "1332 | CC(C)(C)O" [label=""]
	"1333 | CCC(C)(C)OC(=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	677 -> "1333 | CCC(C)(C)OC(=O)OC(=O)O" [label=""]
	"1334 | CC(C)(C)OC(=O)OC=O" [color=lightgrey shape=box style=filled]
	678 -> "1334 | CC(C)(C)OC(=O)OC=O" [label=""]
	"1335 | CC(Br)C(C)(C)O" [color=lightyellow shape=box style=filled]
	678 -> "1335 | CC(Br)C(C)(C)O" [label=""]
	"1336 | CC(C)(C)OC(=O)OC(=O)Br" [color=lightgrey shape=box style=filled]
	679 -> "1336 | CC(C)(C)OC(=O)OC(=O)Br" [label=""]
	"1337 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	679 -> "1337 | CCC(C)(C)O" [label=""]
	"1338 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	680 -> "1338 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"1339 | NC1C(=O)N2C(C(=O)O)=C(CCl)CS[C@H]12" [color=lightgrey shape=box style=filled]
	680 -> "1339 | NC1C(=O)N2C(C(=O)O)=C(CCl)CS[C@H]12" [label=""]
	"1340 | ClC(Cl)(Cl)Cl" [color=lightyellow shape=box style=filled]
	681 -> "1340 | ClC(Cl)(Cl)Cl" [label=""]
	"1341 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	681 -> "1341 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1342 | O=C1CCC(=O)N1Cl" [color=lightyellow shape=box style=filled]
	682 -> "1342 | O=C1CCC(=O)N1Cl" [label=""]
	"1343 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	682 -> "1343 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1344 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CBr)CS[C@H]23)cs1" [color=lightgrey shape=box style=filled]
	683 -> "1344 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CBr)CS[C@H]23)cs1" [label=""]
	"1345 | Cl" [color=lightyellow shape=box style=filled]
	683 -> "1345 | Cl" [label=""]
	"1346 | Nc1nc(C(O)C(=O)Cl)cs1" [color=lightgrey shape=box style=filled]
	684 -> "1346 | Nc1nc(C(O)C(=O)Cl)cs1" [label=""]
	"1347 | NC1C(=O)N2C(C(=O)O)=C(CCl)CS[C@H]12" [color=lightgrey shape=box style=filled]
	684 -> "1347 | NC1C(=O)N2C(C(=O)O)=C(CCl)CS[C@H]12" [label=""]
	"1348 | ClCl" [color=lightyellow shape=box style=filled]
	685 -> "1348 | ClCl" [label=""]
	"1349 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	685 -> "1349 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1350 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	686 -> "1350 | O=C1CCC(=O)N1Br" [label=""]
	"1351 | Cl" [color=lightyellow shape=box style=filled]
	686 -> "1351 | Cl" [label=""]
	"1352 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	686 -> "1352 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1353 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	687 -> "1353 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"1354 | NC1C(=O)N2C(C(=O)O)=C(CBr)CS[C@H]12" [color=lightgrey shape=box style=filled]
	687 -> "1354 | NC1C(=O)N2C(C(=O)O)=C(CBr)CS[C@H]12" [label=""]
	"1355 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" [color=lightgrey shape=box style=filled]
	688 -> "1355 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(C)CS[C@H]23)cs1" [label=""]
	"1356 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	688 -> "1356 | O=C1CCC(=O)N1Br" [label=""]
	"1357 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S([C]=O)=[O+]Br)cs1" [color=lightgrey shape=box style=filled]
	689 -> "1357 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S([C]=O)=[O+]Br)cs1" [label=""]
	"1358 | O=C(Br)[C]=C(Cl)C(=O)O" [color=lightgrey shape=box style=filled]
	689 -> "1358 | O=C(Br)[C]=C(Cl)C(=O)O" [label=""]
	"1359 | [Br]" [color=lightyellow shape=box style=filled]
	690 -> "1359 | [Br]" [label=""]
	"1360 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=[O+])C(=O)C(C(=O)Br)=C(Cl)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	690 -> "1360 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=[O+])C(=O)C(C(=O)Br)=C(Cl)C(=O)O)cs1" [label=""]
	"1361 | O=C=O" [color=lightyellow shape=box style=filled]
	691 -> "1361 | O=C=O" [label=""]
	"1362 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	691 -> "1362 | CCC(C)(C)O" [label=""]
	"1363 | O=C(O)O" [color=lightyellow shape=box style=filled]
	692 -> "1363 | O=C(O)O" [label=""]
	"1364 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	692 -> "1364 | CCC(C)(C)O" [label=""]
	"1365 | CCC(C)(C)Cl" [color=lightyellow shape=box style=filled]
	693 -> "1365 | CCC(C)(C)Cl" [label=""]
	"1366 | O=C(O)O" [color=lightyellow shape=box style=filled]
	693 -> "1366 | O=C(O)O" [label=""]
	"1367 | CC(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	694 -> "1367 | CC(C)OC(=O)O" [label=""]
	"1368 | CCI" [color=lightyellow shape=box style=filled]
	694 -> "1368 | CCI" [label=""]
	"1369 | O=C(O)O" [color=lightyellow shape=box style=filled]
	695 -> "1369 | O=C(O)O" [label=""]
	"1370 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	695 -> "1370 | CCC(C)(C)O" [label=""]
	"1371 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	696 -> "1371 | O=C(O)Cl" [label=""]
	"1372 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	696 -> "1372 | CCC(C)(C)O" [label=""]
	"1373 | CCO" [color=lightyellow shape=box style=filled]
	697 -> "1373 | CCO" [label=""]
	"1374 | CC(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	697 -> "1374 | CC(C)OC(=O)O" [label=""]
	"1375 | CCOP(=O)(OCC)OC(=O)OC(C)C" [color=lightgrey shape=box style=filled]
	698 -> "1375 | CCOP(=O)(OCC)OC(=O)OC(C)C" [label=""]
	"1376 | CCI" [color=lightyellow shape=box style=filled]
	698 -> "1376 | CCI" [label=""]
	"1377 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	699 -> "1377 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"1378 | NC1C(=O)N2C(C(=O)O)=C(CCl)CS[C@H]12" [color=lightgrey shape=box style=filled]
	699 -> "1378 | NC1C(=O)N2C(C(=O)O)=C(CCl)CS[C@H]12" [label=""]
	"1379 | ClC(Cl)(Cl)Cl" [color=lightyellow shape=box style=filled]
	700 -> "1379 | ClC(Cl)(Cl)Cl" [label=""]
	"1380 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	700 -> "1380 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1381 | O=C1CCC(=O)N1Cl" [color=lightyellow shape=box style=filled]
	701 -> "1381 | O=C1CCC(=O)N1Cl" [label=""]
	"1382 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	701 -> "1382 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1383 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CBr)CS[C@H]23)cs1" [color=lightgrey shape=box style=filled]
	702 -> "1383 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CBr)CS[C@H]23)cs1" [label=""]
	"1384 | Cl" [color=lightyellow shape=box style=filled]
	702 -> "1384 | Cl" [label=""]
	"1385 | Nc1nc(C(O)C(=O)Cl)cs1" [color=lightgrey shape=box style=filled]
	703 -> "1385 | Nc1nc(C(O)C(=O)Cl)cs1" [label=""]
	"1386 | NC1C(=O)N2C(C(=O)O)=C(CCl)CS[C@H]12" [color=lightgrey shape=box style=filled]
	703 -> "1386 | NC1C(=O)N2C(C(=O)O)=C(CCl)CS[C@H]12" [label=""]
	"1387 | ClCl" [color=lightyellow shape=box style=filled]
	704 -> "1387 | ClCl" [label=""]
	"1388 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	704 -> "1388 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1389 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	705 -> "1389 | O=C1CCC(=O)N1Br" [label=""]
	"1390 | Cl" [color=lightyellow shape=box style=filled]
	705 -> "1390 | Cl" [label=""]
	"1391 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	705 -> "1391 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1392 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	706 -> "1392 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"1393 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	706 -> "1393 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [label=""]
	"1394 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	707 -> "1394 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"1395 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	707 -> "1395 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1396 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" [color=lightgrey shape=box style=filled]
	708 -> "1396 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" [label=""]
	"1397 | O=C=O" [color=lightyellow shape=box style=filled]
	708 -> "1397 | O=C=O" [label=""]
	"1398 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	709 -> "1398 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"1399 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	709 -> "1399 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1400 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	709 -> "1400 | CCC(C)(C)OC(=O)O" [label=""]
	"1401 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	710 -> "1401 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"1402 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	710 -> "1402 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [label=""]
	"1403 | CCC(C)(C)OC=O" [color=lightgrey shape=box style=filled]
	710 -> "1403 | CCC(C)(C)OC=O" [label=""]
	"1404 | O=C=O" [color=lightyellow shape=box style=filled]
	711 -> "1404 | O=C=O" [label=""]
	"1405 | CC(=O)C(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" [color=lightgrey shape=box style=filled]
	711 -> "1405 | CC(=O)C(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" [label=""]
	"1406 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	712 -> "1406 | CCC(C)(C)OC(=O)O" [label=""]
	"1407 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	712 -> "1407 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1408 | CCC(C)(C)OCO" [color=lightgrey shape=box style=filled]
	713 -> "1408 | CCC(C)(C)OCO" [label=""]
	"1409 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	713 -> "1409 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1410 | CC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	714 -> "1410 | CC(C)(C)OC(=O)O" [label=""]
	"1411 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	714 -> "1411 | CCC(C)(C)OC(=O)O" [label=""]
	"1412 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	714 -> "1412 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1413 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	715 -> "1413 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"1414 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	715 -> "1414 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [label=""]
	"1415 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	716 -> "1415 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"1416 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	716 -> "1416 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1417 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" [color=lightgrey shape=box style=filled]
	717 -> "1417 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" [label=""]
	"1418 | O=C=O" [color=lightyellow shape=box style=filled]
	717 -> "1418 | O=C=O" [label=""]
	"1419 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	718 -> "1419 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"1420 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	718 -> "1420 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1421 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	718 -> "1421 | CCC(C)(C)OC(=O)O" [label=""]
	"1422 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	719 -> "1422 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"1423 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	719 -> "1423 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [label=""]
	"1424 | CCC(C)(C)OC=O" [color=lightgrey shape=box style=filled]
	719 -> "1424 | CCC(C)(C)OC=O" [label=""]
	"1425 | O=C=O" [color=lightyellow shape=box style=filled]
	720 -> "1425 | O=C=O" [label=""]
	"1426 | CC(=O)C(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" [color=lightgrey shape=box style=filled]
	720 -> "1426 | CC(=O)C(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" [label=""]
	"1427 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	721 -> "1427 | CCC(C)(C)OC(=O)O" [label=""]
	"1428 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	721 -> "1428 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1429 | CCC(C)(C)OCO" [color=lightgrey shape=box style=filled]
	722 -> "1429 | CCC(C)(C)OCO" [label=""]
	"1430 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	722 -> "1430 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1431 | CC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	723 -> "1431 | CC(C)(C)OC(=O)O" [label=""]
	"1432 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	723 -> "1432 | CCC(C)(C)OC(=O)O" [label=""]
	"1433 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	723 -> "1433 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1434 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	724 -> "1434 | Nc1nccs1" [label=""]
	"1435 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	724 -> "1435 | O=CC(=O)O" [label=""]
	"1436 | Nc1nc(CO)cs1" [color=lightyellow shape=box style=filled]
	725 -> "1436 | Nc1nc(CO)cs1" [label=""]
	"1437 | O=C=O" [color=lightyellow shape=box style=filled]
	725 -> "1437 | O=C=O" [label=""]
	"1438 | O=C(O)C(=O)O" [color=lightyellow shape=box style=filled]
	726 -> "1438 | O=C(O)C(=O)O" [label=""]
	"1439 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	726 -> "1439 | Nc1nccs1" [label=""]
	"1440 | O=C(O)C(O)c1csc([N+](=O)[O-])n1" [color=lightgrey shape=box style=filled]
	727 -> "1440 | O=C(O)C(O)c1csc([N+](=O)[O-])n1" [label=""]
	"1441 | Nc1nc(Br)cs1" [color=lightyellow shape=box style=filled]
	728 -> "1441 | Nc1nc(Br)cs1" [label=""]
	"1442 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	728 -> "1442 | O=C(O)CO" [label=""]
	"1443 | Nc1nc(C(=O)C(=O)O)cs1" [color=lightyellow shape=box style=filled]
	729 -> "1443 | Nc1nc(C(=O)C(=O)O)cs1" [label=""]
	"1444 | O" [color=lightyellow shape=box style=filled]
	729 -> "1444 | O" [label=""]
	"1445 | Nc1nc(Cl)cs1" [color=lightyellow shape=box style=filled]
	730 -> "1445 | Nc1nc(Cl)cs1" [label=""]
	"1446 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	730 -> "1446 | O=C(O)CO" [label=""]
	"1447 | O=CO" [color=lightyellow shape=box style=filled]
	731 -> "1447 | O=CO" [label=""]
	"1448 | Nc1nc(C=O)cs1" [color=lightyellow shape=box style=filled]
	731 -> "1448 | Nc1nc(C=O)cs1" [label=""]
	"1449 | O=C(O)C(O)c1csc(N[O-])n1" [color=lightgrey shape=box style=filled]
	732 -> "1449 | O=C(O)C(O)c1csc(N[O-])n1" [label=""]
	"1450 | Nc1nc(C(=O)C(=O)O)cs1" [color=lightyellow shape=box style=filled]
	733 -> "1450 | Nc1nc(C(=O)C(=O)O)cs1" [label=""]
	"1451 | OO" [color=lightyellow shape=box style=filled]
	733 -> "1451 | OO" [label=""]
	"1452 | NC1C(=O)N2C(C(=O)O)=C(CBr)CS[C@H]12" [color=lightgrey shape=box style=filled]
	734 -> "1452 | NC1C(=O)N2C(C(=O)O)=C(CBr)CS[C@H]12" [label=""]
	"1453 | Cl" [color=lightyellow shape=box style=filled]
	734 -> "1453 | Cl" [label=""]
	"1454 | ClC(Cl)(Cl)Cl" [color=lightyellow shape=box style=filled]
	735 -> "1454 | ClC(Cl)(Cl)Cl" [label=""]
	"1455 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	735 -> "1455 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [label=""]
	"1456 | O=C1CCC(=O)N1Cl" [color=lightyellow shape=box style=filled]
	736 -> "1456 | O=C1CCC(=O)N1Cl" [label=""]
	"1457 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	736 -> "1457 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [label=""]
	"1458 | NC1C(=O)N2C=C(CCl)CS[C@H]12" [color=lightgrey shape=box style=filled]
	737 -> "1458 | NC1C(=O)N2C=C(CCl)CS[C@H]12" [label=""]
	"1459 | O=C=O" [color=lightyellow shape=box style=filled]
	737 -> "1459 | O=C=O" [label=""]
	"1460 | NC1C(=O)N2C(C(=O)O)=C(CBr)CS[C@H]12" [color=lightgrey shape=box style=filled]
	738 -> "1460 | NC1C(=O)N2C(C(=O)O)=C(CBr)CS[C@H]12" [label=""]
	"1461 | OCl" [color=lightyellow shape=box style=filled]
	738 -> "1461 | OCl" [label=""]
	"1462 | CC(C)(C)OC(=O)NC1C(=O)N(CC(=O)O)[C@@H]1SCCCCl" [color=lightgrey shape=box style=filled]
	739 -> "1462 | CC(C)(C)OC(=O)NC1C(=O)N(CC(=O)O)[C@@H]1SCCCCl" [label=""]
	"1463 | NC1C(=O)N2C(C(=O)O)=CCS[C@H]12" [color=lightgrey shape=box style=filled]
	740 -> "1463 | NC1C(=O)N2C(C(=O)O)=CCS[C@H]12" [label=""]
	"1464 | ClCCl" [color=lightyellow shape=box style=filled]
	740 -> "1464 | ClCCl" [label=""]
	"1465 | NC1C(=O)N[C@@H]1SCC(CCl)C(=O)C(=O)O" [color=lightgrey shape=box style=filled]
	741 -> "1465 | NC1C(=O)N[C@@H]1SCC(CCl)C(=O)C(=O)O" [label=""]
	"1466 | NC1C(=O)N[C@@H]1SCC(CCl)=C(O)C(=O)O" [color=lightgrey shape=box style=filled]
	742 -> "1466 | NC1C(=O)N[C@@H]1SCC(CCl)=C(O)C(=O)O" [label=""]
	"1467 | O=CO" [color=lightyellow shape=box style=filled]
	743 -> "1467 | O=CO" [label=""]
	"1468 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	743 -> "1468 | CCC(C)(C)O" [label=""]
	"1469 | CCI" [color=lightyellow shape=box style=filled]
	744 -> "1469 | CCI" [label=""]
	"1470 | CC(C)OC=O" [color=lightyellow shape=box style=filled]
	744 -> "1470 | CC(C)OC=O" [label=""]
	"1471 | CN(C)C=O" [color=lightyellow shape=box style=filled]
	745 -> "1471 | CN(C)C=O" [label=""]
	"1472 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	745 -> "1472 | CCC(C)(C)O" [label=""]
	"1473 | O=C(OO)c1cccc(Cl)c1" [color=lightyellow shape=box style=filled]
	746 -> "1473 | O=C(OO)c1cccc(Cl)c1" [label=""]
	"1474 | CCC(C)(C)OC" [color=lightyellow shape=box style=filled]
	746 -> "1474 | CCC(C)(C)OC" [label=""]
	"1475 | CCBr" [color=lightyellow shape=box style=filled]
	747 -> "1475 | CCBr" [label=""]
	"1476 | CC(C)OC=O" [color=lightyellow shape=box style=filled]
	747 -> "1476 | CC(C)OC=O" [label=""]
	"1477 | CCC(C)(C)Cl" [color=lightyellow shape=box style=filled]
	748 -> "1477 | CCC(C)(C)Cl" [label=""]
	"1478 | O=CO" [color=lightyellow shape=box style=filled]
	748 -> "1478 | O=CO" [label=""]
	"1479 | CCO" [color=lightyellow shape=box style=filled]
	749 -> "1479 | CCO" [label=""]
	"1480 | CC(C)OC=O" [color=lightyellow shape=box style=filled]
	749 -> "1480 | CC(C)OC=O" [label=""]
	"1481 | O=CO" [color=lightyellow shape=box style=filled]
	750 -> "1481 | O=CO" [label=""]
	"1482 | C=C(C)CC" [color=lightgrey shape=box style=filled]
	750 -> "1482 | C=C(C)CC" [label=""]
	"1483 | O=CO" [color=lightyellow shape=box style=filled]
	751 -> "1483 | O=CO" [label=""]
	"1484 | C=C(C)CC" [color=lightgrey shape=box style=filled]
	751 -> "1484 | C=C(C)CC" [label=""]
	"1485 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	752 -> "1485 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"1486 | NC1C(=O)N2C(C(=O)O)=C(CCl)CS[C@H]12" [color=lightgrey shape=box style=filled]
	752 -> "1486 | NC1C(=O)N2C(C(=O)O)=C(CCl)CS[C@H]12" [label=""]
	"1487 | ClC(Cl)(Cl)Cl" [color=lightyellow shape=box style=filled]
	753 -> "1487 | ClC(Cl)(Cl)Cl" [label=""]
	"1488 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	753 -> "1488 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1489 | O=C1CCC(=O)N1Cl" [color=lightyellow shape=box style=filled]
	754 -> "1489 | O=C1CCC(=O)N1Cl" [label=""]
	"1490 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	754 -> "1490 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1491 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CBr)CS[C@H]23)cs1" [color=lightgrey shape=box style=filled]
	755 -> "1491 | Nc1nc(C(O)C(=O)NC2C(=O)N3C(C(=O)O)=C(CBr)CS[C@H]23)cs1" [label=""]
	"1492 | Cl" [color=lightyellow shape=box style=filled]
	755 -> "1492 | Cl" [label=""]
	"1493 | Nc1nc(C(O)C(=O)Cl)cs1" [color=lightgrey shape=box style=filled]
	756 -> "1493 | Nc1nc(C(O)C(=O)Cl)cs1" [label=""]
	"1494 | NC1C(=O)N2C(C(=O)O)=C(CCl)CS[C@H]12" [color=lightgrey shape=box style=filled]
	756 -> "1494 | NC1C(=O)N2C(C(=O)O)=C(CCl)CS[C@H]12" [label=""]
	"1495 | ClCl" [color=lightyellow shape=box style=filled]
	757 -> "1495 | ClCl" [label=""]
	"1496 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	757 -> "1496 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1497 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	758 -> "1497 | O=C1CCC(=O)N1Br" [label=""]
	"1498 | Cl" [color=lightyellow shape=box style=filled]
	758 -> "1498 | Cl" [label=""]
	"1499 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	758 -> "1499 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"1500 | O=C=O" [color=lightyellow shape=box style=filled]
	759 -> "1500 | O=C=O" [label=""]
	"1501 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	759 -> "1501 | CCC(C)(C)O" [label=""]
	"1502 | O=C(O)O" [color=lightyellow shape=box style=filled]
	760 -> "1502 | O=C(O)O" [label=""]
	"1503 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	760 -> "1503 | CCC(C)(C)O" [label=""]
	"1504 | CCC(C)(C)Cl" [color=lightyellow shape=box style=filled]
	761 -> "1504 | CCC(C)(C)Cl" [label=""]
	"1505 | O=C(O)O" [color=lightyellow shape=box style=filled]
	761 -> "1505 | O=C(O)O" [label=""]
	"1506 | CC(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	762 -> "1506 | CC(C)OC(=O)O" [label=""]
	"1507 | CCI" [color=lightyellow shape=box style=filled]
	762 -> "1507 | CCI" [label=""]
	"1508 | O=C(O)O" [color=lightyellow shape=box style=filled]
	763 -> "1508 | O=C(O)O" [label=""]
	"1509 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	763 -> "1509 | CCC(C)(C)O" [label=""]
	"1510 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	764 -> "1510 | O=C(O)Cl" [label=""]
	"1511 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	764 -> "1511 | CCC(C)(C)O" [label=""]
	"1512 | CCO" [color=lightyellow shape=box style=filled]
	765 -> "1512 | CCO" [label=""]
	"1513 | CC(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	765 -> "1513 | CC(C)OC(=O)O" [label=""]
	"1514 | CCOP(=O)(OCC)OC(=O)OC(C)C" [color=lightgrey shape=box style=filled]
	766 -> "1514 | CCOP(=O)(OCC)OC(=O)OC(C)C" [label=""]
	"1515 | CCI" [color=lightyellow shape=box style=filled]
	766 -> "1515 | CCI" [label=""]
	767 [color=lightblue shape=rarrow style=filled]
	"119 | Nc1nc(C(O)C(=O)O)cs1" -> 767 [label=0.000]
	768 [color=lightblue shape=rarrow style=filled]
	"119 | Nc1nc(C(O)C(=O)O)cs1" -> 768 [label=0.000]
	769 [color=lightblue shape=rarrow style=filled]
	"119 | Nc1nc(C(O)C(=O)O)cs1" -> 769 [label=0.000]
	770 [color=aquamarine shape=rarrow style=filled]
	"119 | Nc1nc(C(O)C(=O)O)cs1" -> 770 [label=0.000]
	771 [color=lightblue shape=rarrow style=filled]
	"119 | Nc1nc(C(O)C(=O)O)cs1" -> 771 [label=0.000]
	772 [color=lightblue shape=rarrow style=filled]
	"119 | Nc1nc(C(O)C(=O)O)cs1" -> 772 [label=0.000]
	773 [color=lightblue shape=rarrow style=filled]
	"119 | Nc1nc(C(O)C(=O)O)cs1" -> 773 [label=0.000]
	774 [color=lightblue shape=rarrow style=filled]
	"119 | Nc1nc(C(O)C(=O)O)cs1" -> 774 [label=0.000]
	775 [color=aquamarine shape=rarrow style=filled]
	"119 | Nc1nc(C(O)C(=O)O)cs1" -> 775 [label=0.000]
	776 [color=lightblue shape=rarrow style=filled]
	"119 | Nc1nc(C(O)C(=O)O)cs1" -> 776 [label=0.000]
	777 [color=aquamarine shape=rarrow style=filled]
	"120 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 777 [label=0.000]
	778 [color=aquamarine shape=rarrow style=filled]
	"120 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 778 [label=0.000]
	779 [color=aquamarine shape=rarrow style=filled]
	"120 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 779 [label=0.000]
	780 [color=aquamarine shape=rarrow style=filled]
	"120 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 780 [label=0.000]
	781 [color=aquamarine shape=rarrow style=filled]
	"120 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 781 [label=0.000]
	782 [color=aquamarine shape=rarrow style=filled]
	"120 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 782 [label=0.000]
	783 [color=aquamarine shape=rarrow style=filled]
	"120 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 783 [label=0.000]
	784 [color=aquamarine shape=rarrow style=filled]
	"120 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 784 [label=0.000]
	785 [color=aquamarine shape=rarrow style=filled]
	"120 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 785 [label=0.000]
	786 [color=lightblue shape=rarrow style=filled]
	"121 | Nc1nc(C(O)C(=O)O)cs1" -> 786 [label=0.000]
	787 [color=lightblue shape=rarrow style=filled]
	"121 | Nc1nc(C(O)C(=O)O)cs1" -> 787 [label=0.000]
	788 [color=lightblue shape=rarrow style=filled]
	"121 | Nc1nc(C(O)C(=O)O)cs1" -> 788 [label=0.000]
	789 [color=aquamarine shape=rarrow style=filled]
	"121 | Nc1nc(C(O)C(=O)O)cs1" -> 789 [label=0.000]
	790 [color=lightblue shape=rarrow style=filled]
	"121 | Nc1nc(C(O)C(=O)O)cs1" -> 790 [label=0.000]
	791 [color=lightblue shape=rarrow style=filled]
	"121 | Nc1nc(C(O)C(=O)O)cs1" -> 791 [label=0.000]
	792 [color=lightblue shape=rarrow style=filled]
	"121 | Nc1nc(C(O)C(=O)O)cs1" -> 792 [label=0.000]
	793 [color=lightblue shape=rarrow style=filled]
	"121 | Nc1nc(C(O)C(=O)O)cs1" -> 793 [label=0.000]
	794 [color=aquamarine shape=rarrow style=filled]
	"121 | Nc1nc(C(O)C(=O)O)cs1" -> 794 [label=0.000]
	795 [color=lightblue shape=rarrow style=filled]
	"121 | Nc1nc(C(O)C(=O)O)cs1" -> 795 [label=0.000]
	796 [color=lightblue shape=rarrow style=filled]
	"123 | CCC(C)(C)OC(=O)O" -> 796 [label=0.000]
	797 [color=lightblue shape=rarrow style=filled]
	"123 | CCC(C)(C)OC(=O)O" -> 797 [label=0.000]
	798 [color=lightblue shape=rarrow style=filled]
	"123 | CCC(C)(C)OC(=O)O" -> 798 [label=0.000]
	799 [color=aquamarine shape=rarrow style=filled]
	"123 | CCC(C)(C)OC(=O)O" -> 799 [label=0.000]
	800 [color=lightblue shape=rarrow style=filled]
	"123 | CCC(C)(C)OC(=O)O" -> 800 [label=0.000]
	801 [color=aquamarine shape=rarrow style=filled]
	"123 | CCC(C)(C)OC(=O)O" -> 801 [label=0.000]
	802 [color=aquamarine shape=rarrow style=filled]
	"123 | CCC(C)(C)OC(=O)O" -> 802 [label=0.000]
	803 [color=aquamarine shape=rarrow style=filled]
	"123 | CCC(C)(C)OC(=O)O" -> 803 [label=0.000]
	804 [color=aquamarine shape=rarrow style=filled]
	"124 | CCC(C)(C)OC(=O)Nc1nccs1" -> 804 [label=0.000]
	805 [color=aquamarine shape=rarrow style=filled]
	"124 | CCC(C)(C)OC(=O)Nc1nccs1" -> 805 [label=0.000]
	806 [color=aquamarine shape=rarrow style=filled]
	"124 | CCC(C)(C)OC(=O)Nc1nccs1" -> 806 [label=0.000]
	807 [color=aquamarine shape=rarrow style=filled]
	"124 | CCC(C)(C)OC(=O)Nc1nccs1" -> 807 [label=0.000]
	808 [color=aquamarine shape=rarrow style=filled]
	"124 | CCC(C)(C)OC(=O)Nc1nccs1" -> 808 [label=0.000]
	809 [color=aquamarine shape=rarrow style=filled]
	"124 | CCC(C)(C)OC(=O)Nc1nccs1" -> 809 [label=0.000]
	810 [color=aquamarine shape=rarrow style=filled]
	"124 | CCC(C)(C)OC(=O)Nc1nccs1" -> 810 [label=0.000]
	811 [color=aquamarine shape=rarrow style=filled]
	"124 | CCC(C)(C)OC(=O)Nc1nccs1" -> 811 [label=0.000]
	812 [color=aquamarine shape=rarrow style=filled]
	"124 | CCC(C)(C)OC(=O)Nc1nccs1" -> 812 [label=0.000]
	813 [color=aquamarine shape=rarrow style=filled]
	"124 | CCC(C)(C)OC(=O)Nc1nccs1" -> 813 [label=0.000]
	814 [color=lightblue shape=rarrow style=filled]
	"126 | Nc1nc(C(O)C(=O)O)cs1" -> 814 [label=0.000]
	815 [color=lightblue shape=rarrow style=filled]
	"126 | Nc1nc(C(O)C(=O)O)cs1" -> 815 [label=0.000]
	816 [color=lightblue shape=rarrow style=filled]
	"126 | Nc1nc(C(O)C(=O)O)cs1" -> 816 [label=0.000]
	817 [color=aquamarine shape=rarrow style=filled]
	"126 | Nc1nc(C(O)C(=O)O)cs1" -> 817 [label=0.000]
	818 [color=lightblue shape=rarrow style=filled]
	"126 | Nc1nc(C(O)C(=O)O)cs1" -> 818 [label=0.000]
	819 [color=lightblue shape=rarrow style=filled]
	"126 | Nc1nc(C(O)C(=O)O)cs1" -> 819 [label=0.000]
	820 [color=lightblue shape=rarrow style=filled]
	"126 | Nc1nc(C(O)C(=O)O)cs1" -> 820 [label=0.000]
	821 [color=lightblue shape=rarrow style=filled]
	"126 | Nc1nc(C(O)C(=O)O)cs1" -> 821 [label=0.000]
	822 [color=aquamarine shape=rarrow style=filled]
	"126 | Nc1nc(C(O)C(=O)O)cs1" -> 822 [label=0.000]
	823 [color=lightblue shape=rarrow style=filled]
	"126 | Nc1nc(C(O)C(=O)O)cs1" -> 823 [label=0.000]
	824 [color=lightblue shape=rarrow style=filled]
	"127 | CCC(C)(C)OC(=O)O" -> 824 [label=0.000]
	825 [color=lightblue shape=rarrow style=filled]
	"127 | CCC(C)(C)OC(=O)O" -> 825 [label=0.000]
	826 [color=lightblue shape=rarrow style=filled]
	"127 | CCC(C)(C)OC(=O)O" -> 826 [label=0.000]
	827 [color=aquamarine shape=rarrow style=filled]
	"127 | CCC(C)(C)OC(=O)O" -> 827 [label=0.000]
	828 [color=lightblue shape=rarrow style=filled]
	"127 | CCC(C)(C)OC(=O)O" -> 828 [label=0.000]
	829 [color=aquamarine shape=rarrow style=filled]
	"127 | CCC(C)(C)OC(=O)O" -> 829 [label=0.000]
	830 [color=aquamarine shape=rarrow style=filled]
	"127 | CCC(C)(C)OC(=O)O" -> 830 [label=0.000]
	831 [color=aquamarine shape=rarrow style=filled]
	"127 | CCC(C)(C)OC(=O)O" -> 831 [label=0.000]
	832 [color=aquamarine shape=rarrow style=filled]
	"128 | CCC(C)(C)OC(N)=O" -> 832 [label=0.000]
	833 [color=lightblue shape=rarrow style=filled]
	"128 | CCC(C)(C)OC(N)=O" -> 833 [label=0.000]
	834 [color=lightblue shape=rarrow style=filled]
	"128 | CCC(C)(C)OC(N)=O" -> 834 [label=0.000]
	835 [color=lightblue shape=rarrow style=filled]
	"128 | CCC(C)(C)OC(N)=O" -> 835 [label=0.000]
	836 [color=lightblue shape=rarrow style=filled]
	"128 | CCC(C)(C)OC(N)=O" -> 836 [label=0.000]
	837 [color=lightblue shape=rarrow style=filled]
	"128 | CCC(C)(C)OC(N)=O" -> 837 [label=0.000]
	838 [color=lightblue shape=rarrow style=filled]
	"128 | CCC(C)(C)OC(N)=O" -> 838 [label=0.000]
	839 [color=aquamarine shape=rarrow style=filled]
	"128 | CCC(C)(C)OC(N)=O" -> 839 [label=0.000]
	840 [color=lightblue shape=rarrow style=filled]
	"128 | CCC(C)(C)OC(N)=O" -> 840 [label=0.000]
	841 [color=lightblue shape=rarrow style=filled]
	"130 | Nc1nc(C(O)C(=O)O)cs1" -> 841 [label=0.000]
	842 [color=lightblue shape=rarrow style=filled]
	"130 | Nc1nc(C(O)C(=O)O)cs1" -> 842 [label=0.000]
	843 [color=lightblue shape=rarrow style=filled]
	"130 | Nc1nc(C(O)C(=O)O)cs1" -> 843 [label=0.000]
	844 [color=aquamarine shape=rarrow style=filled]
	"130 | Nc1nc(C(O)C(=O)O)cs1" -> 844 [label=0.000]
	845 [color=lightblue shape=rarrow style=filled]
	"130 | Nc1nc(C(O)C(=O)O)cs1" -> 845 [label=0.000]
	846 [color=lightblue shape=rarrow style=filled]
	"130 | Nc1nc(C(O)C(=O)O)cs1" -> 846 [label=0.000]
	847 [color=lightblue shape=rarrow style=filled]
	"130 | Nc1nc(C(O)C(=O)O)cs1" -> 847 [label=0.000]
	848 [color=lightblue shape=rarrow style=filled]
	"130 | Nc1nc(C(O)C(=O)O)cs1" -> 848 [label=0.000]
	849 [color=aquamarine shape=rarrow style=filled]
	"130 | Nc1nc(C(O)C(=O)O)cs1" -> 849 [label=0.000]
	850 [color=lightblue shape=rarrow style=filled]
	"130 | Nc1nc(C(O)C(=O)O)cs1" -> 850 [label=0.000]
	851 [color=lightblue shape=rarrow style=filled]
	"131 | CCC(C)(C)OCO" -> 851 [label=0.000]
	852 [color=lightblue shape=rarrow style=filled]
	"131 | CCC(C)(C)OCO" -> 852 [label=0.000]
	853 [color=lightblue shape=rarrow style=filled]
	"131 | CCC(C)(C)OCO" -> 853 [label=0.000]
	854 [color=lightblue shape=rarrow style=filled]
	"131 | CCC(C)(C)OCO" -> 854 [label=0.000]
	855 [color=lightblue shape=rarrow style=filled]
	"131 | CCC(C)(C)OCO" -> 855 [label=0.000]
	856 [color=lightblue shape=rarrow style=filled]
	"131 | CCC(C)(C)OCO" -> 856 [label=0.000]
	857 [color=lightblue shape=rarrow style=filled]
	"131 | CCC(C)(C)OCO" -> 857 [label=0.000]
	858 [color=lightblue shape=rarrow style=filled]
	"131 | CCC(C)(C)OCO" -> 858 [label=0.000]
	859 [color=lightblue shape=rarrow style=filled]
	"131 | CCC(C)(C)OCO" -> 859 [label=0.000]
	860 [color=lightblue shape=rarrow style=filled]
	"131 | CCC(C)(C)OCO" -> 860 [label=0.000]
	861 [color=aquamarine shape=rarrow style=filled]
	"132 | CCC(C)(C)OC(=O)Nc1nc(CO)cs1" -> 861 [label=0.000]
	862 [color=aquamarine shape=rarrow style=filled]
	"132 | CCC(C)(C)OC(=O)Nc1nc(CO)cs1" -> 862 [label=0.000]
	863 [color=aquamarine shape=rarrow style=filled]
	"132 | CCC(C)(C)OC(=O)Nc1nc(CO)cs1" -> 863 [label=0.000]
	864 [color=aquamarine shape=rarrow style=filled]
	"132 | CCC(C)(C)OC(=O)Nc1nc(CO)cs1" -> 864 [label=0.000]
	865 [color=aquamarine shape=rarrow style=filled]
	"132 | CCC(C)(C)OC(=O)Nc1nc(CO)cs1" -> 865 [label=0.000]
	866 [color=aquamarine shape=rarrow style=filled]
	"132 | CCC(C)(C)OC(=O)Nc1nc(CO)cs1" -> 866 [label=0.000]
	867 [color=aquamarine shape=rarrow style=filled]
	"132 | CCC(C)(C)OC(=O)Nc1nc(CO)cs1" -> 867 [label=0.000]
	868 [color=aquamarine shape=rarrow style=filled]
	"132 | CCC(C)(C)OC(=O)Nc1nc(CO)cs1" -> 868 [label=0.000]
	869 [color=aquamarine shape=rarrow style=filled]
	"132 | CCC(C)(C)OC(=O)Nc1nc(CO)cs1" -> 869 [label=0.000]
	870 [color=aquamarine shape=rarrow style=filled]
	"132 | CCC(C)(C)OC(=O)Nc1nc(CO)cs1" -> 870 [label=0.000]
	871 [color=aquamarine shape=rarrow style=filled]
	"135 | CCC(C)(C)OC(=O)Nc1nc(Br)cs1" -> 871 [label=0.000]
	872 [color=aquamarine shape=rarrow style=filled]
	"135 | CCC(C)(C)OC(=O)Nc1nc(Br)cs1" -> 872 [label=0.000]
	873 [color=aquamarine shape=rarrow style=filled]
	"135 | CCC(C)(C)OC(=O)Nc1nc(Br)cs1" -> 873 [label=0.000]
	874 [color=aquamarine shape=rarrow style=filled]
	"135 | CCC(C)(C)OC(=O)Nc1nc(Br)cs1" -> 874 [label=0.000]
	875 [color=aquamarine shape=rarrow style=filled]
	"135 | CCC(C)(C)OC(=O)Nc1nc(Br)cs1" -> 875 [label=0.000]
	876 [color=aquamarine shape=rarrow style=filled]
	"135 | CCC(C)(C)OC(=O)Nc1nc(Br)cs1" -> 876 [label=0.000]
	877 [color=aquamarine shape=rarrow style=filled]
	"135 | CCC(C)(C)OC(=O)Nc1nc(Br)cs1" -> 877 [label=0.000]
	878 [color=aquamarine shape=rarrow style=filled]
	"135 | CCC(C)(C)OC(=O)Nc1nc(Br)cs1" -> 878 [label=0.000]
	879 [color=aquamarine shape=rarrow style=filled]
	"135 | CCC(C)(C)OC(=O)Nc1nc(Br)cs1" -> 879 [label=0.000]
	880 [color=lightblue shape=rarrow style=filled]
	"136 | CC(C)(C)OC(=O)O" -> 880 [label=0.000]
	881 [color=lightblue shape=rarrow style=filled]
	"136 | CC(C)(C)OC(=O)O" -> 881 [label=0.000]
	882 [color=lightblue shape=rarrow style=filled]
	"136 | CC(C)(C)OC(=O)O" -> 882 [label=0.000]
	883 [color=aquamarine shape=rarrow style=filled]
	"136 | CC(C)(C)OC(=O)O" -> 883 [label=0.000]
	884 [color=lightblue shape=rarrow style=filled]
	"136 | CC(C)(C)OC(=O)O" -> 884 [label=0.000]
	885 [color=lightblue shape=rarrow style=filled]
	"136 | CC(C)(C)OC(=O)O" -> 885 [label=0.000]
	886 [color=aquamarine shape=rarrow style=filled]
	"136 | CC(C)(C)OC(=O)O" -> 886 [label=0.000]
	887 [color=lightblue shape=rarrow style=filled]
	"136 | CC(C)(C)OC(=O)O" -> 887 [label=0.000]
	888 [color=aquamarine shape=rarrow style=filled]
	"136 | CC(C)(C)OC(=O)O" -> 888 [label=0.000]
	889 [color=aquamarine shape=rarrow style=filled]
	"136 | CC(C)(C)OC(=O)O" -> 889 [label=0.000]
	890 [color=lightblue shape=rarrow style=filled]
	"137 | Nc1nc(C(O)C(=O)O)cs1" -> 890 [label=0.000]
	891 [color=lightblue shape=rarrow style=filled]
	"137 | Nc1nc(C(O)C(=O)O)cs1" -> 891 [label=0.000]
	892 [color=lightblue shape=rarrow style=filled]
	"137 | Nc1nc(C(O)C(=O)O)cs1" -> 892 [label=0.000]
	893 [color=aquamarine shape=rarrow style=filled]
	"137 | Nc1nc(C(O)C(=O)O)cs1" -> 893 [label=0.000]
	894 [color=lightblue shape=rarrow style=filled]
	"137 | Nc1nc(C(O)C(=O)O)cs1" -> 894 [label=0.000]
	895 [color=lightblue shape=rarrow style=filled]
	"137 | Nc1nc(C(O)C(=O)O)cs1" -> 895 [label=0.000]
	896 [color=lightblue shape=rarrow style=filled]
	"137 | Nc1nc(C(O)C(=O)O)cs1" -> 896 [label=0.000]
	897 [color=lightblue shape=rarrow style=filled]
	"137 | Nc1nc(C(O)C(=O)O)cs1" -> 897 [label=0.000]
	898 [color=aquamarine shape=rarrow style=filled]
	"137 | Nc1nc(C(O)C(=O)O)cs1" -> 898 [label=0.000]
	899 [color=lightblue shape=rarrow style=filled]
	"137 | Nc1nc(C(O)C(=O)O)cs1" -> 899 [label=0.000]
	900 [color=lightblue shape=rarrow style=filled]
	"138 | CCC(C)(C)OC(=O)O" -> 900 [label=0.000]
	901 [color=lightblue shape=rarrow style=filled]
	"138 | CCC(C)(C)OC(=O)O" -> 901 [label=0.000]
	902 [color=lightblue shape=rarrow style=filled]
	"138 | CCC(C)(C)OC(=O)O" -> 902 [label=0.000]
	903 [color=aquamarine shape=rarrow style=filled]
	"138 | CCC(C)(C)OC(=O)O" -> 903 [label=0.000]
	904 [color=lightblue shape=rarrow style=filled]
	"138 | CCC(C)(C)OC(=O)O" -> 904 [label=0.000]
	905 [color=aquamarine shape=rarrow style=filled]
	"138 | CCC(C)(C)OC(=O)O" -> 905 [label=0.000]
	906 [color=aquamarine shape=rarrow style=filled]
	"138 | CCC(C)(C)OC(=O)O" -> 906 [label=0.000]
	907 [color=aquamarine shape=rarrow style=filled]
	"138 | CCC(C)(C)OC(=O)O" -> 907 [label=0.000]
	908 [color=aquamarine shape=rarrow style=filled]
	"140 | CCC(C)(C)OC(=O)Nc1nccs1" -> 908 [label=0.000]
	909 [color=aquamarine shape=rarrow style=filled]
	"140 | CCC(C)(C)OC(=O)Nc1nccs1" -> 909 [label=0.000]
	910 [color=aquamarine shape=rarrow style=filled]
	"140 | CCC(C)(C)OC(=O)Nc1nccs1" -> 910 [label=0.000]
	911 [color=aquamarine shape=rarrow style=filled]
	"140 | CCC(C)(C)OC(=O)Nc1nccs1" -> 911 [label=0.000]
	912 [color=aquamarine shape=rarrow style=filled]
	"140 | CCC(C)(C)OC(=O)Nc1nccs1" -> 912 [label=0.000]
	913 [color=aquamarine shape=rarrow style=filled]
	"140 | CCC(C)(C)OC(=O)Nc1nccs1" -> 913 [label=0.000]
	914 [color=aquamarine shape=rarrow style=filled]
	"140 | CCC(C)(C)OC(=O)Nc1nccs1" -> 914 [label=0.000]
	915 [color=aquamarine shape=rarrow style=filled]
	"140 | CCC(C)(C)OC(=O)Nc1nccs1" -> 915 [label=0.000]
	916 [color=aquamarine shape=rarrow style=filled]
	"140 | CCC(C)(C)OC(=O)Nc1nccs1" -> 916 [label=0.000]
	917 [color=aquamarine shape=rarrow style=filled]
	"140 | CCC(C)(C)OC(=O)Nc1nccs1" -> 917 [label=0.000]
	918 [color=aquamarine shape=rarrow style=filled]
	"142 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 918 [label=0.000]
	919 [color=aquamarine shape=rarrow style=filled]
	"142 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 919 [label=0.000]
	920 [color=aquamarine shape=rarrow style=filled]
	"142 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 920 [label=0.000]
	921 [color=aquamarine shape=rarrow style=filled]
	"142 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 921 [label=0.000]
	922 [color=aquamarine shape=rarrow style=filled]
	"142 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 922 [label=0.000]
	923 [color=aquamarine shape=rarrow style=filled]
	"142 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 923 [label=0.000]
	924 [color=aquamarine shape=rarrow style=filled]
	"142 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 924 [label=0.000]
	925 [color=aquamarine shape=rarrow style=filled]
	"142 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 925 [label=0.000]
	926 [color=aquamarine shape=rarrow style=filled]
	"142 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 926 [label=0.000]
	927 [color=aquamarine shape=rarrow style=filled]
	"142 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 927 [label=0.000]
	928 [color=aquamarine shape=rarrow style=filled]
	"143 | NC1C(=O)N2C=C(CBr)CS[C@H]12" -> 928 [label=0.000]
	929 [color=aquamarine shape=rarrow style=filled]
	"143 | NC1C(=O)N2C=C(CBr)CS[C@H]12" -> 929 [label=0.000]
	930 [color=aquamarine shape=rarrow style=filled]
	"143 | NC1C(=O)N2C=C(CBr)CS[C@H]12" -> 930 [label=0.000]
	931 [color=aquamarine shape=rarrow style=filled]
	"143 | NC1C(=O)N2C=C(CBr)CS[C@H]12" -> 931 [label=0.000]
	932 [color=aquamarine shape=rarrow style=filled]
	"143 | NC1C(=O)N2C=C(CBr)CS[C@H]12" -> 932 [label=0.000]
	933 [color=aquamarine shape=rarrow style=filled]
	"143 | NC1C(=O)N2C=C(CBr)CS[C@H]12" -> 933 [label=0.000]
	934 [color=aquamarine shape=rarrow style=filled]
	"143 | NC1C(=O)N2C=C(CBr)CS[C@H]12" -> 934 [label=0.000]
	935 [color=aquamarine shape=rarrow style=filled]
	"143 | NC1C(=O)N2C=C(CBr)CS[C@H]12" -> 935 [label=0.000]
	936 [color=aquamarine shape=rarrow style=filled]
	"143 | NC1C(=O)N2C=C(CBr)CS[C@H]12" -> 936 [label=0.000]
	937 [color=aquamarine shape=rarrow style=filled]
	"143 | NC1C(=O)N2C=C(CBr)CS[C@H]12" -> 937 [label=0.000]
	938 [color=aquamarine shape=rarrow style=filled]
	"145 | NC1C(=O)N[C@@H]1SCC(=CC(=O)O)C(Br)Br" -> 938 [label=0.000]
	939 [color=aquamarine shape=rarrow style=filled]
	"145 | NC1C(=O)N[C@@H]1SCC(=CC(=O)O)C(Br)Br" -> 939 [label=0.000]
	940 [color=aquamarine shape=rarrow style=filled]
	"145 | NC1C(=O)N[C@@H]1SCC(=CC(=O)O)C(Br)Br" -> 940 [label=0.000]
	941 [color=aquamarine shape=rarrow style=filled]
	"145 | NC1C(=O)N[C@@H]1SCC(=CC(=O)O)C(Br)Br" -> 941 [label=0.000]
	942 [color=aquamarine shape=rarrow style=filled]
	"145 | NC1C(=O)N[C@@H]1SCC(=CC(=O)O)C(Br)Br" -> 942 [label=0.000]
	943 [color=aquamarine shape=rarrow style=filled]
	"145 | NC1C(=O)N[C@@H]1SCC(=CC(=O)O)C(Br)Br" -> 943 [label=0.000]
	944 [color=aquamarine shape=rarrow style=filled]
	"145 | NC1C(=O)N[C@@H]1SCC(=CC(=O)O)C(Br)Br" -> 944 [label=0.000]
	945 [color=aquamarine shape=rarrow style=filled]
	"145 | NC1C(=O)N[C@@H]1SCC(=CC(=O)O)C(Br)Br" -> 945 [label=0.000]
	946 [color=aquamarine shape=rarrow style=filled]
	"145 | NC1C(=O)N[C@@H]1SCC(=CC(=O)O)C(Br)Br" -> 946 [label=0.000]
	947 [color=aquamarine shape=rarrow style=filled]
	"145 | NC1C(=O)N[C@@H]1SCC(=CC(=O)O)C(Br)Br" -> 947 [label=0.000]
	948 [color=aquamarine shape=rarrow style=filled]
	"146 | NC(C(=O)O)[C@@H]1NC(C(=O)O)=C(CBr)CS1" -> 948 [label=0.000]
	949 [color=aquamarine shape=rarrow style=filled]
	"146 | NC(C(=O)O)[C@@H]1NC(C(=O)O)=C(CBr)CS1" -> 949 [label=0.000]
	950 [color=aquamarine shape=rarrow style=filled]
	"146 | NC(C(=O)O)[C@@H]1NC(C(=O)O)=C(CBr)CS1" -> 950 [label=0.000]
	951 [color=aquamarine shape=rarrow style=filled]
	"146 | NC(C(=O)O)[C@@H]1NC(C(=O)O)=C(CBr)CS1" -> 951 [label=0.000]
	952 [color=aquamarine shape=rarrow style=filled]
	"146 | NC(C(=O)O)[C@@H]1NC(C(=O)O)=C(CBr)CS1" -> 952 [label=0.000]
	953 [color=aquamarine shape=rarrow style=filled]
	"146 | NC(C(=O)O)[C@@H]1NC(C(=O)O)=C(CBr)CS1" -> 953 [label=0.000]
	954 [color=aquamarine shape=rarrow style=filled]
	"146 | NC(C(=O)O)[C@@H]1NC(C(=O)O)=C(CBr)CS1" -> 954 [label=0.000]
	955 [color=aquamarine shape=rarrow style=filled]
	"146 | NC(C(=O)O)[C@@H]1NC(C(=O)O)=C(CBr)CS1" -> 955 [label=0.000]
	956 [color=aquamarine shape=rarrow style=filled]
	"146 | NC(C(=O)O)[C@@H]1NC(C(=O)O)=C(CBr)CS1" -> 956 [label=0.000]
	957 [color=aquamarine shape=rarrow style=filled]
	"147 | NC1C(=O)N[C@@H]1SCC(CBr)=C(O)C(=O)O" -> 957 [label=0.000]
	958 [color=aquamarine shape=rarrow style=filled]
	"147 | NC1C(=O)N[C@@H]1SCC(CBr)=C(O)C(=O)O" -> 958 [label=0.000]
	959 [color=aquamarine shape=rarrow style=filled]
	"147 | NC1C(=O)N[C@@H]1SCC(CBr)=C(O)C(=O)O" -> 959 [label=0.000]
	960 [color=aquamarine shape=rarrow style=filled]
	"147 | NC1C(=O)N[C@@H]1SCC(CBr)=C(O)C(=O)O" -> 960 [label=0.000]
	961 [color=aquamarine shape=rarrow style=filled]
	"147 | NC1C(=O)N[C@@H]1SCC(CBr)=C(O)C(=O)O" -> 961 [label=0.000]
	962 [color=aquamarine shape=rarrow style=filled]
	"147 | NC1C(=O)N[C@@H]1SCC(CBr)=C(O)C(=O)O" -> 962 [label=0.000]
	963 [color=aquamarine shape=rarrow style=filled]
	"147 | NC1C(=O)N[C@@H]1SCC(CBr)=C(O)C(=O)O" -> 963 [label=0.000]
	964 [color=aquamarine shape=rarrow style=filled]
	"147 | NC1C(=O)N[C@@H]1SCC(CBr)=C(O)C(=O)O" -> 964 [label=0.000]
	965 [color=aquamarine shape=rarrow style=filled]
	"147 | NC1C(=O)N[C@@H]1SCC(CBr)=C(O)C(=O)O" -> 965 [label=0.000]
	966 [color=aquamarine shape=rarrow style=filled]
	"147 | NC1C(=O)N[C@@H]1SCC(CBr)=C(O)C(=O)O" -> 966 [label=0.000]
	967 [color=aquamarine shape=rarrow style=filled]
	"148 | NC1C(=O)N[C@@H]1SCC(CBr)=C(Cl)C(=O)O" -> 967 [label=0.000]
	968 [color=aquamarine shape=rarrow style=filled]
	"148 | NC1C(=O)N[C@@H]1SCC(CBr)=C(Cl)C(=O)O" -> 968 [label=0.000]
	969 [color=aquamarine shape=rarrow style=filled]
	"148 | NC1C(=O)N[C@@H]1SCC(CBr)=C(Cl)C(=O)O" -> 969 [label=0.000]
	970 [color=aquamarine shape=rarrow style=filled]
	"148 | NC1C(=O)N[C@@H]1SCC(CBr)=C(Cl)C(=O)O" -> 970 [label=0.000]
	971 [color=aquamarine shape=rarrow style=filled]
	"148 | NC1C(=O)N[C@@H]1SCC(CBr)=C(Cl)C(=O)O" -> 971 [label=0.000]
	972 [color=aquamarine shape=rarrow style=filled]
	"148 | NC1C(=O)N[C@@H]1SCC(CBr)=C(Cl)C(=O)O" -> 972 [label=0.000]
	973 [color=aquamarine shape=rarrow style=filled]
	"148 | NC1C(=O)N[C@@H]1SCC(CBr)=C(Cl)C(=O)O" -> 973 [label=0.000]
	974 [color=aquamarine shape=rarrow style=filled]
	"148 | NC1C(=O)N[C@@H]1SCC(CBr)=C(Cl)C(=O)O" -> 974 [label=0.000]
	975 [color=aquamarine shape=rarrow style=filled]
	"148 | NC1C(=O)N[C@@H]1SCC(CBr)=C(Cl)C(=O)O" -> 975 [label=0.000]
	976 [color=aquamarine shape=rarrow style=filled]
	"148 | NC1C(=O)N[C@@H]1SCC(CBr)=C(Cl)C(=O)O" -> 976 [label=0.000]
	977 [color=aquamarine shape=rarrow style=filled]
	"149 | NC1C(=O)N[C@@H]1SCC(CBr)C(=O)C(=O)O" -> 977 [label=0.000]
	978 [color=aquamarine shape=rarrow style=filled]
	"149 | NC1C(=O)N[C@@H]1SCC(CBr)C(=O)C(=O)O" -> 978 [label=0.000]
	979 [color=aquamarine shape=rarrow style=filled]
	"149 | NC1C(=O)N[C@@H]1SCC(CBr)C(=O)C(=O)O" -> 979 [label=0.000]
	980 [color=aquamarine shape=rarrow style=filled]
	"149 | NC1C(=O)N[C@@H]1SCC(CBr)C(=O)C(=O)O" -> 980 [label=0.000]
	981 [color=aquamarine shape=rarrow style=filled]
	"149 | NC1C(=O)N[C@@H]1SCC(CBr)C(=O)C(=O)O" -> 981 [label=0.000]
	982 [color=aquamarine shape=rarrow style=filled]
	"150 | NC1C(=O)N[C@@H]1SCC(CBr)CC(=O)O" -> 982 [label=0.000]
	983 [color=aquamarine shape=rarrow style=filled]
	"150 | NC1C(=O)N[C@@H]1SCC(CBr)CC(=O)O" -> 983 [label=0.000]
	984 [color=aquamarine shape=rarrow style=filled]
	"150 | NC1C(=O)N[C@@H]1SCC(CBr)CC(=O)O" -> 984 [label=0.000]
	985 [color=aquamarine shape=rarrow style=filled]
	"151 | NC1C(=O)N[C@@H]1SCCCBr" -> 985 [label=0.000]
	986 [color=aquamarine shape=rarrow style=filled]
	"151 | NC1C(=O)N[C@@H]1SCCCBr" -> 986 [label=0.000]
	987 [color=aquamarine shape=rarrow style=filled]
	"151 | NC1C(=O)N[C@@H]1SCCCBr" -> 987 [label=0.000]
	988 [color=aquamarine shape=rarrow style=filled]
	"153 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 988 [label=0.000]
	989 [color=aquamarine shape=rarrow style=filled]
	"153 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 989 [label=0.000]
	990 [color=aquamarine shape=rarrow style=filled]
	"153 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 990 [label=0.000]
	991 [color=aquamarine shape=rarrow style=filled]
	"153 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 991 [label=0.000]
	992 [color=aquamarine shape=rarrow style=filled]
	"153 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 992 [label=0.000]
	993 [color=aquamarine shape=rarrow style=filled]
	"153 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 993 [label=0.000]
	994 [color=aquamarine shape=rarrow style=filled]
	"153 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 994 [label=0.000]
	995 [color=aquamarine shape=rarrow style=filled]
	"153 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 995 [label=0.000]
	996 [color=aquamarine shape=rarrow style=filled]
	"153 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 996 [label=0.000]
	997 [color=aquamarine shape=rarrow style=filled]
	"153 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 997 [label=0.000]
	998 [color=aquamarine shape=rarrow style=filled]
	"154 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 998 [label=0.000]
	999 [color=aquamarine shape=rarrow style=filled]
	"154 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 999 [label=0.000]
	1000 [color=aquamarine shape=rarrow style=filled]
	"154 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 1000 [label=0.000]
	1001 [color=aquamarine shape=rarrow style=filled]
	"154 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 1001 [label=0.000]
	1002 [color=aquamarine shape=rarrow style=filled]
	"154 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 1002 [label=0.000]
	1003 [color=aquamarine shape=rarrow style=filled]
	"154 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 1003 [label=0.000]
	1004 [color=aquamarine shape=rarrow style=filled]
	"154 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 1004 [label=0.000]
	1005 [color=aquamarine shape=rarrow style=filled]
	"154 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 1005 [label=0.000]
	1006 [color=aquamarine shape=rarrow style=filled]
	"154 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 1006 [label=0.000]
	1007 [color=aquamarine shape=rarrow style=filled]
	"154 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 1007 [label=0.000]
	1008 [color=aquamarine shape=rarrow style=filled]
	"155 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 1008 [label=0.000]
	1009 [color=aquamarine shape=rarrow style=filled]
	"155 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 1009 [label=0.000]
	1010 [color=aquamarine shape=rarrow style=filled]
	"155 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 1010 [label=0.000]
	1011 [color=aquamarine shape=rarrow style=filled]
	"155 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 1011 [label=0.000]
	1012 [color=aquamarine shape=rarrow style=filled]
	"155 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 1012 [label=0.000]
	1013 [color=aquamarine shape=rarrow style=filled]
	"155 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 1013 [label=0.000]
	1014 [color=aquamarine shape=rarrow style=filled]
	"155 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 1014 [label=0.000]
	1015 [color=aquamarine shape=rarrow style=filled]
	"155 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 1015 [label=0.000]
	1016 [color=aquamarine shape=rarrow style=filled]
	"155 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" -> 1016 [label=0.000]
	1017 [color=aquamarine shape=rarrow style=filled]
	"156 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1017 [label=0.000]
	1018 [color=aquamarine shape=rarrow style=filled]
	"156 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1018 [label=0.000]
	1019 [color=aquamarine shape=rarrow style=filled]
	"156 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1019 [label=0.000]
	1020 [color=aquamarine shape=rarrow style=filled]
	"156 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1020 [label=0.000]
	1021 [color=aquamarine shape=rarrow style=filled]
	"156 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1021 [label=0.000]
	1022 [color=aquamarine shape=rarrow style=filled]
	"156 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1022 [label=0.000]
	1023 [color=aquamarine shape=rarrow style=filled]
	"156 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1023 [label=0.000]
	1024 [color=aquamarine shape=rarrow style=filled]
	"156 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1024 [label=0.000]
	1025 [color=aquamarine shape=rarrow style=filled]
	"156 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1025 [label=0.000]
	1026 [color=aquamarine shape=rarrow style=filled]
	"156 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1026 [label=0.000]
	1027 [color=aquamarine shape=rarrow style=filled]
	"157 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 1027 [label=0.000]
	1028 [color=aquamarine shape=rarrow style=filled]
	"157 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 1028 [label=0.000]
	1029 [color=aquamarine shape=rarrow style=filled]
	"157 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 1029 [label=0.000]
	1030 [color=aquamarine shape=rarrow style=filled]
	"157 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 1030 [label=0.000]
	1031 [color=aquamarine shape=rarrow style=filled]
	"157 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 1031 [label=0.000]
	1032 [color=aquamarine shape=rarrow style=filled]
	"157 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 1032 [label=0.000]
	1033 [color=aquamarine shape=rarrow style=filled]
	"157 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 1033 [label=0.000]
	1034 [color=aquamarine shape=rarrow style=filled]
	"157 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 1034 [label=0.000]
	1035 [color=aquamarine shape=rarrow style=filled]
	"157 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 1035 [label=0.000]
	1036 [color=aquamarine shape=rarrow style=filled]
	"157 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 1036 [label=0.000]
	1037 [color=aquamarine shape=rarrow style=filled]
	"160 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1037 [label=0.000]
	1038 [color=aquamarine shape=rarrow style=filled]
	"160 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1038 [label=0.000]
	1039 [color=aquamarine shape=rarrow style=filled]
	"160 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1039 [label=0.000]
	1040 [color=aquamarine shape=rarrow style=filled]
	"160 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1040 [label=0.000]
	1041 [color=aquamarine shape=rarrow style=filled]
	"160 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1041 [label=0.000]
	1042 [color=aquamarine shape=rarrow style=filled]
	"160 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1042 [label=0.000]
	1043 [color=aquamarine shape=rarrow style=filled]
	"160 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1043 [label=0.000]
	1044 [color=aquamarine shape=rarrow style=filled]
	"160 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1044 [label=0.000]
	1045 [color=aquamarine shape=rarrow style=filled]
	"160 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1045 [label=0.000]
	1046 [color=aquamarine shape=rarrow style=filled]
	"160 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1046 [label=0.000]
	1047 [color=lightblue shape=rarrow style=filled]
	"161 | CCC(C)(C)OC(=O)O" -> 1047 [label=0.000]
	1048 [color=lightblue shape=rarrow style=filled]
	"161 | CCC(C)(C)OC(=O)O" -> 1048 [label=0.000]
	1049 [color=lightblue shape=rarrow style=filled]
	"161 | CCC(C)(C)OC(=O)O" -> 1049 [label=0.000]
	1050 [color=aquamarine shape=rarrow style=filled]
	"161 | CCC(C)(C)OC(=O)O" -> 1050 [label=0.000]
	1051 [color=lightblue shape=rarrow style=filled]
	"161 | CCC(C)(C)OC(=O)O" -> 1051 [label=0.000]
	1052 [color=aquamarine shape=rarrow style=filled]
	"161 | CCC(C)(C)OC(=O)O" -> 1052 [label=0.000]
	1053 [color=aquamarine shape=rarrow style=filled]
	"161 | CCC(C)(C)OC(=O)O" -> 1053 [label=0.000]
	1054 [color=aquamarine shape=rarrow style=filled]
	"161 | CCC(C)(C)OC(=O)O" -> 1054 [label=0.000]
	1055 [color=lightblue shape=rarrow style=filled]
	"162 | Nc1nc(C(O)C(=O)O)cs1" -> 1055 [label=0.000]
	1056 [color=lightblue shape=rarrow style=filled]
	"162 | Nc1nc(C(O)C(=O)O)cs1" -> 1056 [label=0.000]
	1057 [color=lightblue shape=rarrow style=filled]
	"162 | Nc1nc(C(O)C(=O)O)cs1" -> 1057 [label=0.000]
	1058 [color=aquamarine shape=rarrow style=filled]
	"162 | Nc1nc(C(O)C(=O)O)cs1" -> 1058 [label=0.000]
	1059 [color=lightblue shape=rarrow style=filled]
	"162 | Nc1nc(C(O)C(=O)O)cs1" -> 1059 [label=0.000]
	1060 [color=lightblue shape=rarrow style=filled]
	"162 | Nc1nc(C(O)C(=O)O)cs1" -> 1060 [label=0.000]
	1061 [color=lightblue shape=rarrow style=filled]
	"162 | Nc1nc(C(O)C(=O)O)cs1" -> 1061 [label=0.000]
	1062 [color=lightblue shape=rarrow style=filled]
	"162 | Nc1nc(C(O)C(=O)O)cs1" -> 1062 [label=0.000]
	1063 [color=aquamarine shape=rarrow style=filled]
	"162 | Nc1nc(C(O)C(=O)O)cs1" -> 1063 [label=0.000]
	1064 [color=lightblue shape=rarrow style=filled]
	"162 | Nc1nc(C(O)C(=O)O)cs1" -> 1064 [label=0.000]
	1065 [color=aquamarine shape=rarrow style=filled]
	"163 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 1065 [label=0.000]
	1066 [color=aquamarine shape=rarrow style=filled]
	"163 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 1066 [label=0.000]
	1067 [color=aquamarine shape=rarrow style=filled]
	"163 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 1067 [label=0.000]
	1068 [color=aquamarine shape=rarrow style=filled]
	"163 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 1068 [label=0.000]
	1069 [color=aquamarine shape=rarrow style=filled]
	"163 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 1069 [label=0.000]
	1070 [color=aquamarine shape=rarrow style=filled]
	"163 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 1070 [label=0.000]
	1071 [color=aquamarine shape=rarrow style=filled]
	"163 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 1071 [label=0.000]
	1072 [color=aquamarine shape=rarrow style=filled]
	"163 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 1072 [label=0.000]
	1073 [color=aquamarine shape=rarrow style=filled]
	"163 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 1073 [label=0.000]
	1074 [color=aquamarine shape=rarrow style=filled]
	"163 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 1074 [label=0.000]
	1075 [color=lightblue shape=rarrow style=filled]
	"164 | CCC(C)(C)OC=O" -> 1075 [label=0.000]
	1076 [color=lightblue shape=rarrow style=filled]
	"164 | CCC(C)(C)OC=O" -> 1076 [label=0.000]
	1077 [color=lightblue shape=rarrow style=filled]
	"164 | CCC(C)(C)OC=O" -> 1077 [label=0.000]
	1078 [color=lightblue shape=rarrow style=filled]
	"164 | CCC(C)(C)OC=O" -> 1078 [label=0.000]
	1079 [color=lightblue shape=rarrow style=filled]
	"164 | CCC(C)(C)OC=O" -> 1079 [label=0.000]
	1080 [color=lightblue shape=rarrow style=filled]
	"164 | CCC(C)(C)OC=O" -> 1080 [label=0.000]
	1081 [color=lightblue shape=rarrow style=filled]
	"164 | CCC(C)(C)OC=O" -> 1081 [label=0.000]
	1082 [color=aquamarine shape=rarrow style=filled]
	"164 | CCC(C)(C)OC=O" -> 1082 [label=0.000]
	1083 [color=aquamarine shape=rarrow style=filled]
	"164 | CCC(C)(C)OC=O" -> 1083 [label=0.000]
	1084 [color=aquamarine shape=rarrow style=filled]
	"166 | CC(=O)C(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 1084 [label=0.000]
	1085 [color=aquamarine shape=rarrow style=filled]
	"166 | CC(=O)C(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 1085 [label=0.000]
	1086 [color=aquamarine shape=rarrow style=filled]
	"166 | CC(=O)C(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 1086 [label=0.000]
	1087 [color=aquamarine shape=rarrow style=filled]
	"166 | CC(=O)C(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 1087 [label=0.000]
	1088 [color=aquamarine shape=rarrow style=filled]
	"166 | CC(=O)C(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 1088 [label=0.000]
	1089 [color=aquamarine shape=rarrow style=filled]
	"166 | CC(=O)C(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 1089 [label=0.000]
	1090 [color=aquamarine shape=rarrow style=filled]
	"166 | CC(=O)C(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 1090 [label=0.000]
	1091 [color=aquamarine shape=rarrow style=filled]
	"166 | CC(=O)C(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 1091 [label=0.000]
	1092 [color=aquamarine shape=rarrow style=filled]
	"166 | CC(=O)C(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 1092 [label=0.000]
	1093 [color=aquamarine shape=rarrow style=filled]
	"166 | CC(=O)C(C)(C)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N3C=C(C)CS[C@H]23)cs1" -> 1093 [label=0.000]
	1094 [color=lightblue shape=rarrow style=filled]
	"167 | CCC(C)(C)OC(=O)O" -> 1094 [label=0.000]
	1095 [color=lightblue shape=rarrow style=filled]
	"167 | CCC(C)(C)OC(=O)O" -> 1095 [label=0.000]
	1096 [color=lightblue shape=rarrow style=filled]
	"167 | CCC(C)(C)OC(=O)O" -> 1096 [label=0.000]
	1097 [color=aquamarine shape=rarrow style=filled]
	"167 | CCC(C)(C)OC(=O)O" -> 1097 [label=0.000]
	1098 [color=lightblue shape=rarrow style=filled]
	"167 | CCC(C)(C)OC(=O)O" -> 1098 [label=0.000]
	1099 [color=aquamarine shape=rarrow style=filled]
	"167 | CCC(C)(C)OC(=O)O" -> 1099 [label=0.000]
	1100 [color=aquamarine shape=rarrow style=filled]
	"167 | CCC(C)(C)OC(=O)O" -> 1100 [label=0.000]
	1101 [color=aquamarine shape=rarrow style=filled]
	"167 | CCC(C)(C)OC(=O)O" -> 1101 [label=0.000]
	1102 [color=aquamarine shape=rarrow style=filled]
	"168 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1102 [label=0.000]
	1103 [color=aquamarine shape=rarrow style=filled]
	"168 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1103 [label=0.000]
	1104 [color=aquamarine shape=rarrow style=filled]
	"168 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1104 [label=0.000]
	1105 [color=aquamarine shape=rarrow style=filled]
	"168 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1105 [label=0.000]
	1106 [color=aquamarine shape=rarrow style=filled]
	"168 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1106 [label=0.000]
	1107 [color=aquamarine shape=rarrow style=filled]
	"168 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1107 [label=0.000]
	1108 [color=aquamarine shape=rarrow style=filled]
	"168 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1108 [label=0.000]
	1109 [color=aquamarine shape=rarrow style=filled]
	"168 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1109 [label=0.000]
	1110 [color=aquamarine shape=rarrow style=filled]
	"168 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1110 [label=0.000]
	1111 [color=aquamarine shape=rarrow style=filled]
	"168 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1111 [label=0.000]
	1112 [color=lightblue shape=rarrow style=filled]
	"169 | CCC(C)(C)OCO" -> 1112 [label=0.000]
	1113 [color=lightblue shape=rarrow style=filled]
	"169 | CCC(C)(C)OCO" -> 1113 [label=0.000]
	1114 [color=lightblue shape=rarrow style=filled]
	"169 | CCC(C)(C)OCO" -> 1114 [label=0.000]
	1115 [color=lightblue shape=rarrow style=filled]
	"169 | CCC(C)(C)OCO" -> 1115 [label=0.000]
	1116 [color=lightblue shape=rarrow style=filled]
	"169 | CCC(C)(C)OCO" -> 1116 [label=0.000]
	1117 [color=lightblue shape=rarrow style=filled]
	"169 | CCC(C)(C)OCO" -> 1117 [label=0.000]
	1118 [color=lightblue shape=rarrow style=filled]
	"169 | CCC(C)(C)OCO" -> 1118 [label=0.000]
	1119 [color=lightblue shape=rarrow style=filled]
	"169 | CCC(C)(C)OCO" -> 1119 [label=0.000]
	1120 [color=lightblue shape=rarrow style=filled]
	"169 | CCC(C)(C)OCO" -> 1120 [label=0.000]
	1121 [color=lightblue shape=rarrow style=filled]
	"169 | CCC(C)(C)OCO" -> 1121 [label=0.000]
	1122 [color=aquamarine shape=rarrow style=filled]
	"170 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1122 [label=0.000]
	1123 [color=aquamarine shape=rarrow style=filled]
	"170 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1123 [label=0.000]
	1124 [color=aquamarine shape=rarrow style=filled]
	"170 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1124 [label=0.000]
	1125 [color=aquamarine shape=rarrow style=filled]
	"170 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1125 [label=0.000]
	1126 [color=aquamarine shape=rarrow style=filled]
	"170 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1126 [label=0.000]
	1127 [color=aquamarine shape=rarrow style=filled]
	"170 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1127 [label=0.000]
	1128 [color=aquamarine shape=rarrow style=filled]
	"170 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1128 [label=0.000]
	1129 [color=aquamarine shape=rarrow style=filled]
	"170 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1129 [label=0.000]
	1130 [color=aquamarine shape=rarrow style=filled]
	"170 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1130 [label=0.000]
	1131 [color=aquamarine shape=rarrow style=filled]
	"170 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1131 [label=0.000]
	1132 [color=lightblue shape=rarrow style=filled]
	"171 | CC(C)(C)OC(=O)O" -> 1132 [label=0.000]
	1133 [color=lightblue shape=rarrow style=filled]
	"171 | CC(C)(C)OC(=O)O" -> 1133 [label=0.000]
	1134 [color=lightblue shape=rarrow style=filled]
	"171 | CC(C)(C)OC(=O)O" -> 1134 [label=0.000]
	1135 [color=aquamarine shape=rarrow style=filled]
	"171 | CC(C)(C)OC(=O)O" -> 1135 [label=0.000]
	1136 [color=lightblue shape=rarrow style=filled]
	"171 | CC(C)(C)OC(=O)O" -> 1136 [label=0.000]
	1137 [color=lightblue shape=rarrow style=filled]
	"171 | CC(C)(C)OC(=O)O" -> 1137 [label=0.000]
	1138 [color=aquamarine shape=rarrow style=filled]
	"171 | CC(C)(C)OC(=O)O" -> 1138 [label=0.000]
	1139 [color=lightblue shape=rarrow style=filled]
	"171 | CC(C)(C)OC(=O)O" -> 1139 [label=0.000]
	1140 [color=aquamarine shape=rarrow style=filled]
	"171 | CC(C)(C)OC(=O)O" -> 1140 [label=0.000]
	1141 [color=aquamarine shape=rarrow style=filled]
	"171 | CC(C)(C)OC(=O)O" -> 1141 [label=0.000]
	1142 [color=lightblue shape=rarrow style=filled]
	"172 | CCC(C)(C)OC(=O)O" -> 1142 [label=0.000]
	1143 [color=lightblue shape=rarrow style=filled]
	"172 | CCC(C)(C)OC(=O)O" -> 1143 [label=0.000]
	1144 [color=lightblue shape=rarrow style=filled]
	"172 | CCC(C)(C)OC(=O)O" -> 1144 [label=0.000]
	1145 [color=aquamarine shape=rarrow style=filled]
	"172 | CCC(C)(C)OC(=O)O" -> 1145 [label=0.000]
	1146 [color=lightblue shape=rarrow style=filled]
	"172 | CCC(C)(C)OC(=O)O" -> 1146 [label=0.000]
	1147 [color=aquamarine shape=rarrow style=filled]
	"172 | CCC(C)(C)OC(=O)O" -> 1147 [label=0.000]
	1148 [color=aquamarine shape=rarrow style=filled]
	"172 | CCC(C)(C)OC(=O)O" -> 1148 [label=0.000]
	1149 [color=aquamarine shape=rarrow style=filled]
	"172 | CCC(C)(C)OC(=O)O" -> 1149 [label=0.000]
	1150 [color=aquamarine shape=rarrow style=filled]
	"173 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1150 [label=0.000]
	1151 [color=aquamarine shape=rarrow style=filled]
	"173 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1151 [label=0.000]
	1152 [color=aquamarine shape=rarrow style=filled]
	"173 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1152 [label=0.000]
	1153 [color=aquamarine shape=rarrow style=filled]
	"173 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1153 [label=0.000]
	1154 [color=aquamarine shape=rarrow style=filled]
	"173 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1154 [label=0.000]
	1155 [color=aquamarine shape=rarrow style=filled]
	"173 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1155 [label=0.000]
	1156 [color=aquamarine shape=rarrow style=filled]
	"173 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1156 [label=0.000]
	1157 [color=aquamarine shape=rarrow style=filled]
	"173 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1157 [label=0.000]
	1158 [color=aquamarine shape=rarrow style=filled]
	"173 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1158 [label=0.000]
	1159 [color=aquamarine shape=rarrow style=filled]
	"173 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" -> 1159 [label=0.000]
	1160 [color=aquamarine shape=rarrow style=filled]
	"174 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 1160 [label=0.000]
	1161 [color=aquamarine shape=rarrow style=filled]
	"174 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 1161 [label=0.000]
	1162 [color=aquamarine shape=rarrow style=filled]
	"174 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 1162 [label=0.000]
	1163 [color=aquamarine shape=rarrow style=filled]
	"174 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 1163 [label=0.000]
	1164 [color=aquamarine shape=rarrow style=filled]
	"174 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 1164 [label=0.000]
	1165 [color=aquamarine shape=rarrow style=filled]
	"174 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 1165 [label=0.000]
	1166 [color=aquamarine shape=rarrow style=filled]
	"174 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 1166 [label=0.000]
	1167 [color=aquamarine shape=rarrow style=filled]
	"174 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 1167 [label=0.000]
	1168 [color=aquamarine shape=rarrow style=filled]
	"174 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 1168 [label=0.000]
	1169 [color=aquamarine shape=rarrow style=filled]
	"175 | NC1C(=O)N[C@@H]1S(C=O)=[O+]Br" -> 1169 [label=0.000]
	1170 [color=aquamarine shape=rarrow style=filled]
	"175 | NC1C(=O)N[C@@H]1S(C=O)=[O+]Br" -> 1170 [label=0.000]
	1171 [color=aquamarine shape=rarrow style=filled]
	"175 | NC1C(=O)N[C@@H]1S(C=O)=[O+]Br" -> 1171 [label=0.000]
	1172 [color=aquamarine shape=rarrow style=filled]
	"175 | NC1C(=O)N[C@@H]1S(C=O)=[O+]Br" -> 1172 [label=0.000]
	1173 [color=aquamarine shape=rarrow style=filled]
	"175 | NC1C(=O)N[C@@H]1S(C=O)=[O+]Br" -> 1173 [label=0.000]
	1174 [color=aquamarine shape=rarrow style=filled]
	"175 | NC1C(=O)N[C@@H]1S(C=O)=[O+]Br" -> 1174 [label=0.000]
	1175 [color=aquamarine shape=rarrow style=filled]
	"175 | NC1C(=O)N[C@@H]1S(C=O)=[O+]Br" -> 1175 [label=0.000]
	1176 [color=aquamarine shape=rarrow style=filled]
	"175 | NC1C(=O)N[C@@H]1S(C=O)=[O+]Br" -> 1176 [label=0.000]
	1177 [color=aquamarine shape=rarrow style=filled]
	"175 | NC1C(=O)N[C@@H]1S(C=O)=[O+]Br" -> 1177 [label=0.000]
	1178 [color=aquamarine shape=rarrow style=filled]
	"175 | NC1C(=O)N[C@@H]1S(C=O)=[O+]Br" -> 1178 [label=0.000]
	1179 [color=aquamarine shape=rarrow style=filled]
	"176 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=[O+]Br)cs1" -> 1179 [label=0.000]
	1180 [color=aquamarine shape=rarrow style=filled]
	"176 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=[O+]Br)cs1" -> 1180 [label=0.000]
	1181 [color=aquamarine shape=rarrow style=filled]
	"176 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=[O+]Br)cs1" -> 1181 [label=0.000]
	1182 [color=aquamarine shape=rarrow style=filled]
	"176 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=[O+]Br)cs1" -> 1182 [label=0.000]
	1183 [color=aquamarine shape=rarrow style=filled]
	"176 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=[O+]Br)cs1" -> 1183 [label=0.000]
	1184 [color=aquamarine shape=rarrow style=filled]
	"176 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=[O+]Br)cs1" -> 1184 [label=0.000]
	1185 [color=aquamarine shape=rarrow style=filled]
	"176 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=[O+]Br)cs1" -> 1185 [label=0.000]
	1186 [color=aquamarine shape=rarrow style=filled]
	"176 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=[O+]Br)cs1" -> 1186 [label=0.000]
	1187 [color=aquamarine shape=rarrow style=filled]
	"176 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=[O+]Br)cs1" -> 1187 [label=0.000]
	1188 [color=aquamarine shape=rarrow style=filled]
	"178 | [O+][Br+]Cl" -> 1188 [label=0.000]
	1189 [color=aquamarine shape=rarrow style=filled]
	"178 | [O+][Br+]Cl" -> 1189 [label=0.000]
	1190 [color=aquamarine shape=rarrow style=filled]
	"178 | [O+][Br+]Cl" -> 1190 [label=0.000]
	1191 [color=aquamarine shape=rarrow style=filled]
	"178 | [O+][Br+]Cl" -> 1191 [label=0.000]
	1192 [color=aquamarine shape=rarrow style=filled]
	"178 | [O+][Br+]Cl" -> 1192 [label=0.000]
	1193 [color=aquamarine shape=rarrow style=filled]
	"178 | [O+][Br+]Cl" -> 1193 [label=0.000]
	1194 [color=aquamarine shape=rarrow style=filled]
	"178 | [O+][Br+]Cl" -> 1194 [label=0.000]
	1195 [color=aquamarine shape=rarrow style=filled]
	"178 | [O+][Br+]Cl" -> 1195 [label=0.000]
	1196 [color=aquamarine shape=rarrow style=filled]
	"179 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" -> 1196 [label=0.000]
	1197 [color=aquamarine shape=rarrow style=filled]
	"179 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" -> 1197 [label=0.000]
	1198 [color=aquamarine shape=rarrow style=filled]
	"179 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" -> 1198 [label=0.000]
	1199 [color=aquamarine shape=rarrow style=filled]
	"179 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" -> 1199 [label=0.000]
	1200 [color=aquamarine shape=rarrow style=filled]
	"179 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" -> 1200 [label=0.000]
	1201 [color=aquamarine shape=rarrow style=filled]
	"179 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" -> 1201 [label=0.000]
	1202 [color=aquamarine shape=rarrow style=filled]
	"179 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" -> 1202 [label=0.000]
	1203 [color=aquamarine shape=rarrow style=filled]
	"179 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" -> 1203 [label=0.000]
	1204 [color=aquamarine shape=rarrow style=filled]
	"179 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" -> 1204 [label=0.000]
	1205 [color=aquamarine shape=rarrow style=filled]
	"180 | CC(Br)C(C)(C=O)OC(=O)Cl" -> 1205 [label=0.000]
	1206 [color=aquamarine shape=rarrow style=filled]
	"180 | CC(Br)C(C)(C=O)OC(=O)Cl" -> 1206 [label=0.000]
	1207 [color=aquamarine shape=rarrow style=filled]
	"180 | CC(Br)C(C)(C=O)OC(=O)Cl" -> 1207 [label=0.000]
	1208 [color=aquamarine shape=rarrow style=filled]
	"180 | CC(Br)C(C)(C=O)OC(=O)Cl" -> 1208 [label=0.000]
	1209 [color=aquamarine shape=rarrow style=filled]
	"180 | CC(Br)C(C)(C=O)OC(=O)Cl" -> 1209 [label=0.000]
	1210 [color=aquamarine shape=rarrow style=filled]
	"180 | CC(Br)C(C)(C=O)OC(=O)Cl" -> 1210 [label=0.000]
	1211 [color=aquamarine shape=rarrow style=filled]
	"180 | CC(Br)C(C)(C=O)OC(=O)Cl" -> 1211 [label=0.000]
	1212 [color=aquamarine shape=rarrow style=filled]
	"180 | CC(Br)C(C)(C=O)OC(=O)Cl" -> 1212 [label=0.000]
	1213 [color=aquamarine shape=rarrow style=filled]
	"180 | CC(Br)C(C)(C=O)OC(=O)Cl" -> 1213 [label=0.000]
	1214 [color=aquamarine shape=rarrow style=filled]
	"181 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(C=O)=[O+]Br)cs1" -> 1214 [label=0.000]
	1215 [color=aquamarine shape=rarrow style=filled]
	"181 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(C=O)=[O+]Br)cs1" -> 1215 [label=0.000]
	1216 [color=aquamarine shape=rarrow style=filled]
	"181 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(C=O)=[O+]Br)cs1" -> 1216 [label=0.000]
	1217 [color=aquamarine shape=rarrow style=filled]
	"181 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(C=O)=[O+]Br)cs1" -> 1217 [label=0.000]
	1218 [color=aquamarine shape=rarrow style=filled]
	"181 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(C=O)=[O+]Br)cs1" -> 1218 [label=0.000]
	1219 [color=aquamarine shape=rarrow style=filled]
	"181 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(C=O)=[O+]Br)cs1" -> 1219 [label=0.000]
	1220 [color=aquamarine shape=rarrow style=filled]
	"181 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(C=O)=[O+]Br)cs1" -> 1220 [label=0.000]
	1221 [color=aquamarine shape=rarrow style=filled]
	"181 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(C=O)=[O+]Br)cs1" -> 1221 [label=0.000]
	1222 [color=aquamarine shape=rarrow style=filled]
	"181 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(C=O)=[O+]Br)cs1" -> 1222 [label=0.000]
	1223 [color=aquamarine shape=rarrow style=filled]
	"181 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(C=O)=[O+]Br)cs1" -> 1223 [label=0.000]
	1224 [color=aquamarine shape=rarrow style=filled]
	"182 | [O+][Br+]O" -> 1224 [label=0.000]
	1225 [color=aquamarine shape=rarrow style=filled]
	"182 | [O+][Br+]O" -> 1225 [label=0.000]
	1226 [color=aquamarine shape=rarrow style=filled]
	"182 | [O+][Br+]O" -> 1226 [label=0.000]
	1227 [color=aquamarine shape=rarrow style=filled]
	"182 | [O+][Br+]O" -> 1227 [label=0.000]
	1228 [color=aquamarine shape=rarrow style=filled]
	"182 | [O+][Br+]O" -> 1228 [label=0.000]
	1229 [color=aquamarine shape=rarrow style=filled]
	"183 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" -> 1229 [label=0.000]
	1230 [color=aquamarine shape=rarrow style=filled]
	"183 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" -> 1230 [label=0.000]
	1231 [color=aquamarine shape=rarrow style=filled]
	"183 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" -> 1231 [label=0.000]
	1232 [color=aquamarine shape=rarrow style=filled]
	"183 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" -> 1232 [label=0.000]
	1233 [color=aquamarine shape=rarrow style=filled]
	"183 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" -> 1233 [label=0.000]
	1234 [color=aquamarine shape=rarrow style=filled]
	"183 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" -> 1234 [label=0.000]
	1235 [color=aquamarine shape=rarrow style=filled]
	"183 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" -> 1235 [label=0.000]
	1236 [color=aquamarine shape=rarrow style=filled]
	"183 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" -> 1236 [label=0.000]
	1237 [color=aquamarine shape=rarrow style=filled]
	"183 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" -> 1237 [label=0.000]
	1238 [color=aquamarine shape=rarrow style=filled]
	"184 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C=O)cs1" -> 1238 [label=0.000]
	1239 [color=aquamarine shape=rarrow style=filled]
	"184 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C=O)cs1" -> 1239 [label=0.000]
	1240 [color=aquamarine shape=rarrow style=filled]
	"184 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C=O)cs1" -> 1240 [label=0.000]
	1241 [color=aquamarine shape=rarrow style=filled]
	"184 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C=O)cs1" -> 1241 [label=0.000]
	1242 [color=aquamarine shape=rarrow style=filled]
	"184 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C=O)cs1" -> 1242 [label=0.000]
	1243 [color=aquamarine shape=rarrow style=filled]
	"184 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C=O)cs1" -> 1243 [label=0.000]
	1244 [color=aquamarine shape=rarrow style=filled]
	"184 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C=O)cs1" -> 1244 [label=0.000]
	1245 [color=aquamarine shape=rarrow style=filled]
	"184 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C=O)cs1" -> 1245 [label=0.000]
	1246 [color=aquamarine shape=rarrow style=filled]
	"184 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C=O)cs1" -> 1246 [label=0.000]
	1247 [color=aquamarine shape=rarrow style=filled]
	"186 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C=O)cs1" -> 1247 [label=0.000]
	1248 [color=aquamarine shape=rarrow style=filled]
	"186 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C=O)cs1" -> 1248 [label=0.000]
	1249 [color=aquamarine shape=rarrow style=filled]
	"186 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C=O)cs1" -> 1249 [label=0.000]
	1250 [color=aquamarine shape=rarrow style=filled]
	"186 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C=O)cs1" -> 1250 [label=0.000]
	1251 [color=aquamarine shape=rarrow style=filled]
	"186 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C=O)cs1" -> 1251 [label=0.000]
	1252 [color=aquamarine shape=rarrow style=filled]
	"186 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C=O)cs1" -> 1252 [label=0.000]
	1253 [color=aquamarine shape=rarrow style=filled]
	"186 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C=O)cs1" -> 1253 [label=0.000]
	1254 [color=aquamarine shape=rarrow style=filled]
	"186 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C=O)cs1" -> 1254 [label=0.000]
	1255 [color=aquamarine shape=rarrow style=filled]
	"186 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C=O)cs1" -> 1255 [label=0.000]
	1256 [color=aquamarine shape=rarrow style=filled]
	"187 | [O+]Br" -> 1256 [label=0.000]
	1257 [color=aquamarine shape=rarrow style=filled]
	"187 | [O+]Br" -> 1257 [label=0.000]
	1258 [color=aquamarine shape=rarrow style=filled]
	"187 | [O+]Br" -> 1258 [label=0.000]
	1259 [color=aquamarine shape=rarrow style=filled]
	"188 | [O+][Br+]C(Cl)(Cl)Cl" -> 1259 [label=0.000]
	1260 [color=aquamarine shape=rarrow style=filled]
	"188 | [O+][Br+]C(Cl)(Cl)Cl" -> 1260 [label=0.000]
	1261 [color=aquamarine shape=rarrow style=filled]
	"188 | [O+][Br+]C(Cl)(Cl)Cl" -> 1261 [label=0.000]
	1262 [color=aquamarine shape=rarrow style=filled]
	"188 | [O+][Br+]C(Cl)(Cl)Cl" -> 1262 [label=0.000]
	1263 [color=aquamarine shape=rarrow style=filled]
	"188 | [O+][Br+]C(Cl)(Cl)Cl" -> 1263 [label=0.000]
	1264 [color=aquamarine shape=rarrow style=filled]
	"188 | [O+][Br+]C(Cl)(Cl)Cl" -> 1264 [label=0.000]
	1265 [color=aquamarine shape=rarrow style=filled]
	"188 | [O+][Br+]C(Cl)(Cl)Cl" -> 1265 [label=0.000]
	1266 [color=aquamarine shape=rarrow style=filled]
	"188 | [O+][Br+]C(Cl)(Cl)Cl" -> 1266 [label=0.000]
	1267 [color=aquamarine shape=rarrow style=filled]
	"188 | [O+][Br+]C(Cl)(Cl)Cl" -> 1267 [label=0.000]
	1268 [color=aquamarine shape=rarrow style=filled]
	"188 | [O+][Br+]C(Cl)(Cl)Cl" -> 1268 [label=0.000]
	1269 [color=aquamarine shape=rarrow style=filled]
	"189 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" -> 1269 [label=0.000]
	1270 [color=aquamarine shape=rarrow style=filled]
	"189 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" -> 1270 [label=0.000]
	1271 [color=aquamarine shape=rarrow style=filled]
	"189 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" -> 1271 [label=0.000]
	1272 [color=aquamarine shape=rarrow style=filled]
	"189 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" -> 1272 [label=0.000]
	1273 [color=aquamarine shape=rarrow style=filled]
	"189 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" -> 1273 [label=0.000]
	1274 [color=aquamarine shape=rarrow style=filled]
	"189 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" -> 1274 [label=0.000]
	1275 [color=aquamarine shape=rarrow style=filled]
	"189 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" -> 1275 [label=0.000]
	1276 [color=aquamarine shape=rarrow style=filled]
	"189 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" -> 1276 [label=0.000]
	1277 [color=aquamarine shape=rarrow style=filled]
	"189 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" -> 1277 [label=0.000]
	1278 [color=aquamarine shape=rarrow style=filled]
	"190 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=[O+]Br)cs1" -> 1278 [label=0.000]
	1279 [color=aquamarine shape=rarrow style=filled]
	"190 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=[O+]Br)cs1" -> 1279 [label=0.000]
	1280 [color=aquamarine shape=rarrow style=filled]
	"190 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=[O+]Br)cs1" -> 1280 [label=0.000]
	1281 [color=aquamarine shape=rarrow style=filled]
	"190 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=[O+]Br)cs1" -> 1281 [label=0.000]
	1282 [color=aquamarine shape=rarrow style=filled]
	"190 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=[O+]Br)cs1" -> 1282 [label=0.000]
	1283 [color=aquamarine shape=rarrow style=filled]
	"190 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=[O+]Br)cs1" -> 1283 [label=0.000]
	1284 [color=aquamarine shape=rarrow style=filled]
	"190 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=[O+]Br)cs1" -> 1284 [label=0.000]
	1285 [color=aquamarine shape=rarrow style=filled]
	"190 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=[O+]Br)cs1" -> 1285 [label=0.000]
	1286 [color=aquamarine shape=rarrow style=filled]
	"190 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=[O+]Br)cs1" -> 1286 [label=0.000]
	1287 [color=lightblue shape=rarrow style=filled]
	"191 | O=CCl" -> 1287 [label=0.000]
	1288 [color=aquamarine shape=rarrow style=filled]
	"191 | O=CCl" -> 1288 [label=0.000]
	1289 [color=lightblue shape=rarrow style=filled]
	"191 | O=CCl" -> 1289 [label=0.000]
	1290 [color=aquamarine shape=rarrow style=filled]
	"192 | [O+]Br" -> 1290 [label=0.000]
	1291 [color=aquamarine shape=rarrow style=filled]
	"192 | [O+]Br" -> 1291 [label=0.000]
	1292 [color=aquamarine shape=rarrow style=filled]
	"192 | [O+]Br" -> 1292 [label=0.000]
	1293 [color=aquamarine shape=rarrow style=filled]
	"193 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S](Cl)C=O)cs1" -> 1293 [label=0.000]
	1294 [color=aquamarine shape=rarrow style=filled]
	"193 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S](Cl)C=O)cs1" -> 1294 [label=0.000]
	1295 [color=aquamarine shape=rarrow style=filled]
	"193 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S](Cl)C=O)cs1" -> 1295 [label=0.000]
	1296 [color=aquamarine shape=rarrow style=filled]
	"193 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S](Cl)C=O)cs1" -> 1296 [label=0.000]
	1297 [color=aquamarine shape=rarrow style=filled]
	"193 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S](Cl)C=O)cs1" -> 1297 [label=0.000]
	1298 [color=aquamarine shape=rarrow style=filled]
	"193 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S](Cl)C=O)cs1" -> 1298 [label=0.000]
	1299 [color=aquamarine shape=rarrow style=filled]
	"193 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S](Cl)C=O)cs1" -> 1299 [label=0.000]
	1300 [color=aquamarine shape=rarrow style=filled]
	"193 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S](Cl)C=O)cs1" -> 1300 [label=0.000]
	1301 [color=aquamarine shape=rarrow style=filled]
	"193 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S](Cl)C=O)cs1" -> 1301 [label=0.000]
	1302 [color=aquamarine shape=rarrow style=filled]
	"194 | CC(=O)Br" -> 1302 [label=0.000]
	1303 [color=aquamarine shape=rarrow style=filled]
	"194 | CC(=O)Br" -> 1303 [label=0.000]
	1304 [color=lightblue shape=rarrow style=filled]
	"194 | CC(=O)Br" -> 1304 [label=0.000]
	1305 [color=aquamarine shape=rarrow style=filled]
	"194 | CC(=O)Br" -> 1305 [label=0.000]
	1306 [color=lightblue shape=rarrow style=filled]
	"194 | CC(=O)Br" -> 1306 [label=0.000]
	1307 [color=lightblue shape=rarrow style=filled]
	"194 | CC(=O)Br" -> 1307 [label=0.000]
	1308 [color=lightblue shape=rarrow style=filled]
	"194 | CC(=O)Br" -> 1308 [label=0.000]
	1309 [color=lightblue shape=rarrow style=filled]
	"194 | CC(=O)Br" -> 1309 [label=0.000]
	1310 [color=lightblue shape=rarrow style=filled]
	"194 | CC(=O)Br" -> 1310 [label=0.000]
	1311 [color=aquamarine shape=rarrow style=filled]
	"194 | CC(=O)Br" -> 1311 [label=0.000]
	1312 [color=aquamarine shape=rarrow style=filled]
	"196 | O=CC(=O)Br" -> 1312 [label=0.000]
	1313 [color=aquamarine shape=rarrow style=filled]
	"196 | O=CC(=O)Br" -> 1313 [label=0.000]
	1314 [color=aquamarine shape=rarrow style=filled]
	"196 | O=CC(=O)Br" -> 1314 [label=0.000]
	1315 [color=lightblue shape=rarrow style=filled]
	"196 | O=CC(=O)Br" -> 1315 [label=0.000]
	1316 [color=aquamarine shape=rarrow style=filled]
	"196 | O=CC(=O)Br" -> 1316 [label=0.000]
	1317 [color=aquamarine shape=rarrow style=filled]
	"196 | O=CC(=O)Br" -> 1317 [label=0.000]
	1318 [color=lightblue shape=rarrow style=filled]
	"196 | O=CC(=O)Br" -> 1318 [label=0.000]
	1319 [color=aquamarine shape=rarrow style=filled]
	"196 | O=CC(=O)Br" -> 1319 [label=0.000]
	1320 [color=aquamarine shape=rarrow style=filled]
	"196 | O=CC(=O)Br" -> 1320 [label=0.000]
	1321 [color=lightblue shape=rarrow style=filled]
	"196 | O=CC(=O)Br" -> 1321 [label=0.000]
	1322 [color=lightblue shape=rarrow style=filled]
	"197 | O=C(O)CCl" -> 1322 [label=0.000]
	1323 [color=lightblue shape=rarrow style=filled]
	"197 | O=C(O)CCl" -> 1323 [label=0.000]
	1324 [color=lightblue shape=rarrow style=filled]
	"197 | O=C(O)CCl" -> 1324 [label=0.000]
	1325 [color=lightblue shape=rarrow style=filled]
	"197 | O=C(O)CCl" -> 1325 [label=0.000]
	1326 [color=lightblue shape=rarrow style=filled]
	"197 | O=C(O)CCl" -> 1326 [label=0.000]
	1327 [color=lightblue shape=rarrow style=filled]
	"197 | O=C(O)CCl" -> 1327 [label=0.000]
	1328 [color=aquamarine shape=rarrow style=filled]
	"197 | O=C(O)CCl" -> 1328 [label=0.000]
	1329 [color=lightblue shape=rarrow style=filled]
	"197 | O=C(O)CCl" -> 1329 [label=0.000]
	1330 [color=aquamarine shape=rarrow style=filled]
	"197 | O=C(O)CCl" -> 1330 [label=0.000]
	1331 [color=aquamarine shape=rarrow style=filled]
	"198 | O=C(Br)CCl" -> 1331 [label=0.000]
	1332 [color=lightblue shape=rarrow style=filled]
	"198 | O=C(Br)CCl" -> 1332 [label=0.000]
	1333 [color=aquamarine shape=rarrow style=filled]
	"198 | O=C(Br)CCl" -> 1333 [label=0.000]
	1334 [color=aquamarine shape=rarrow style=filled]
	"198 | O=C(Br)CCl" -> 1334 [label=0.000]
	1335 [color=aquamarine shape=rarrow style=filled]
	"198 | O=C(Br)CCl" -> 1335 [label=0.000]
	1336 [color=aquamarine shape=rarrow style=filled]
	"198 | O=C(Br)CCl" -> 1336 [label=0.000]
	1337 [color=aquamarine shape=rarrow style=filled]
	"198 | O=C(Br)CCl" -> 1337 [label=0.000]
	1338 [color=aquamarine shape=rarrow style=filled]
	"198 | O=C(Br)CCl" -> 1338 [label=0.000]
	1339 [color=aquamarine shape=rarrow style=filled]
	"198 | O=C(Br)CCl" -> 1339 [label=0.000]
	1340 [color=aquamarine shape=rarrow style=filled]
	"198 | O=C(Br)CCl" -> 1340 [label=0.000]
	1341 [color=lightblue shape=rarrow style=filled]
	"199 | O=C(O)CCl" -> 1341 [label=0.000]
	1342 [color=lightblue shape=rarrow style=filled]
	"199 | O=C(O)CCl" -> 1342 [label=0.000]
	1343 [color=lightblue shape=rarrow style=filled]
	"199 | O=C(O)CCl" -> 1343 [label=0.000]
	1344 [color=lightblue shape=rarrow style=filled]
	"199 | O=C(O)CCl" -> 1344 [label=0.000]
	1345 [color=lightblue shape=rarrow style=filled]
	"199 | O=C(O)CCl" -> 1345 [label=0.000]
	1346 [color=lightblue shape=rarrow style=filled]
	"199 | O=C(O)CCl" -> 1346 [label=0.000]
	1347 [color=aquamarine shape=rarrow style=filled]
	"199 | O=C(O)CCl" -> 1347 [label=0.000]
	1348 [color=lightblue shape=rarrow style=filled]
	"199 | O=C(O)CCl" -> 1348 [label=0.000]
	1349 [color=aquamarine shape=rarrow style=filled]
	"199 | O=C(O)CCl" -> 1349 [label=0.000]
	1350 [color=aquamarine shape=rarrow style=filled]
	"200 | CC(=O)Br" -> 1350 [label=0.000]
	1351 [color=aquamarine shape=rarrow style=filled]
	"200 | CC(=O)Br" -> 1351 [label=0.000]
	1352 [color=lightblue shape=rarrow style=filled]
	"200 | CC(=O)Br" -> 1352 [label=0.000]
	1353 [color=aquamarine shape=rarrow style=filled]
	"200 | CC(=O)Br" -> 1353 [label=0.000]
	1354 [color=lightblue shape=rarrow style=filled]
	"200 | CC(=O)Br" -> 1354 [label=0.000]
	1355 [color=lightblue shape=rarrow style=filled]
	"200 | CC(=O)Br" -> 1355 [label=0.000]
	1356 [color=lightblue shape=rarrow style=filled]
	"200 | CC(=O)Br" -> 1356 [label=0.000]
	1357 [color=lightblue shape=rarrow style=filled]
	"200 | CC(=O)Br" -> 1357 [label=0.000]
	1358 [color=lightblue shape=rarrow style=filled]
	"200 | CC(=O)Br" -> 1358 [label=0.000]
	1359 [color=aquamarine shape=rarrow style=filled]
	"200 | CC(=O)Br" -> 1359 [label=0.000]
	1360 [color=lightblue shape=rarrow style=filled]
	"201 | O=C(O)C(=O)Cl" -> 1360 [label=0.000]
	1361 [color=lightblue shape=rarrow style=filled]
	"201 | O=C(O)C(=O)Cl" -> 1361 [label=0.000]
	1362 [color=aquamarine shape=rarrow style=filled]
	"201 | O=C(O)C(=O)Cl" -> 1362 [label=0.000]
	1363 [color=aquamarine shape=rarrow style=filled]
	"201 | O=C(O)C(=O)Cl" -> 1363 [label=0.000]
	1364 [color=lightblue shape=rarrow style=filled]
	"201 | O=C(O)C(=O)Cl" -> 1364 [label=0.000]
	1365 [color=lightblue shape=rarrow style=filled]
	"203 | O=C(O)CCl" -> 1365 [label=0.000]
	1366 [color=lightblue shape=rarrow style=filled]
	"203 | O=C(O)CCl" -> 1366 [label=0.000]
	1367 [color=lightblue shape=rarrow style=filled]
	"203 | O=C(O)CCl" -> 1367 [label=0.000]
	1368 [color=lightblue shape=rarrow style=filled]
	"203 | O=C(O)CCl" -> 1368 [label=0.000]
	1369 [color=lightblue shape=rarrow style=filled]
	"203 | O=C(O)CCl" -> 1369 [label=0.000]
	1370 [color=lightblue shape=rarrow style=filled]
	"203 | O=C(O)CCl" -> 1370 [label=0.000]
	1371 [color=aquamarine shape=rarrow style=filled]
	"203 | O=C(O)CCl" -> 1371 [label=0.000]
	1372 [color=lightblue shape=rarrow style=filled]
	"203 | O=C(O)CCl" -> 1372 [label=0.000]
	1373 [color=aquamarine shape=rarrow style=filled]
	"203 | O=C(O)CCl" -> 1373 [label=0.000]
	1374 [color=aquamarine shape=rarrow style=filled]
	"204 | O=CC(=O)Br" -> 1374 [label=0.000]
	1375 [color=aquamarine shape=rarrow style=filled]
	"204 | O=CC(=O)Br" -> 1375 [label=0.000]
	1376 [color=aquamarine shape=rarrow style=filled]
	"204 | O=CC(=O)Br" -> 1376 [label=0.000]
	1377 [color=lightblue shape=rarrow style=filled]
	"204 | O=CC(=O)Br" -> 1377 [label=0.000]
	1378 [color=aquamarine shape=rarrow style=filled]
	"204 | O=CC(=O)Br" -> 1378 [label=0.000]
	1379 [color=aquamarine shape=rarrow style=filled]
	"204 | O=CC(=O)Br" -> 1379 [label=0.000]
	1380 [color=lightblue shape=rarrow style=filled]
	"204 | O=CC(=O)Br" -> 1380 [label=0.000]
	1381 [color=aquamarine shape=rarrow style=filled]
	"204 | O=CC(=O)Br" -> 1381 [label=0.000]
	1382 [color=aquamarine shape=rarrow style=filled]
	"204 | O=CC(=O)Br" -> 1382 [label=0.000]
	1383 [color=lightblue shape=rarrow style=filled]
	"204 | O=CC(=O)Br" -> 1383 [label=0.000]
	1384 [color=aquamarine shape=rarrow style=filled]
	"206 | O=CC(=O)Br" -> 1384 [label=0.000]
	1385 [color=aquamarine shape=rarrow style=filled]
	"206 | O=CC(=O)Br" -> 1385 [label=0.000]
	1386 [color=aquamarine shape=rarrow style=filled]
	"206 | O=CC(=O)Br" -> 1386 [label=0.000]
	1387 [color=lightblue shape=rarrow style=filled]
	"206 | O=CC(=O)Br" -> 1387 [label=0.000]
	1388 [color=aquamarine shape=rarrow style=filled]
	"206 | O=CC(=O)Br" -> 1388 [label=0.000]
	1389 [color=aquamarine shape=rarrow style=filled]
	"206 | O=CC(=O)Br" -> 1389 [label=0.000]
	1390 [color=lightblue shape=rarrow style=filled]
	"206 | O=CC(=O)Br" -> 1390 [label=0.000]
	1391 [color=aquamarine shape=rarrow style=filled]
	"206 | O=CC(=O)Br" -> 1391 [label=0.000]
	1392 [color=aquamarine shape=rarrow style=filled]
	"206 | O=CC(=O)Br" -> 1392 [label=0.000]
	1393 [color=lightblue shape=rarrow style=filled]
	"206 | O=CC(=O)Br" -> 1393 [label=0.000]
	1394 [color=lightblue shape=rarrow style=filled]
	"207 | O=C(O)C(=O)Cl" -> 1394 [label=0.000]
	1395 [color=lightblue shape=rarrow style=filled]
	"207 | O=C(O)C(=O)Cl" -> 1395 [label=0.000]
	1396 [color=aquamarine shape=rarrow style=filled]
	"207 | O=C(O)C(=O)Cl" -> 1396 [label=0.000]
	1397 [color=aquamarine shape=rarrow style=filled]
	"207 | O=C(O)C(=O)Cl" -> 1397 [label=0.000]
	1398 [color=lightblue shape=rarrow style=filled]
	"207 | O=C(O)C(=O)Cl" -> 1398 [label=0.000]
	1399 [color=aquamarine shape=rarrow style=filled]
	"208 | O=C(O)C=C(Cl)C(=O)[O+]=[O+]O" -> 1399 [label=0.000]
	1400 [color=aquamarine shape=rarrow style=filled]
	"208 | O=C(O)C=C(Cl)C(=O)[O+]=[O+]O" -> 1400 [label=0.000]
	1401 [color=aquamarine shape=rarrow style=filled]
	"208 | O=C(O)C=C(Cl)C(=O)[O+]=[O+]O" -> 1401 [label=0.000]
	1402 [color=aquamarine shape=rarrow style=filled]
	"210 | Br[Cl+]Br" -> 1402 [label=0.000]
	1403 [color=aquamarine shape=rarrow style=filled]
	"211 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1403 [label=0.000]
	1404 [color=aquamarine shape=rarrow style=filled]
	"211 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1404 [label=0.000]
	1405 [color=aquamarine shape=rarrow style=filled]
	"211 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1405 [label=0.000]
	1406 [color=aquamarine shape=rarrow style=filled]
	"211 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1406 [label=0.000]
	1407 [color=aquamarine shape=rarrow style=filled]
	"211 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1407 [label=0.000]
	1408 [color=aquamarine shape=rarrow style=filled]
	"211 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1408 [label=0.000]
	1409 [color=aquamarine shape=rarrow style=filled]
	"211 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1409 [label=0.000]
	1410 [color=aquamarine shape=rarrow style=filled]
	"211 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1410 [label=0.000]
	1411 [color=aquamarine shape=rarrow style=filled]
	"211 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1411 [label=0.000]
	1412 [color=aquamarine shape=rarrow style=filled]
	"211 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1412 [label=0.000]
	1413 [color=aquamarine shape=rarrow style=filled]
	"213 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 1413 [label=0.000]
	1414 [color=aquamarine shape=rarrow style=filled]
	"213 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 1414 [label=0.000]
	1415 [color=aquamarine shape=rarrow style=filled]
	"213 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 1415 [label=0.000]
	1416 [color=aquamarine shape=rarrow style=filled]
	"213 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 1416 [label=0.000]
	1417 [color=aquamarine shape=rarrow style=filled]
	"213 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 1417 [label=0.000]
	1418 [color=aquamarine shape=rarrow style=filled]
	"213 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 1418 [label=0.000]
	1419 [color=aquamarine shape=rarrow style=filled]
	"213 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 1419 [label=0.000]
	1420 [color=aquamarine shape=rarrow style=filled]
	"213 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 1420 [label=0.000]
	1421 [color=aquamarine shape=rarrow style=filled]
	"213 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 1421 [label=0.000]
	1422 [color=lightblue shape=rarrow style=filled]
	"213 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" -> 1422 [label=0.000]
	1423 [color=aquamarine shape=rarrow style=filled]
	"214 | NC1C(=O)N[C@@H]1S(=O)C(=O)C(C(=O)Br)=C(Cl)C(=O)O" -> 1423 [label=0.000]
	1424 [color=aquamarine shape=rarrow style=filled]
	"214 | NC1C(=O)N[C@@H]1S(=O)C(=O)C(C(=O)Br)=C(Cl)C(=O)O" -> 1424 [label=0.000]
	1425 [color=aquamarine shape=rarrow style=filled]
	"214 | NC1C(=O)N[C@@H]1S(=O)C(=O)C(C(=O)Br)=C(Cl)C(=O)O" -> 1425 [label=0.000]
	1426 [color=aquamarine shape=rarrow style=filled]
	"214 | NC1C(=O)N[C@@H]1S(=O)C(=O)C(C(=O)Br)=C(Cl)C(=O)O" -> 1426 [label=0.000]
	1427 [color=aquamarine shape=rarrow style=filled]
	"214 | NC1C(=O)N[C@@H]1S(=O)C(=O)C(C(=O)Br)=C(Cl)C(=O)O" -> 1427 [label=0.000]
	1428 [color=lightblue shape=rarrow style=filled]
	"215 | O=C(O)CCl" -> 1428 [label=0.000]
	1429 [color=lightblue shape=rarrow style=filled]
	"215 | O=C(O)CCl" -> 1429 [label=0.000]
	1430 [color=lightblue shape=rarrow style=filled]
	"215 | O=C(O)CCl" -> 1430 [label=0.000]
	1431 [color=lightblue shape=rarrow style=filled]
	"215 | O=C(O)CCl" -> 1431 [label=0.000]
	1432 [color=lightblue shape=rarrow style=filled]
	"215 | O=C(O)CCl" -> 1432 [label=0.000]
	1433 [color=lightblue shape=rarrow style=filled]
	"215 | O=C(O)CCl" -> 1433 [label=0.000]
	1434 [color=aquamarine shape=rarrow style=filled]
	"215 | O=C(O)CCl" -> 1434 [label=0.000]
	1435 [color=lightblue shape=rarrow style=filled]
	"215 | O=C(O)CCl" -> 1435 [label=0.000]
	1436 [color=aquamarine shape=rarrow style=filled]
	"215 | O=C(O)CCl" -> 1436 [label=0.000]
	1437 [color=aquamarine shape=rarrow style=filled]
	"216 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(=O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1437 [label=0.000]
	1438 [color=aquamarine shape=rarrow style=filled]
	"216 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(=O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1438 [label=0.000]
	1439 [color=aquamarine shape=rarrow style=filled]
	"216 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(=O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1439 [label=0.000]
	1440 [color=aquamarine shape=rarrow style=filled]
	"216 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(=O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1440 [label=0.000]
	1441 [color=aquamarine shape=rarrow style=filled]
	"216 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(=O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1441 [label=0.000]
	1442 [color=aquamarine shape=rarrow style=filled]
	"216 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(=O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1442 [label=0.000]
	1443 [color=aquamarine shape=rarrow style=filled]
	"216 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(=O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1443 [label=0.000]
	1444 [color=aquamarine shape=rarrow style=filled]
	"216 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(=O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1444 [label=0.000]
	1445 [color=aquamarine shape=rarrow style=filled]
	"216 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(=O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1445 [label=0.000]
	1446 [color=aquamarine shape=rarrow style=filled]
	"216 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(=O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1446 [label=0.000]
	1447 [color=aquamarine shape=rarrow style=filled]
	"217 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1447 [label=0.000]
	1448 [color=aquamarine shape=rarrow style=filled]
	"217 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1448 [label=0.000]
	1449 [color=aquamarine shape=rarrow style=filled]
	"217 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1449 [label=0.000]
	1450 [color=aquamarine shape=rarrow style=filled]
	"217 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1450 [label=0.000]
	1451 [color=aquamarine shape=rarrow style=filled]
	"217 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1451 [label=0.000]
	1452 [color=aquamarine shape=rarrow style=filled]
	"217 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1452 [label=0.000]
	1453 [color=aquamarine shape=rarrow style=filled]
	"217 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1453 [label=0.000]
	1454 [color=aquamarine shape=rarrow style=filled]
	"217 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1454 [label=0.000]
	1455 [color=aquamarine shape=rarrow style=filled]
	"217 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1455 [label=0.000]
	1456 [color=aquamarine shape=rarrow style=filled]
	"217 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1456 [label=0.000]
	1457 [color=lightblue shape=rarrow style=filled]
	"218 | O=C(O)C(=O)Cl" -> 1457 [label=0.000]
	1458 [color=lightblue shape=rarrow style=filled]
	"218 | O=C(O)C(=O)Cl" -> 1458 [label=0.000]
	1459 [color=aquamarine shape=rarrow style=filled]
	"218 | O=C(O)C(=O)Cl" -> 1459 [label=0.000]
	1460 [color=aquamarine shape=rarrow style=filled]
	"218 | O=C(O)C(=O)Cl" -> 1460 [label=0.000]
	1461 [color=lightblue shape=rarrow style=filled]
	"218 | O=C(O)C(=O)Cl" -> 1461 [label=0.000]
	1462 [color=lightblue shape=rarrow style=filled]
	"219 | CC(=O)C(C)(C=O)OC(=O)Cl" -> 1462 [label=0.000]
	1463 [color=aquamarine shape=rarrow style=filled]
	"219 | CC(=O)C(C)(C=O)OC(=O)Cl" -> 1463 [label=0.000]
	1464 [color=aquamarine shape=rarrow style=filled]
	"219 | CC(=O)C(C)(C=O)OC(=O)Cl" -> 1464 [label=0.000]
	1465 [color=aquamarine shape=rarrow style=filled]
	"219 | CC(=O)C(C)(C=O)OC(=O)Cl" -> 1465 [label=0.000]
	1466 [color=aquamarine shape=rarrow style=filled]
	"219 | CC(=O)C(C)(C=O)OC(=O)Cl" -> 1466 [label=0.000]
	1467 [color=aquamarine shape=rarrow style=filled]
	"219 | CC(=O)C(C)(C=O)OC(=O)Cl" -> 1467 [label=0.000]
	1468 [color=aquamarine shape=rarrow style=filled]
	"219 | CC(=O)C(C)(C=O)OC(=O)Cl" -> 1468 [label=0.000]
	1469 [color=aquamarine shape=rarrow style=filled]
	"219 | CC(=O)C(C)(C=O)OC(=O)Cl" -> 1469 [label=0.000]
	1470 [color=aquamarine shape=rarrow style=filled]
	"219 | CC(=O)C(C)(C=O)OC(=O)Cl" -> 1470 [label=0.000]
	1471 [color=aquamarine shape=rarrow style=filled]
	"219 | CC(=O)C(C)(C=O)OC(=O)Cl" -> 1471 [label=0.000]
	1472 [color=lightblue shape=rarrow style=filled]
	"220 | O=C(O)CCl" -> 1472 [label=0.000]
	1473 [color=lightblue shape=rarrow style=filled]
	"220 | O=C(O)CCl" -> 1473 [label=0.000]
	1474 [color=lightblue shape=rarrow style=filled]
	"220 | O=C(O)CCl" -> 1474 [label=0.000]
	1475 [color=lightblue shape=rarrow style=filled]
	"220 | O=C(O)CCl" -> 1475 [label=0.000]
	1476 [color=lightblue shape=rarrow style=filled]
	"220 | O=C(O)CCl" -> 1476 [label=0.000]
	1477 [color=lightblue shape=rarrow style=filled]
	"220 | O=C(O)CCl" -> 1477 [label=0.000]
	1478 [color=aquamarine shape=rarrow style=filled]
	"220 | O=C(O)CCl" -> 1478 [label=0.000]
	1479 [color=lightblue shape=rarrow style=filled]
	"220 | O=C(O)CCl" -> 1479 [label=0.000]
	1480 [color=aquamarine shape=rarrow style=filled]
	"220 | O=C(O)CCl" -> 1480 [label=0.000]
	1481 [color=aquamarine shape=rarrow style=filled]
	"221 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1481 [label=0.000]
	1482 [color=aquamarine shape=rarrow style=filled]
	"221 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1482 [label=0.000]
	1483 [color=aquamarine shape=rarrow style=filled]
	"221 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1483 [label=0.000]
	1484 [color=aquamarine shape=rarrow style=filled]
	"221 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1484 [label=0.000]
	1485 [color=aquamarine shape=rarrow style=filled]
	"221 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1485 [label=0.000]
	1486 [color=aquamarine shape=rarrow style=filled]
	"221 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1486 [label=0.000]
	1487 [color=aquamarine shape=rarrow style=filled]
	"221 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1487 [label=0.000]
	1488 [color=aquamarine shape=rarrow style=filled]
	"221 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1488 [label=0.000]
	1489 [color=aquamarine shape=rarrow style=filled]
	"221 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1489 [label=0.000]
	1490 [color=aquamarine shape=rarrow style=filled]
	"221 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1490 [label=0.000]
	1491 [color=lightblue shape=rarrow style=filled]
	"222 | CC(=O)C(C)(C=O)OC(=O)Cl" -> 1491 [label=0.000]
	1492 [color=aquamarine shape=rarrow style=filled]
	"222 | CC(=O)C(C)(C=O)OC(=O)Cl" -> 1492 [label=0.000]
	1493 [color=aquamarine shape=rarrow style=filled]
	"222 | CC(=O)C(C)(C=O)OC(=O)Cl" -> 1493 [label=0.000]
	1494 [color=aquamarine shape=rarrow style=filled]
	"222 | CC(=O)C(C)(C=O)OC(=O)Cl" -> 1494 [label=0.000]
	1495 [color=aquamarine shape=rarrow style=filled]
	"222 | CC(=O)C(C)(C=O)OC(=O)Cl" -> 1495 [label=0.000]
	1496 [color=aquamarine shape=rarrow style=filled]
	"222 | CC(=O)C(C)(C=O)OC(=O)Cl" -> 1496 [label=0.000]
	1497 [color=aquamarine shape=rarrow style=filled]
	"222 | CC(=O)C(C)(C=O)OC(=O)Cl" -> 1497 [label=0.000]
	1498 [color=aquamarine shape=rarrow style=filled]
	"222 | CC(=O)C(C)(C=O)OC(=O)Cl" -> 1498 [label=0.000]
	1499 [color=aquamarine shape=rarrow style=filled]
	"222 | CC(=O)C(C)(C=O)OC(=O)Cl" -> 1499 [label=0.000]
	1500 [color=aquamarine shape=rarrow style=filled]
	"222 | CC(=O)C(C)(C=O)OC(=O)Cl" -> 1500 [label=0.000]
	1501 [color=aquamarine shape=rarrow style=filled]
	"223 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)C(C(=O)Br)=C(Cl)C(=O)O)cs1" -> 1501 [label=0.000]
	1502 [color=aquamarine shape=rarrow style=filled]
	"223 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)C(C(=O)Br)=C(Cl)C(=O)O)cs1" -> 1502 [label=0.000]
	1503 [color=aquamarine shape=rarrow style=filled]
	"223 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)C(C(=O)Br)=C(Cl)C(=O)O)cs1" -> 1503 [label=0.000]
	1504 [color=aquamarine shape=rarrow style=filled]
	"223 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)C(C(=O)Br)=C(Cl)C(=O)O)cs1" -> 1504 [label=0.000]
	1505 [color=aquamarine shape=rarrow style=filled]
	"223 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)C(C(=O)Br)=C(Cl)C(=O)O)cs1" -> 1505 [label=0.000]
	1506 [color=aquamarine shape=rarrow style=filled]
	"223 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)C(C(=O)Br)=C(Cl)C(=O)O)cs1" -> 1506 [label=0.000]
	1507 [color=aquamarine shape=rarrow style=filled]
	"223 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)C(C(=O)Br)=C(Cl)C(=O)O)cs1" -> 1507 [label=0.000]
	1508 [color=aquamarine shape=rarrow style=filled]
	"224 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1508 [label=0.000]
	1509 [color=aquamarine shape=rarrow style=filled]
	"224 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1509 [label=0.000]
	1510 [color=aquamarine shape=rarrow style=filled]
	"224 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1510 [label=0.000]
	1511 [color=aquamarine shape=rarrow style=filled]
	"224 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1511 [label=0.000]
	1512 [color=aquamarine shape=rarrow style=filled]
	"224 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1512 [label=0.000]
	1513 [color=aquamarine shape=rarrow style=filled]
	"224 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1513 [label=0.000]
	1514 [color=aquamarine shape=rarrow style=filled]
	"224 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1514 [label=0.000]
	1515 [color=aquamarine shape=rarrow style=filled]
	"224 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1515 [label=0.000]
	1516 [color=aquamarine shape=rarrow style=filled]
	"224 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1516 [label=0.000]
	1517 [color=aquamarine shape=rarrow style=filled]
	"224 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1517 [label=0.000]
	1518 [color=aquamarine shape=rarrow style=filled]
	"226 | [NH]c1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=[O+])C(=O)[C]C(=O)Br)cs1" -> 1518 [label=0.000]
	1519 [color=aquamarine shape=rarrow style=filled]
	"226 | [NH]c1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=[O+])C(=O)[C]C(=O)Br)cs1" -> 1519 [label=0.000]
	1520 [color=aquamarine shape=rarrow style=filled]
	"226 | [NH]c1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=[O+])C(=O)[C]C(=O)Br)cs1" -> 1520 [label=0.000]
	1521 [color=aquamarine shape=rarrow style=filled]
	"226 | [NH]c1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=[O+])C(=O)[C]C(=O)Br)cs1" -> 1521 [label=0.000]
	1522 [color=aquamarine shape=rarrow style=filled]
	"226 | [NH]c1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=[O+])C(=O)[C]C(=O)Br)cs1" -> 1522 [label=0.000]
	1523 [color=aquamarine shape=rarrow style=filled]
	"226 | [NH]c1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=[O+])C(=O)[C]C(=O)Br)cs1" -> 1523 [label=0.000]
	1524 [color=aquamarine shape=rarrow style=filled]
	"226 | [NH]c1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=[O+])C(=O)[C]C(=O)Br)cs1" -> 1524 [label=0.000]
	1525 [color=aquamarine shape=rarrow style=filled]
	"226 | [NH]c1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=[O+])C(=O)[C]C(=O)Br)cs1" -> 1525 [label=0.000]
	1526 [color=aquamarine shape=rarrow style=filled]
	"226 | [NH]c1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=[O+])C(=O)[C]C(=O)Br)cs1" -> 1526 [label=0.000]
	1527 [color=aquamarine shape=rarrow style=filled]
	"226 | [NH]c1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=[O+])C(=O)[C]C(=O)Br)cs1" -> 1527 [label=0.000]
	1528 [color=lightblue shape=rarrow style=filled]
	"227 | O=C(O)[C]Cl" -> 1528 [label=0.000]
	1529 [color=lightblue shape=rarrow style=filled]
	"227 | O=C(O)[C]Cl" -> 1529 [label=0.000]
	1530 [color=lightblue shape=rarrow style=filled]
	"227 | O=C(O)[C]Cl" -> 1530 [label=0.000]
	1531 [color=lightblue shape=rarrow style=filled]
	"227 | O=C(O)[C]Cl" -> 1531 [label=0.000]
	1532 [color=lightblue shape=rarrow style=filled]
	"227 | O=C(O)[C]Cl" -> 1532 [label=0.000]
	1533 [color=aquamarine shape=rarrow style=filled]
	"227 | O=C(O)[C]Cl" -> 1533 [label=0.000]
	1534 [color=lightblue shape=rarrow style=filled]
	"227 | O=C(O)[C]Cl" -> 1534 [label=0.000]
	1535 [color=lightblue shape=rarrow style=filled]
	"227 | O=C(O)[C]Cl" -> 1535 [label=0.000]
	1536 [color=aquamarine shape=rarrow style=filled]
	"227 | O=C(O)[C]Cl" -> 1536 [label=0.000]
	1537 [color=lightblue shape=rarrow style=filled]
	"227 | O=C(O)[C]Cl" -> 1537 [label=0.000]
	1538 [color=lightblue shape=rarrow style=filled]
	"228 | CC(=O)C(C)(C=O)O[C]=O" -> 1538 [label=0.000]
	1539 [color=aquamarine shape=rarrow style=filled]
	"228 | CC(=O)C(C)(C=O)O[C]=O" -> 1539 [label=0.000]
	1540 [color=aquamarine shape=rarrow style=filled]
	"228 | CC(=O)C(C)(C=O)O[C]=O" -> 1540 [label=0.000]
	1541 [color=aquamarine shape=rarrow style=filled]
	"228 | CC(=O)C(C)(C=O)O[C]=O" -> 1541 [label=0.000]
	1542 [color=lightblue shape=rarrow style=filled]
	"228 | CC(=O)C(C)(C=O)O[C]=O" -> 1542 [label=0.000]
	1543 [color=aquamarine shape=rarrow style=filled]
	"228 | CC(=O)C(C)(C=O)O[C]=O" -> 1543 [label=0.000]
	1544 [color=aquamarine shape=rarrow style=filled]
	"228 | CC(=O)C(C)(C=O)O[C]=O" -> 1544 [label=0.000]
	1545 [color=lightblue shape=rarrow style=filled]
	"228 | CC(=O)C(C)(C=O)O[C]=O" -> 1545 [label=0.000]
	1546 [color=lightblue shape=rarrow style=filled]
	"228 | CC(=O)C(C)(C=O)O[C]=O" -> 1546 [label=0.000]
	1547 [color=aquamarine shape=rarrow style=filled]
	"228 | CC(=O)C(C)(C=O)O[C]=O" -> 1547 [label=0.000]
	1548 [color=lightblue shape=rarrow style=filled]
	"229 | O=C(O)CCl" -> 1548 [label=0.000]
	1549 [color=lightblue shape=rarrow style=filled]
	"229 | O=C(O)CCl" -> 1549 [label=0.000]
	1550 [color=lightblue shape=rarrow style=filled]
	"229 | O=C(O)CCl" -> 1550 [label=0.000]
	1551 [color=lightblue shape=rarrow style=filled]
	"229 | O=C(O)CCl" -> 1551 [label=0.000]
	1552 [color=lightblue shape=rarrow style=filled]
	"229 | O=C(O)CCl" -> 1552 [label=0.000]
	1553 [color=lightblue shape=rarrow style=filled]
	"229 | O=C(O)CCl" -> 1553 [label=0.000]
	1554 [color=aquamarine shape=rarrow style=filled]
	"229 | O=C(O)CCl" -> 1554 [label=0.000]
	1555 [color=lightblue shape=rarrow style=filled]
	"229 | O=C(O)CCl" -> 1555 [label=0.000]
	1556 [color=aquamarine shape=rarrow style=filled]
	"229 | O=C(O)CCl" -> 1556 [label=0.000]
	1557 [color=aquamarine shape=rarrow style=filled]
	"230 | CC(=O)C(C)(C=O)OC(=O)OC(=O)OC(C)(C)C" -> 1557 [label=0.000]
	1558 [color=aquamarine shape=rarrow style=filled]
	"230 | CC(=O)C(C)(C=O)OC(=O)OC(=O)OC(C)(C)C" -> 1558 [label=0.000]
	1559 [color=aquamarine shape=rarrow style=filled]
	"230 | CC(=O)C(C)(C=O)OC(=O)OC(=O)OC(C)(C)C" -> 1559 [label=0.000]
	1560 [color=aquamarine shape=rarrow style=filled]
	"230 | CC(=O)C(C)(C=O)OC(=O)OC(=O)OC(C)(C)C" -> 1560 [label=0.000]
	1561 [color=aquamarine shape=rarrow style=filled]
	"230 | CC(=O)C(C)(C=O)OC(=O)OC(=O)OC(C)(C)C" -> 1561 [label=0.000]
	1562 [color=aquamarine shape=rarrow style=filled]
	"230 | CC(=O)C(C)(C=O)OC(=O)OC(=O)OC(C)(C)C" -> 1562 [label=0.000]
	1563 [color=aquamarine shape=rarrow style=filled]
	"230 | CC(=O)C(C)(C=O)OC(=O)OC(=O)OC(C)(C)C" -> 1563 [label=0.000]
	1564 [color=aquamarine shape=rarrow style=filled]
	"230 | CC(=O)C(C)(C=O)OC(=O)OC(=O)OC(C)(C)C" -> 1564 [label=0.000]
	1565 [color=aquamarine shape=rarrow style=filled]
	"230 | CC(=O)C(C)(C=O)OC(=O)OC(=O)OC(C)(C)C" -> 1565 [label=0.000]
	1566 [color=aquamarine shape=rarrow style=filled]
	"230 | CC(=O)C(C)(C=O)OC(=O)OC(=O)OC(C)(C)C" -> 1566 [label=0.000]
	1567 [color=aquamarine shape=rarrow style=filled]
	"231 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1567 [label=0.000]
	1568 [color=aquamarine shape=rarrow style=filled]
	"231 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1568 [label=0.000]
	1569 [color=aquamarine shape=rarrow style=filled]
	"231 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1569 [label=0.000]
	1570 [color=aquamarine shape=rarrow style=filled]
	"231 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1570 [label=0.000]
	1571 [color=aquamarine shape=rarrow style=filled]
	"231 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1571 [label=0.000]
	1572 [color=aquamarine shape=rarrow style=filled]
	"231 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1572 [label=0.000]
	1573 [color=aquamarine shape=rarrow style=filled]
	"231 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1573 [label=0.000]
	1574 [color=aquamarine shape=rarrow style=filled]
	"231 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1574 [label=0.000]
	1575 [color=aquamarine shape=rarrow style=filled]
	"231 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1575 [label=0.000]
	1576 [color=aquamarine shape=rarrow style=filled]
	"231 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1576 [label=0.000]
	1577 [color=lightblue shape=rarrow style=filled]
	"232 | O=C(O)CCl" -> 1577 [label=0.000]
	1578 [color=lightblue shape=rarrow style=filled]
	"232 | O=C(O)CCl" -> 1578 [label=0.000]
	1579 [color=lightblue shape=rarrow style=filled]
	"232 | O=C(O)CCl" -> 1579 [label=0.000]
	1580 [color=lightblue shape=rarrow style=filled]
	"232 | O=C(O)CCl" -> 1580 [label=0.000]
	1581 [color=lightblue shape=rarrow style=filled]
	"232 | O=C(O)CCl" -> 1581 [label=0.000]
	1582 [color=lightblue shape=rarrow style=filled]
	"232 | O=C(O)CCl" -> 1582 [label=0.000]
	1583 [color=aquamarine shape=rarrow style=filled]
	"232 | O=C(O)CCl" -> 1583 [label=0.000]
	1584 [color=lightblue shape=rarrow style=filled]
	"232 | O=C(O)CCl" -> 1584 [label=0.000]
	1585 [color=aquamarine shape=rarrow style=filled]
	"232 | O=C(O)CCl" -> 1585 [label=0.000]
	1586 [color=lightblue shape=rarrow style=filled]
	"233 | CC(=O)C(C)(C=O)OC(=O)O" -> 1586 [label=0.000]
	1587 [color=aquamarine shape=rarrow style=filled]
	"233 | CC(=O)C(C)(C=O)OC(=O)O" -> 1587 [label=0.000]
	1588 [color=aquamarine shape=rarrow style=filled]
	"233 | CC(=O)C(C)(C=O)OC(=O)O" -> 1588 [label=0.000]
	1589 [color=aquamarine shape=rarrow style=filled]
	"233 | CC(=O)C(C)(C=O)OC(=O)O" -> 1589 [label=0.000]
	1590 [color=lightblue shape=rarrow style=filled]
	"233 | CC(=O)C(C)(C=O)OC(=O)O" -> 1590 [label=0.000]
	1591 [color=lightblue shape=rarrow style=filled]
	"233 | CC(=O)C(C)(C=O)OC(=O)O" -> 1591 [label=0.000]
	1592 [color=aquamarine shape=rarrow style=filled]
	"233 | CC(=O)C(C)(C=O)OC(=O)O" -> 1592 [label=0.000]
	1593 [color=aquamarine shape=rarrow style=filled]
	"233 | CC(=O)C(C)(C=O)OC(=O)O" -> 1593 [label=0.000]
	1594 [color=aquamarine shape=rarrow style=filled]
	"233 | CC(=O)C(C)(C=O)OC(=O)O" -> 1594 [label=0.000]
	1595 [color=lightblue shape=rarrow style=filled]
	"233 | CC(=O)C(C)(C=O)OC(=O)O" -> 1595 [label=0.000]
	1596 [color=aquamarine shape=rarrow style=filled]
	"234 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1596 [label=0.000]
	1597 [color=aquamarine shape=rarrow style=filled]
	"234 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1597 [label=0.000]
	1598 [color=aquamarine shape=rarrow style=filled]
	"234 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1598 [label=0.000]
	1599 [color=aquamarine shape=rarrow style=filled]
	"234 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1599 [label=0.000]
	1600 [color=aquamarine shape=rarrow style=filled]
	"234 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1600 [label=0.000]
	1601 [color=aquamarine shape=rarrow style=filled]
	"234 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1601 [label=0.000]
	1602 [color=aquamarine shape=rarrow style=filled]
	"234 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1602 [label=0.000]
	1603 [color=aquamarine shape=rarrow style=filled]
	"234 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1603 [label=0.000]
	1604 [color=aquamarine shape=rarrow style=filled]
	"234 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1604 [label=0.000]
	1605 [color=aquamarine shape=rarrow style=filled]
	"234 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" -> 1605 [label=0.000]
	1606 [color=aquamarine shape=rarrow style=filled]
	"236 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 1606 [label=0.000]
	1607 [color=aquamarine shape=rarrow style=filled]
	"236 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 1607 [label=0.000]
	1608 [color=aquamarine shape=rarrow style=filled]
	"236 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 1608 [label=0.000]
	1609 [color=aquamarine shape=rarrow style=filled]
	"236 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 1609 [label=0.000]
	1610 [color=aquamarine shape=rarrow style=filled]
	"236 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 1610 [label=0.000]
	1611 [color=aquamarine shape=rarrow style=filled]
	"236 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 1611 [label=0.000]
	1612 [color=aquamarine shape=rarrow style=filled]
	"236 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 1612 [label=0.000]
	1613 [color=aquamarine shape=rarrow style=filled]
	"236 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 1613 [label=0.000]
	1614 [color=aquamarine shape=rarrow style=filled]
	"236 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 1614 [label=0.000]
	1615 [color=aquamarine shape=rarrow style=filled]
	"236 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" -> 1615 [label=0.000]
	1616 [color=aquamarine shape=rarrow style=filled]
	"237 | NC1C(=O)N2C=C(CBr)CS[C@H]12" -> 1616 [label=0.000]
	1617 [color=aquamarine shape=rarrow style=filled]
	"237 | NC1C(=O)N2C=C(CBr)CS[C@H]12" -> 1617 [label=0.000]
	1618 [color=aquamarine shape=rarrow style=filled]
	"237 | NC1C(=O)N2C=C(CBr)CS[C@H]12" -> 1618 [label=0.000]
	1619 [color=aquamarine shape=rarrow style=filled]
	"237 | NC1C(=O)N2C=C(CBr)CS[C@H]12" -> 1619 [label=0.000]
	1620 [color=aquamarine shape=rarrow style=filled]
	"237 | NC1C(=O)N2C=C(CBr)CS[C@H]12" -> 1620 [label=0.000]
	1621 [color=aquamarine shape=rarrow style=filled]
	"237 | NC1C(=O)N2C=C(CBr)CS[C@H]12" -> 1621 [label=0.000]
	1622 [color=aquamarine shape=rarrow style=filled]
	"237 | NC1C(=O)N2C=C(CBr)CS[C@H]12" -> 1622 [label=0.000]
	1623 [color=aquamarine shape=rarrow style=filled]
	"237 | NC1C(=O)N2C=C(CBr)CS[C@H]12" -> 1623 [label=0.000]
	1624 [color=aquamarine shape=rarrow style=filled]
	"237 | NC1C(=O)N2C=C(CBr)CS[C@H]12" -> 1624 [label=0.000]
	1625 [color=aquamarine shape=rarrow style=filled]
	"237 | NC1C(=O)N2C=C(CBr)CS[C@H]12" -> 1625 [label=0.000]
	1626 [color=aquamarine shape=rarrow style=filled]
	"239 | NC1C(=O)N[C@@H]1SCC(=CC(=O)O)C(Br)Br" -> 1626 [label=0.000]
	1627 [color=aquamarine shape=rarrow style=filled]
	"239 | NC1C(=O)N[C@@H]1SCC(=CC(=O)O)C(Br)Br" -> 1627 [label=0.000]
	1628 [color=aquamarine shape=rarrow style=filled]
	"239 | NC1C(=O)N[C@@H]1SCC(=CC(=O)O)C(Br)Br" -> 1628 [label=0.000]
	1629 [color=aquamarine shape=rarrow style=filled]
	"239 | NC1C(=O)N[C@@H]1SCC(=CC(=O)O)C(Br)Br" -> 1629 [label=0.000]
	1630 [color=aquamarine shape=rarrow style=filled]
	"239 | NC1C(=O)N[C@@H]1SCC(=CC(=O)O)C(Br)Br" -> 1630 [label=0.000]
	1631 [color=aquamarine shape=rarrow style=filled]
	"239 | NC1C(=O)N[C@@H]1SCC(=CC(=O)O)C(Br)Br" -> 1631 [label=0.000]
	1632 [color=aquamarine shape=rarrow style=filled]
	"239 | NC1C(=O)N[C@@H]1SCC(=CC(=O)O)C(Br)Br" -> 1632 [label=0.000]
	1633 [color=aquamarine shape=rarrow style=filled]
	"239 | NC1C(=O)N[C@@H]1SCC(=CC(=O)O)C(Br)Br" -> 1633 [label=0.000]
	1634 [color=aquamarine shape=rarrow style=filled]
	"239 | NC1C(=O)N[C@@H]1SCC(=CC(=O)O)C(Br)Br" -> 1634 [label=0.000]
	1635 [color=aquamarine shape=rarrow style=filled]
	"239 | NC1C(=O)N[C@@H]1SCC(=CC(=O)O)C(Br)Br" -> 1635 [label=0.000]
	1636 [color=aquamarine shape=rarrow style=filled]
	"240 | NC(C(=O)O)[C@@H]1NC(C(=O)O)=C(CBr)CS1" -> 1636 [label=0.000]
	1637 [color=aquamarine shape=rarrow style=filled]
	"240 | NC(C(=O)O)[C@@H]1NC(C(=O)O)=C(CBr)CS1" -> 1637 [label=0.000]
	1638 [color=aquamarine shape=rarrow style=filled]
	"240 | NC(C(=O)O)[C@@H]1NC(C(=O)O)=C(CBr)CS1" -> 1638 [label=0.000]
	1639 [color=aquamarine shape=rarrow style=filled]
	"240 | NC(C(=O)O)[C@@H]1NC(C(=O)O)=C(CBr)CS1" -> 1639 [label=0.000]
	1640 [color=aquamarine shape=rarrow style=filled]
	"240 | NC(C(=O)O)[C@@H]1NC(C(=O)O)=C(CBr)CS1" -> 1640 [label=0.000]
	1641 [color=aquamarine shape=rarrow style=filled]
	"240 | NC(C(=O)O)[C@@H]1NC(C(=O)O)=C(CBr)CS1" -> 1641 [label=0.000]
	1642 [color=aquamarine shape=rarrow style=filled]
	"240 | NC(C(=O)O)[C@@H]1NC(C(=O)O)=C(CBr)CS1" -> 1642 [label=0.000]
	1643 [color=aquamarine shape=rarrow style=filled]
	"240 | NC(C(=O)O)[C@@H]1NC(C(=O)O)=C(CBr)CS1" -> 1643 [label=0.000]
	1644 [color=aquamarine shape=rarrow style=filled]
	"240 | NC(C(=O)O)[C@@H]1NC(C(=O)O)=C(CBr)CS1" -> 1644 [label=0.000]
	1645 [color=aquamarine shape=rarrow style=filled]
	"241 | NC1C(=O)N[C@@H]1SCC(CBr)=C(O)C(=O)O" -> 1645 [label=0.000]
	1646 [color=aquamarine shape=rarrow style=filled]
	"241 | NC1C(=O)N[C@@H]1SCC(CBr)=C(O)C(=O)O" -> 1646 [label=0.000]
	1647 [color=aquamarine shape=rarrow style=filled]
	"241 | NC1C(=O)N[C@@H]1SCC(CBr)=C(O)C(=O)O" -> 1647 [label=0.000]
	1648 [color=aquamarine shape=rarrow style=filled]
	"241 | NC1C(=O)N[C@@H]1SCC(CBr)=C(O)C(=O)O" -> 1648 [label=0.000]
	1649 [color=aquamarine shape=rarrow style=filled]
	"241 | NC1C(=O)N[C@@H]1SCC(CBr)=C(O)C(=O)O" -> 1649 [label=0.000]
	1650 [color=aquamarine shape=rarrow style=filled]
	"241 | NC1C(=O)N[C@@H]1SCC(CBr)=C(O)C(=O)O" -> 1650 [label=0.000]
	1651 [color=aquamarine shape=rarrow style=filled]
	"241 | NC1C(=O)N[C@@H]1SCC(CBr)=C(O)C(=O)O" -> 1651 [label=0.000]
	1652 [color=aquamarine shape=rarrow style=filled]
	"241 | NC1C(=O)N[C@@H]1SCC(CBr)=C(O)C(=O)O" -> 1652 [label=0.000]
	1653 [color=aquamarine shape=rarrow style=filled]
	"241 | NC1C(=O)N[C@@H]1SCC(CBr)=C(O)C(=O)O" -> 1653 [label=0.000]
	1654 [color=aquamarine shape=rarrow style=filled]
	"241 | NC1C(=O)N[C@@H]1SCC(CBr)=C(O)C(=O)O" -> 1654 [label=0.000]
	1655 [color=aquamarine shape=rarrow style=filled]
	"242 | NC1C(=O)N[C@@H]1SCC(CBr)=C(Cl)C(=O)O" -> 1655 [label=0.000]
	1656 [color=aquamarine shape=rarrow style=filled]
	"242 | NC1C(=O)N[C@@H]1SCC(CBr)=C(Cl)C(=O)O" -> 1656 [label=0.000]
	1657 [color=aquamarine shape=rarrow style=filled]
	"242 | NC1C(=O)N[C@@H]1SCC(CBr)=C(Cl)C(=O)O" -> 1657 [label=0.000]
	1658 [color=aquamarine shape=rarrow style=filled]
	"242 | NC1C(=O)N[C@@H]1SCC(CBr)=C(Cl)C(=O)O" -> 1658 [label=0.000]
	1659 [color=aquamarine shape=rarrow style=filled]
	"242 | NC1C(=O)N[C@@H]1SCC(CBr)=C(Cl)C(=O)O" -> 1659 [label=0.000]
	1660 [color=aquamarine shape=rarrow style=filled]
	"242 | NC1C(=O)N[C@@H]1SCC(CBr)=C(Cl)C(=O)O" -> 1660 [label=0.000]
	1661 [color=aquamarine shape=rarrow style=filled]
	"242 | NC1C(=O)N[C@@H]1SCC(CBr)=C(Cl)C(=O)O" -> 1661 [label=0.000]
	1662 [color=aquamarine shape=rarrow style=filled]
	"242 | NC1C(=O)N[C@@H]1SCC(CBr)=C(Cl)C(=O)O" -> 1662 [label=0.000]
	1663 [color=aquamarine shape=rarrow style=filled]
	"242 | NC1C(=O)N[C@@H]1SCC(CBr)=C(Cl)C(=O)O" -> 1663 [label=0.000]
	1664 [color=aquamarine shape=rarrow style=filled]
	"242 | NC1C(=O)N[C@@H]1SCC(CBr)=C(Cl)C(=O)O" -> 1664 [label=0.000]
	1665 [color=aquamarine shape=rarrow style=filled]
	"243 | NC1C(=O)N[C@@H]1SCC(CBr)C(=O)C(=O)O" -> 1665 [label=0.000]
	1666 [color=aquamarine shape=rarrow style=filled]
	"243 | NC1C(=O)N[C@@H]1SCC(CBr)C(=O)C(=O)O" -> 1666 [label=0.000]
	1667 [color=aquamarine shape=rarrow style=filled]
	"243 | NC1C(=O)N[C@@H]1SCC(CBr)C(=O)C(=O)O" -> 1667 [label=0.000]
	1668 [color=aquamarine shape=rarrow style=filled]
	"243 | NC1C(=O)N[C@@H]1SCC(CBr)C(=O)C(=O)O" -> 1668 [label=0.000]
	1669 [color=aquamarine shape=rarrow style=filled]
	"243 | NC1C(=O)N[C@@H]1SCC(CBr)C(=O)C(=O)O" -> 1669 [label=0.000]
	1670 [color=aquamarine shape=rarrow style=filled]
	"244 | NC1C(=O)N[C@@H]1SCC(CBr)CC(=O)O" -> 1670 [label=0.000]
	1671 [color=aquamarine shape=rarrow style=filled]
	"244 | NC1C(=O)N[C@@H]1SCC(CBr)CC(=O)O" -> 1671 [label=0.000]
	1672 [color=aquamarine shape=rarrow style=filled]
	"244 | NC1C(=O)N[C@@H]1SCC(CBr)CC(=O)O" -> 1672 [label=0.000]
	1673 [color=aquamarine shape=rarrow style=filled]
	"245 | NC1C(=O)N[C@@H]1SCCCBr" -> 1673 [label=0.000]
	1674 [color=aquamarine shape=rarrow style=filled]
	"245 | NC1C(=O)N[C@@H]1SCCCBr" -> 1674 [label=0.000]
	1675 [color=aquamarine shape=rarrow style=filled]
	"245 | NC1C(=O)N[C@@H]1SCCCBr" -> 1675 [label=0.000]
	1676 [color=aquamarine shape=rarrow style=filled]
	"249 | BrSBr" -> 1676 [label=0.000]
	1677 [color=lightblue shape=rarrow style=filled]
	"250 | Cc1nncs1" -> 1677 [label=0.000]
	1678 [color=aquamarine shape=rarrow style=filled]
	"250 | Cc1nncs1" -> 1678 [label=0.000]
	1679 [color=aquamarine shape=rarrow style=filled]
	"250 | Cc1nncs1" -> 1679 [label=0.000]
	1680 [color=aquamarine shape=rarrow style=filled]
	"250 | Cc1nncs1" -> 1680 [label=0.000]
	1681 [color=aquamarine shape=rarrow style=filled]
	"250 | Cc1nncs1" -> 1681 [label=0.000]
	1682 [color=aquamarine shape=rarrow style=filled]
	"250 | Cc1nncs1" -> 1682 [label=0.000]
	1683 [color=aquamarine shape=rarrow style=filled]
	"250 | Cc1nncs1" -> 1683 [label=0.000]
	1684 [color=aquamarine shape=rarrow style=filled]
	"250 | Cc1nncs1" -> 1684 [label=0.000]
	1685 [color=aquamarine shape=rarrow style=filled]
	"250 | Cc1nncs1" -> 1685 [label=0.000]
	1686 [color=aquamarine shape=rarrow style=filled]
	"252 | SBr" -> 1686 [label=0.000]
	1687 [color=aquamarine shape=rarrow style=filled]
	"253 | NN=C=[S]Br" -> 1687 [label=0.000]
	1688 [color=aquamarine shape=rarrow style=filled]
	"253 | NN=C=[S]Br" -> 1688 [label=0.000]
	1689 [color=aquamarine shape=rarrow style=filled]
	"253 | NN=C=[S]Br" -> 1689 [label=0.000]
	1690 [color=aquamarine shape=rarrow style=filled]
	"253 | NN=C=[S]Br" -> 1690 [label=0.000]
	1691 [color=aquamarine shape=rarrow style=filled]
	"253 | NN=C=[S]Br" -> 1691 [label=0.000]
	1692 [color=aquamarine shape=rarrow style=filled]
	"253 | NN=C=[S]Br" -> 1692 [label=0.000]
	1693 [color=aquamarine shape=rarrow style=filled]
	"253 | NN=C=[S]Br" -> 1693 [label=0.000]
	1694 [color=aquamarine shape=rarrow style=filled]
	"253 | NN=C=[S]Br" -> 1694 [label=0.000]
	1695 [color=aquamarine shape=rarrow style=filled]
	"253 | NN=C=[S]Br" -> 1695 [label=0.000]
	1696 [color=aquamarine shape=rarrow style=filled]
	"253 | NN=C=[S]Br" -> 1696 [label=0.000]
	1697 [color=aquamarine shape=rarrow style=filled]
	"254 | CC[SH](=O)=O" -> 1697 [label=0.000]
	1698 [color=lightblue shape=rarrow style=filled]
	"254 | CC[SH](=O)=O" -> 1698 [label=0.000]
	1699 [color=lightblue shape=rarrow style=filled]
	"254 | CC[SH](=O)=O" -> 1699 [label=0.000]
	1700 [color=lightblue shape=rarrow style=filled]
	"254 | CC[SH](=O)=O" -> 1700 [label=0.000]
	1701 [color=aquamarine shape=rarrow style=filled]
	"254 | CC[SH](=O)=O" -> 1701 [label=0.000]
	1702 [color=aquamarine shape=rarrow style=filled]
	"254 | CC[SH](=O)=O" -> 1702 [label=0.000]
	1703 [color=aquamarine shape=rarrow style=filled]
	"254 | CC[SH](=O)=O" -> 1703 [label=0.000]
	1704 [color=aquamarine shape=rarrow style=filled]
	"254 | CC[SH](=O)=O" -> 1704 [label=0.000]
	1705 [color=aquamarine shape=rarrow style=filled]
	"254 | CC[SH](=O)=O" -> 1705 [label=0.000]
	1706 [color=lightblue shape=rarrow style=filled]
	"254 | CC[SH](=O)=O" -> 1706 [label=0.000]
	1707 [color=aquamarine shape=rarrow style=filled]
	"256 | CC1=C(C(=O)O)N[C@@H](C(N)C(=O)O)SC1" -> 1707 [label=0.000]
	1708 [color=aquamarine shape=rarrow style=filled]
	"256 | CC1=C(C(=O)O)N[C@@H](C(N)C(=O)O)SC1" -> 1708 [label=0.000]
	1709 [color=aquamarine shape=rarrow style=filled]
	"256 | CC1=C(C(=O)O)N[C@@H](C(N)C(=O)O)SC1" -> 1709 [label=0.000]
	1710 [color=aquamarine shape=rarrow style=filled]
	"256 | CC1=C(C(=O)O)N[C@@H](C(N)C(=O)O)SC1" -> 1710 [label=0.000]
	1711 [color=aquamarine shape=rarrow style=filled]
	"256 | CC1=C(C(=O)O)N[C@@H](C(N)C(=O)O)SC1" -> 1711 [label=0.000]
	1712 [color=aquamarine shape=rarrow style=filled]
	"256 | CC1=C(C(=O)O)N[C@@H](C(N)C(=O)O)SC1" -> 1712 [label=0.000]
	1713 [color=aquamarine shape=rarrow style=filled]
	"256 | CC1=C(C(=O)O)N[C@@H](C(N)C(=O)O)SC1" -> 1713 [label=0.000]
	1714 [color=aquamarine shape=rarrow style=filled]
	"256 | CC1=C(C(=O)O)N[C@@H](C(N)C(=O)O)SC1" -> 1714 [label=0.000]
	1715 [color=aquamarine shape=rarrow style=filled]
	"256 | CC1=C(C(=O)O)N[C@@H](C(N)C(=O)O)SC1" -> 1715 [label=0.000]
	1716 [color=aquamarine shape=rarrow style=filled]
	"256 | CC1=C(C(=O)O)N[C@@H](C(N)C(=O)O)SC1" -> 1716 [label=0.000]
	1717 [color=aquamarine shape=rarrow style=filled]
	"258 | CC1=CN2C(=O)C(N)[C@H]2SC1" -> 1717 [label=0.000]
	1718 [color=aquamarine shape=rarrow style=filled]
	"258 | CC1=CN2C(=O)C(N)[C@H]2SC1" -> 1718 [label=0.000]
	1719 [color=aquamarine shape=rarrow style=filled]
	"258 | CC1=CN2C(=O)C(N)[C@H]2SC1" -> 1719 [label=0.000]
	1720 [color=aquamarine shape=rarrow style=filled]
	"258 | CC1=CN2C(=O)C(N)[C@H]2SC1" -> 1720 [label=0.000]
	1721 [color=aquamarine shape=rarrow style=filled]
	"258 | CC1=CN2C(=O)C(N)[C@H]2SC1" -> 1721 [label=0.000]
	1722 [color=aquamarine shape=rarrow style=filled]
	"258 | CC1=CN2C(=O)C(N)[C@H]2SC1" -> 1722 [label=0.000]
	1723 [color=aquamarine shape=rarrow style=filled]
	"258 | CC1=CN2C(=O)C(N)[C@H]2SC1" -> 1723 [label=0.000]
	1724 [color=aquamarine shape=rarrow style=filled]
	"258 | CC1=CN2C(=O)C(N)[C@H]2SC1" -> 1724 [label=0.000]
	1725 [color=aquamarine shape=rarrow style=filled]
	"258 | CC1=CN2C(=O)C(N)[C@H]2SC1" -> 1725 [label=0.000]
	1726 [color=lightblue shape=rarrow style=filled]
	"258 | CC1=CN2C(=O)C(N)[C@H]2SC1" -> 1726 [label=0.000]
	"1516 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	767 -> "1516 | Nc1nccs1" [label=""]
	"1517 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	767 -> "1517 | O=CC(=O)O" [label=""]
	"1518 | Nc1nc(CO)cs1" [color=lightyellow shape=box style=filled]
	768 -> "1518 | Nc1nc(CO)cs1" [label=""]
	"1519 | O=C=O" [color=lightyellow shape=box style=filled]
	768 -> "1519 | O=C=O" [label=""]
	"1520 | O=C(O)C(=O)O" [color=lightyellow shape=box style=filled]
	769 -> "1520 | O=C(O)C(=O)O" [label=""]
	"1521 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	769 -> "1521 | Nc1nccs1" [label=""]
	"1522 | O=C(O)C(O)c1csc([N+](=O)[O-])n1" [color=lightgrey shape=box style=filled]
	770 -> "1522 | O=C(O)C(O)c1csc([N+](=O)[O-])n1" [label=""]
	"1523 | Nc1nc(Br)cs1" [color=lightyellow shape=box style=filled]
	771 -> "1523 | Nc1nc(Br)cs1" [label=""]
	"1524 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	771 -> "1524 | O=C(O)CO" [label=""]
	"1525 | Nc1nc(C(=O)C(=O)O)cs1" [color=lightyellow shape=box style=filled]
	772 -> "1525 | Nc1nc(C(=O)C(=O)O)cs1" [label=""]
	"1526 | O" [color=lightyellow shape=box style=filled]
	772 -> "1526 | O" [label=""]
	"1527 | Nc1nc(Cl)cs1" [color=lightyellow shape=box style=filled]
	773 -> "1527 | Nc1nc(Cl)cs1" [label=""]
	"1528 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	773 -> "1528 | O=C(O)CO" [label=""]
	"1529 | O=CO" [color=lightyellow shape=box style=filled]
	774 -> "1529 | O=CO" [label=""]
	"1530 | Nc1nc(C=O)cs1" [color=lightyellow shape=box style=filled]
	774 -> "1530 | Nc1nc(C=O)cs1" [label=""]
	"1531 | O=C(O)C(O)c1csc(N[O-])n1" [color=lightgrey shape=box style=filled]
	775 -> "1531 | O=C(O)C(O)c1csc(N[O-])n1" [label=""]
	"1532 | Nc1nc(C(=O)C(=O)O)cs1" [color=lightyellow shape=box style=filled]
	776 -> "1532 | Nc1nc(C(=O)C(=O)O)cs1" [label=""]
	"1533 | OO" [color=lightyellow shape=box style=filled]
	776 -> "1533 | OO" [label=""]
	"1534 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	777 -> "1534 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"1535 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	777 -> "1535 | CCC(C)(C)OC(=O)O" [label=""]
	"1536 | CC(C)(C)OC(=O)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	778 -> "1536 | CC(C)(C)OC(=O)OC(=O)Cl" [label=""]
	"1537 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	778 -> "1537 | CCC(C)(C)O" [label=""]
	"1538 | CC(C)(C)OC(=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	779 -> "1538 | CC(C)(C)OC(=O)OC(=O)O" [label=""]
	"1539 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	779 -> "1539 | CCC(C)(C)O" [label=""]
	"1540 | CCC(C)(C)OC(=O)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	780 -> "1540 | CCC(C)(C)OC(=O)OC(=O)Cl" [label=""]
	"1541 | CC(C)(C)O" [color=lightyellow shape=box style=filled]
	780 -> "1541 | CC(C)(C)O" [label=""]
	"1542 | CC(C)(C)OC(=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	781 -> "1542 | CC(C)(C)OC(=O)OC(=O)O" [label=""]
	"1543 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	781 -> "1543 | CCC(C)(C)O" [label=""]
	"1544 | CC(C)(C)OC(=O)O[C]=O" [color=lightgrey shape=box style=filled]
	782 -> "1544 | CC(C)(C)OC(=O)O[C]=O" [label=""]
	"1545 | CCC(C)(C)[O]" [color=lightgrey shape=box style=filled]
	782 -> "1545 | CCC(C)(C)[O]" [label=""]
	"1546 | CC(C)(C)O" [color=lightyellow shape=box style=filled]
	783 -> "1546 | CC(C)(C)O" [label=""]
	"1547 | CCC(C)(C)OC(=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	783 -> "1547 | CCC(C)(C)OC(=O)OC(=O)O" [label=""]
	"1548 | CC(C)(C)OC(=O)OC=O" [color=lightgrey shape=box style=filled]
	784 -> "1548 | CC(C)(C)OC(=O)OC=O" [label=""]
	"1549 | CC(Br)C(C)(C)O" [color=lightyellow shape=box style=filled]
	784 -> "1549 | CC(Br)C(C)(C)O" [label=""]
	"1550 | CC(C)(C)OC(=O)OC(=O)Br" [color=lightgrey shape=box style=filled]
	785 -> "1550 | CC(C)(C)OC(=O)OC(=O)Br" [label=""]
	"1551 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	785 -> "1551 | CCC(C)(C)O" [label=""]
	"1552 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	786 -> "1552 | Nc1nccs1" [label=""]
	"1553 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	786 -> "1553 | O=CC(=O)O" [label=""]
	"1554 | Nc1nc(CO)cs1" [color=lightyellow shape=box style=filled]
	787 -> "1554 | Nc1nc(CO)cs1" [label=""]
	"1555 | O=C=O" [color=lightyellow shape=box style=filled]
	787 -> "1555 | O=C=O" [label=""]
	"1556 | O=C(O)C(=O)O" [color=lightyellow shape=box style=filled]
	788 -> "1556 | O=C(O)C(=O)O" [label=""]
	"1557 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	788 -> "1557 | Nc1nccs1" [label=""]
	"1558 | O=C(O)C(O)c1csc([N+](=O)[O-])n1" [color=lightgrey shape=box style=filled]
	789 -> "1558 | O=C(O)C(O)c1csc([N+](=O)[O-])n1" [label=""]
	"1559 | Nc1nc(Br)cs1" [color=lightyellow shape=box style=filled]
	790 -> "1559 | Nc1nc(Br)cs1" [label=""]
	"1560 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	790 -> "1560 | O=C(O)CO" [label=""]
	"1561 | Nc1nc(C(=O)C(=O)O)cs1" [color=lightyellow shape=box style=filled]
	791 -> "1561 | Nc1nc(C(=O)C(=O)O)cs1" [label=""]
	"1562 | O" [color=lightyellow shape=box style=filled]
	791 -> "1562 | O" [label=""]
	"1563 | Nc1nc(Cl)cs1" [color=lightyellow shape=box style=filled]
	792 -> "1563 | Nc1nc(Cl)cs1" [label=""]
	"1564 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	792 -> "1564 | O=C(O)CO" [label=""]
	"1565 | O=CO" [color=lightyellow shape=box style=filled]
	793 -> "1565 | O=CO" [label=""]
	"1566 | Nc1nc(C=O)cs1" [color=lightyellow shape=box style=filled]
	793 -> "1566 | Nc1nc(C=O)cs1" [label=""]
	"1567 | O=C(O)C(O)c1csc(N[O-])n1" [color=lightgrey shape=box style=filled]
	794 -> "1567 | O=C(O)C(O)c1csc(N[O-])n1" [label=""]
	"1568 | Nc1nc(C(=O)C(=O)O)cs1" [color=lightyellow shape=box style=filled]
	795 -> "1568 | Nc1nc(C(=O)C(=O)O)cs1" [label=""]
	"1569 | OO" [color=lightyellow shape=box style=filled]
	795 -> "1569 | OO" [label=""]
	"1570 | O=C=O" [color=lightyellow shape=box style=filled]
	796 -> "1570 | O=C=O" [label=""]
	"1571 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	796 -> "1571 | CCC(C)(C)O" [label=""]
	"1572 | O=C(O)O" [color=lightyellow shape=box style=filled]
	797 -> "1572 | O=C(O)O" [label=""]
	"1573 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	797 -> "1573 | CCC(C)(C)O" [label=""]
	"1574 | CCC(C)(C)Cl" [color=lightyellow shape=box style=filled]
	798 -> "1574 | CCC(C)(C)Cl" [label=""]
	"1575 | O=C(O)O" [color=lightyellow shape=box style=filled]
	798 -> "1575 | O=C(O)O" [label=""]
	"1576 | CC(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	799 -> "1576 | CC(C)OC(=O)O" [label=""]
	"1577 | CCI" [color=lightyellow shape=box style=filled]
	799 -> "1577 | CCI" [label=""]
	"1578 | O=C(O)O" [color=lightyellow shape=box style=filled]
	800 -> "1578 | O=C(O)O" [label=""]
	"1579 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	800 -> "1579 | CCC(C)(C)O" [label=""]
	"1580 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	801 -> "1580 | O=C(O)Cl" [label=""]
	"1581 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	801 -> "1581 | CCC(C)(C)O" [label=""]
	"1582 | CCO" [color=lightyellow shape=box style=filled]
	802 -> "1582 | CCO" [label=""]
	"1583 | CC(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	802 -> "1583 | CC(C)OC(=O)O" [label=""]
	"1584 | CCOP(=O)(OCC)OC(=O)OC(C)C" [color=lightgrey shape=box style=filled]
	803 -> "1584 | CCOP(=O)(OCC)OC(=O)OC(C)C" [label=""]
	"1585 | CCI" [color=lightyellow shape=box style=filled]
	803 -> "1585 | CCI" [label=""]
	"1586 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	804 -> "1586 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"1587 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	804 -> "1587 | Nc1nccs1" [label=""]
	"1588 | CCC(C)(C)OC(N)=O" [color=lightgrey shape=box style=filled]
	805 -> "1588 | CCC(C)(C)OC(N)=O" [label=""]
	"1589 | Brc1nccs1" [color=lightyellow shape=box style=filled]
	805 -> "1589 | Brc1nccs1" [label=""]
	"1590 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	806 -> "1590 | Nc1nccs1" [label=""]
	"1591 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	806 -> "1591 | CCC(C)(C)OC(=O)O" [label=""]
	"1592 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	807 -> "1592 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"1593 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	807 -> "1593 | Nc1nccs1" [label=""]
	"1594 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	807 -> "1594 | CCC(C)(C)OC(=O)O" [label=""]
	"1595 | CC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	808 -> "1595 | CC(C)(C)OC(=O)O" [label=""]
	"1596 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	808 -> "1596 | Nc1nccs1" [label=""]
	"1597 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	808 -> "1597 | CCC(C)(C)OC(=O)O" [label=""]
	"1598 | CCC(C)(C)OC(N)=O" [color=lightgrey shape=box style=filled]
	809 -> "1598 | CCC(C)(C)OC(N)=O" [label=""]
	"1599 | Clc1nccs1" [color=lightyellow shape=box style=filled]
	809 -> "1599 | Clc1nccs1" [label=""]
	"1600 | CC(C)(C)OC(=O)Cl" [color=lightyellow shape=box style=filled]
	810 -> "1600 | CC(C)(C)OC(=O)Cl" [label=""]
	"1601 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	810 -> "1601 | Nc1nccs1" [label=""]
	"1602 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	810 -> "1602 | CCC(C)(C)OC(=O)O" [label=""]
	"1603 | CC(C)(CC=O)OC(N)=O" [color=lightgrey shape=box style=filled]
	811 -> "1603 | CC(C)(CC=O)OC(N)=O" [label=""]
	"1604 | Brc1nccs1" [color=lightyellow shape=box style=filled]
	811 -> "1604 | Brc1nccs1" [label=""]
	"1605 | CC(C)(C)O[C]=O" [color=lightgrey shape=box style=filled]
	812 -> "1605 | CC(C)(C)O[C]=O" [label=""]
	"1606 | CCC(C)(C)OC([O])=O" [color=lightgrey shape=box style=filled]
	812 -> "1606 | CCC(C)(C)OC([O])=O" [label=""]
	"1607 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	812 -> "1607 | Nc1nccs1" [label=""]
	"1608 | CC(C)(C)O[C]=O" [color=lightgrey shape=box style=filled]
	813 -> "1608 | CC(C)(C)O[C]=O" [label=""]
	"1609 | CCC(C)(C)OC([O])=O" [color=lightgrey shape=box style=filled]
	813 -> "1609 | CCC(C)(C)OC([O])=O" [label=""]
	"1610 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	813 -> "1610 | Nc1nccs1" [label=""]
	"1611 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	814 -> "1611 | Nc1nccs1" [label=""]
	"1612 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	814 -> "1612 | O=CC(=O)O" [label=""]
	"1613 | Nc1nc(CO)cs1" [color=lightyellow shape=box style=filled]
	815 -> "1613 | Nc1nc(CO)cs1" [label=""]
	"1614 | O=C=O" [color=lightyellow shape=box style=filled]
	815 -> "1614 | O=C=O" [label=""]
	"1615 | O=C(O)C(=O)O" [color=lightyellow shape=box style=filled]
	816 -> "1615 | O=C(O)C(=O)O" [label=""]
	"1616 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	816 -> "1616 | Nc1nccs1" [label=""]
	"1617 | O=C(O)C(O)c1csc([N+](=O)[O-])n1" [color=lightgrey shape=box style=filled]
	817 -> "1617 | O=C(O)C(O)c1csc([N+](=O)[O-])n1" [label=""]
	"1618 | Nc1nc(Br)cs1" [color=lightyellow shape=box style=filled]
	818 -> "1618 | Nc1nc(Br)cs1" [label=""]
	"1619 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	818 -> "1619 | O=C(O)CO" [label=""]
	"1620 | Nc1nc(C(=O)C(=O)O)cs1" [color=lightyellow shape=box style=filled]
	819 -> "1620 | Nc1nc(C(=O)C(=O)O)cs1" [label=""]
	"1621 | O" [color=lightyellow shape=box style=filled]
	819 -> "1621 | O" [label=""]
	"1622 | Nc1nc(Cl)cs1" [color=lightyellow shape=box style=filled]
	820 -> "1622 | Nc1nc(Cl)cs1" [label=""]
	"1623 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	820 -> "1623 | O=C(O)CO" [label=""]
	"1624 | O=CO" [color=lightyellow shape=box style=filled]
	821 -> "1624 | O=CO" [label=""]
	"1625 | Nc1nc(C=O)cs1" [color=lightyellow shape=box style=filled]
	821 -> "1625 | Nc1nc(C=O)cs1" [label=""]
	"1626 | O=C(O)C(O)c1csc(N[O-])n1" [color=lightgrey shape=box style=filled]
	822 -> "1626 | O=C(O)C(O)c1csc(N[O-])n1" [label=""]
	"1627 | Nc1nc(C(=O)C(=O)O)cs1" [color=lightyellow shape=box style=filled]
	823 -> "1627 | Nc1nc(C(=O)C(=O)O)cs1" [label=""]
	"1628 | OO" [color=lightyellow shape=box style=filled]
	823 -> "1628 | OO" [label=""]
	"1629 | O=C=O" [color=lightyellow shape=box style=filled]
	824 -> "1629 | O=C=O" [label=""]
	"1630 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	824 -> "1630 | CCC(C)(C)O" [label=""]
	"1631 | O=C(O)O" [color=lightyellow shape=box style=filled]
	825 -> "1631 | O=C(O)O" [label=""]
	"1632 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	825 -> "1632 | CCC(C)(C)O" [label=""]
	"1633 | CCC(C)(C)Cl" [color=lightyellow shape=box style=filled]
	826 -> "1633 | CCC(C)(C)Cl" [label=""]
	"1634 | O=C(O)O" [color=lightyellow shape=box style=filled]
	826 -> "1634 | O=C(O)O" [label=""]
	"1635 | CC(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	827 -> "1635 | CC(C)OC(=O)O" [label=""]
	"1636 | CCI" [color=lightyellow shape=box style=filled]
	827 -> "1636 | CCI" [label=""]
	"1637 | O=C(O)O" [color=lightyellow shape=box style=filled]
	828 -> "1637 | O=C(O)O" [label=""]
	"1638 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	828 -> "1638 | CCC(C)(C)O" [label=""]
	"1639 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	829 -> "1639 | O=C(O)Cl" [label=""]
	"1640 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	829 -> "1640 | CCC(C)(C)O" [label=""]
	"1641 | CCO" [color=lightyellow shape=box style=filled]
	830 -> "1641 | CCO" [label=""]
	"1642 | CC(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	830 -> "1642 | CC(C)OC(=O)O" [label=""]
	"1643 | CCOP(=O)(OCC)OC(=O)OC(C)C" [color=lightgrey shape=box style=filled]
	831 -> "1643 | CCOP(=O)(OCC)OC(=O)OC(C)C" [label=""]
	"1644 | CCI" [color=lightyellow shape=box style=filled]
	831 -> "1644 | CCI" [label=""]
	"1645 | NC(=O)Cl" [color=lightgrey shape=box style=filled]
	832 -> "1645 | NC(=O)Cl" [label=""]
	"1646 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	832 -> "1646 | CCC(C)(C)O" [label=""]
	"1647 | NC(=O)O" [color=lightyellow shape=box style=filled]
	833 -> "1647 | NC(=O)O" [label=""]
	"1648 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	833 -> "1648 | CCC(C)(C)O" [label=""]
	"1649 | NC(=O)O" [color=lightyellow shape=box style=filled]
	834 -> "1649 | NC(=O)O" [label=""]
	"1650 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	834 -> "1650 | CCC(C)(C)O" [label=""]
	"1651 | NC=O" [color=lightyellow shape=box style=filled]
	835 -> "1651 | NC=O" [label=""]
	"1652 | O" [color=lightyellow shape=box style=filled]
	835 -> "1652 | O" [label=""]
	"1653 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	835 -> "1653 | CCC(C)(C)O" [label=""]
	"1654 | CCI" [color=lightyellow shape=box style=filled]
	836 -> "1654 | CCI" [label=""]
	"1655 | CC(C)OC(N)=O" [color=lightyellow shape=box style=filled]
	836 -> "1655 | CC(C)OC(N)=O" [label=""]
	"1656 | CCC(C)(C)Cl" [color=lightyellow shape=box style=filled]
	837 -> "1656 | CCC(C)(C)Cl" [label=""]
	"1657 | NC(=O)O" [color=lightyellow shape=box style=filled]
	837 -> "1657 | NC(=O)O" [label=""]
	"1658 | NC=O" [color=lightyellow shape=box style=filled]
	838 -> "1658 | NC=O" [label=""]
	"1659 | CC(Br)C(C)(C)O" [color=lightyellow shape=box style=filled]
	838 -> "1659 | CC(Br)C(C)(C)O" [label=""]
	"1660 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	839 -> "1660 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"1661 | N" [color=lightyellow shape=box style=filled]
	839 -> "1661 | N" [label=""]
	"1662 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	840 -> "1662 | O=C1CCC(=O)N1Br" [label=""]
	"1663 | NC=O" [color=lightyellow shape=box style=filled]
	840 -> "1663 | NC=O" [label=""]
	"1664 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	840 -> "1664 | CCC(C)(C)O" [label=""]
	"1665 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	841 -> "1665 | Nc1nccs1" [label=""]
	"1666 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	841 -> "1666 | O=CC(=O)O" [label=""]
	"1667 | Nc1nc(CO)cs1" [color=lightyellow shape=box style=filled]
	842 -> "1667 | Nc1nc(CO)cs1" [label=""]
	"1668 | O=C=O" [color=lightyellow shape=box style=filled]
	842 -> "1668 | O=C=O" [label=""]
	"1669 | O=C(O)C(=O)O" [color=lightyellow shape=box style=filled]
	843 -> "1669 | O=C(O)C(=O)O" [label=""]
	"1670 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	843 -> "1670 | Nc1nccs1" [label=""]
	"1671 | O=C(O)C(O)c1csc([N+](=O)[O-])n1" [color=lightgrey shape=box style=filled]
	844 -> "1671 | O=C(O)C(O)c1csc([N+](=O)[O-])n1" [label=""]
	"1672 | Nc1nc(Br)cs1" [color=lightyellow shape=box style=filled]
	845 -> "1672 | Nc1nc(Br)cs1" [label=""]
	"1673 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	845 -> "1673 | O=C(O)CO" [label=""]
	"1674 | Nc1nc(C(=O)C(=O)O)cs1" [color=lightyellow shape=box style=filled]
	846 -> "1674 | Nc1nc(C(=O)C(=O)O)cs1" [label=""]
	"1675 | O" [color=lightyellow shape=box style=filled]
	846 -> "1675 | O" [label=""]
	"1676 | Nc1nc(Cl)cs1" [color=lightyellow shape=box style=filled]
	847 -> "1676 | Nc1nc(Cl)cs1" [label=""]
	"1677 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	847 -> "1677 | O=C(O)CO" [label=""]
	"1678 | O=CO" [color=lightyellow shape=box style=filled]
	848 -> "1678 | O=CO" [label=""]
	"1679 | Nc1nc(C=O)cs1" [color=lightyellow shape=box style=filled]
	848 -> "1679 | Nc1nc(C=O)cs1" [label=""]
	"1680 | O=C(O)C(O)c1csc(N[O-])n1" [color=lightgrey shape=box style=filled]
	849 -> "1680 | O=C(O)C(O)c1csc(N[O-])n1" [label=""]
	"1681 | Nc1nc(C(=O)C(=O)O)cs1" [color=lightyellow shape=box style=filled]
	850 -> "1681 | Nc1nc(C(=O)C(=O)O)cs1" [label=""]
	"1682 | OO" [color=lightyellow shape=box style=filled]
	850 -> "1682 | OO" [label=""]
	"1683 | C=O" [color=lightyellow shape=box style=filled]
	851 -> "1683 | C=O" [label=""]
	"1684 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	851 -> "1684 | CCC(C)(C)O" [label=""]
	"1685 | O=CO" [color=lightyellow shape=box style=filled]
	852 -> "1685 | O=CO" [label=""]
	"1686 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	852 -> "1686 | CCC(C)(C)O" [label=""]
	"1687 | OCO" [color=lightyellow shape=box style=filled]
	853 -> "1687 | OCO" [label=""]
	"1688 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	853 -> "1688 | CCC(C)(C)O" [label=""]
	"1689 | CCC(C)(C)Cl" [color=lightyellow shape=box style=filled]
	854 -> "1689 | CCC(C)(C)Cl" [label=""]
	"1690 | OCO" [color=lightyellow shape=box style=filled]
	854 -> "1690 | OCO" [label=""]
	"1691 | CO" [color=lightyellow shape=box style=filled]
	855 -> "1691 | CO" [label=""]
	"1692 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	855 -> "1692 | CCC(C)(C)O" [label=""]
	"1693 | CO" [color=lightyellow shape=box style=filled]
	856 -> "1693 | CO" [label=""]
	"1694 | O" [color=lightyellow shape=box style=filled]
	856 -> "1694 | O" [label=""]
	"1695 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	856 -> "1695 | CCC(C)(C)O" [label=""]
	"1696 | O=CO" [color=lightyellow shape=box style=filled]
	857 -> "1696 | O=CO" [label=""]
	"1697 | CCC(C)C" [color=lightyellow shape=box style=filled]
	857 -> "1697 | CCC(C)C" [label=""]
	"1698 | OC[P+](c1ccccc1)(c1ccccc1)c1ccccc1" [color=lightyellow shape=box style=filled]
	858 -> "1698 | OC[P+](c1ccccc1)(c1ccccc1)c1ccccc1" [label=""]
	"1699 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	858 -> "1699 | CCC(C)(C)O" [label=""]
	"1700 | C=O" [color=lightyellow shape=box style=filled]
	859 -> "1700 | C=O" [label=""]
	"1701 | CC(=O)C(C)(C)O" [color=lightyellow shape=box style=filled]
	859 -> "1701 | CC(=O)C(C)(C)O" [label=""]
	"1702 | O=CO" [color=lightyellow shape=box style=filled]
	860 -> "1702 | O=CO" [label=""]
	"1703 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	860 -> "1703 | CCC(C)(C)O" [label=""]
	"1704 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	861 -> "1704 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"1705 | Nc1nc(CO)cs1" [color=lightyellow shape=box style=filled]
	861 -> "1705 | Nc1nc(CO)cs1" [label=""]
	"1706 | CCC(C)(C)OC(=O)Nc1nc(C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	862 -> "1706 | CCC(C)(C)OC(=O)Nc1nc(C(=O)O)cs1" [label=""]
	"1707 | CCC(C)(C)OC(N)=O" [color=lightgrey shape=box style=filled]
	863 -> "1707 | CCC(C)(C)OC(N)=O" [label=""]
	"1708 | OCc1csc(Br)n1" [color=lightyellow shape=box style=filled]
	863 -> "1708 | OCc1csc(Br)n1" [label=""]
	"1709 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	864 -> "1709 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"1710 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	864 -> "1710 | CCC(C)(C)OC(=O)O" [label=""]
	"1711 | Nc1nc(CO)cs1" [color=lightyellow shape=box style=filled]
	864 -> "1711 | Nc1nc(CO)cs1" [label=""]
	"1712 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	865 -> "1712 | CCC(C)(C)OC(=O)O" [label=""]
	"1713 | Nc1nc(CO)cs1" [color=lightyellow shape=box style=filled]
	865 -> "1713 | Nc1nc(CO)cs1" [label=""]
	"1714 | CCC(C)(C)OCO" [color=lightgrey shape=box style=filled]
	866 -> "1714 | CCC(C)(C)OCO" [label=""]
	"1715 | Nc1nc(CO)cs1" [color=lightyellow shape=box style=filled]
	866 -> "1715 | Nc1nc(CO)cs1" [label=""]
	"1716 | CCC(C)(C)OC(N)=O" [color=lightgrey shape=box style=filled]
	867 -> "1716 | CCC(C)(C)OC(N)=O" [label=""]
	"1717 | OCc1csc(Cl)n1" [color=lightyellow shape=box style=filled]
	867 -> "1717 | OCc1csc(Cl)n1" [label=""]
	"1718 | CC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	868 -> "1718 | CC(C)(C)OC(=O)O" [label=""]
	"1719 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	868 -> "1719 | CCC(C)(C)OC(=O)O" [label=""]
	"1720 | Nc1nc(CO)cs1" [color=lightyellow shape=box style=filled]
	868 -> "1720 | Nc1nc(CO)cs1" [label=""]
	"1721 | CC(C)(C)OC(=O)Cl" [color=lightyellow shape=box style=filled]
	869 -> "1721 | CC(C)(C)OC(=O)Cl" [label=""]
	"1722 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	869 -> "1722 | CCC(C)(C)OC(=O)O" [label=""]
	"1723 | Nc1nc(CO)cs1" [color=lightyellow shape=box style=filled]
	869 -> "1723 | Nc1nc(CO)cs1" [label=""]
	"1724 | CCC(C)(C)OC(=O)Nc1nc(C=O)cs1" [color=lightgrey shape=box style=filled]
	870 -> "1724 | CCC(C)(C)OC(=O)Nc1nc(C=O)cs1" [label=""]
	"1725 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	871 -> "1725 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"1726 | Nc1nc(Br)cs1" [color=lightyellow shape=box style=filled]
	871 -> "1726 | Nc1nc(Br)cs1" [label=""]
	"1727 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	872 -> "1727 | O=C1CCC(=O)N1Br" [label=""]
	"1728 | CCC(C)(C)OC(=O)Nc1nccs1" [color=lightgrey shape=box style=filled]
	872 -> "1728 | CCC(C)(C)OC(=O)Nc1nccs1" [label=""]
	"1729 | CCC(C)(C)OC(N)=O" [color=lightgrey shape=box style=filled]
	873 -> "1729 | CCC(C)(C)OC(N)=O" [label=""]
	"1730 | Brc1csc(Br)n1" [color=lightyellow shape=box style=filled]
	873 -> "1730 | Brc1csc(Br)n1" [label=""]
	"1731 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	874 -> "1731 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"1732 | Nc1nc(Br)cs1" [color=lightyellow shape=box style=filled]
	874 -> "1732 | Nc1nc(Br)cs1" [label=""]
	"1733 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	874 -> "1733 | CCC(C)(C)OC(=O)O" [label=""]
	"1734 | CC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	875 -> "1734 | CC(C)(C)OC(=O)O" [label=""]
	"1735 | Nc1nc(Br)cs1" [color=lightyellow shape=box style=filled]
	875 -> "1735 | Nc1nc(Br)cs1" [label=""]
	"1736 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	875 -> "1736 | CCC(C)(C)OC(=O)O" [label=""]
	"1737 | CCC(C)(C)OC(N)=O" [color=lightgrey shape=box style=filled]
	876 -> "1737 | CCC(C)(C)OC(N)=O" [label=""]
	"1738 | Clc1nc(Br)cs1" [color=lightyellow shape=box style=filled]
	876 -> "1738 | Clc1nc(Br)cs1" [label=""]
	"1739 | CC(C)(C)OC(=O)Cl" [color=lightyellow shape=box style=filled]
	877 -> "1739 | CC(C)(C)OC(=O)Cl" [label=""]
	"1740 | Nc1nc(Br)cs1" [color=lightyellow shape=box style=filled]
	877 -> "1740 | Nc1nc(Br)cs1" [label=""]
	"1741 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	877 -> "1741 | CCC(C)(C)OC(=O)O" [label=""]
	"1742 | Nc1nc(Br)cs1" [color=lightyellow shape=box style=filled]
	878 -> "1742 | Nc1nc(Br)cs1" [label=""]
	"1743 | CC(C)(C)O[C]=O" [color=lightgrey shape=box style=filled]
	878 -> "1743 | CC(C)(C)O[C]=O" [label=""]
	"1744 | CCC(C)(C)OC([O])=O" [color=lightgrey shape=box style=filled]
	878 -> "1744 | CCC(C)(C)OC([O])=O" [label=""]
	"1745 | CC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	879 -> "1745 | CC(C)(C)OC(=O)O" [label=""]
	"1746 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	879 -> "1746 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"1747 | Nc1nc(Br)cs1" [color=lightyellow shape=box style=filled]
	879 -> "1747 | Nc1nc(Br)cs1" [label=""]
	"1748 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	879 -> "1748 | CCC(C)(C)OC(=O)O" [label=""]
	"1749 | CC(C)(C)O" [color=lightyellow shape=box style=filled]
	880 -> "1749 | CC(C)(C)O" [label=""]
	"1750 | O=C=O" [color=lightyellow shape=box style=filled]
	880 -> "1750 | O=C=O" [label=""]
	"1751 | CC(C)(C)Cl" [color=lightyellow shape=box style=filled]
	881 -> "1751 | CC(C)(C)Cl" [label=""]
	"1752 | O=C(O)O" [color=lightyellow shape=box style=filled]
	881 -> "1752 | O=C(O)O" [label=""]
	"1753 | O=C(O)O" [color=lightyellow shape=box style=filled]
	882 -> "1753 | O=C(O)O" [label=""]
	"1754 | CC(C)(C)Br" [color=lightyellow shape=box style=filled]
	882 -> "1754 | CC(C)(C)Br" [label=""]
	"1755 | O=C(OO)c1cccc(Cl)c1" [color=lightyellow shape=box style=filled]
	883 -> "1755 | O=C(OO)c1cccc(Cl)c1" [label=""]
	"1756 | CC(C)(C)OCO" [color=lightgrey shape=box style=filled]
	883 -> "1756 | CC(C)(C)OCO" [label=""]
	"1757 | CC(C)(C)O" [color=lightyellow shape=box style=filled]
	884 -> "1757 | CC(C)(C)O" [label=""]
	"1758 | O=C(O)O" [color=lightyellow shape=box style=filled]
	884 -> "1758 | O=C(O)O" [label=""]
	"1759 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	885 -> "1759 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"1760 | O" [color=lightyellow shape=box style=filled]
	885 -> "1760 | O" [label=""]
	"1761 | CI" [color=lightyellow shape=box style=filled]
	886 -> "1761 | CI" [label=""]
	"1762 | CCOP(=O)(OCC)OC(=O)OC(C)C" [color=lightgrey shape=box style=filled]
	886 -> "1762 | CCOP(=O)(OCC)OC(=O)OC(C)C" [label=""]
	"1763 | CC(C)(C)O" [color=lightyellow shape=box style=filled]
	887 -> "1763 | CC(C)(C)O" [label=""]
	"1764 | O=C(O)O" [color=lightyellow shape=box style=filled]
	887 -> "1764 | O=C(O)O" [label=""]
	"1765 | CC(C)(C)OC(=O)OC(O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	888 -> "1765 | CC(C)(C)OC(=O)OC(O)OC(C)(C)C" [label=""]
	"1766 | O" [color=lightyellow shape=box style=filled]
	888 -> "1766 | O" [label=""]
	"1767 | CO" [color=lightyellow shape=box style=filled]
	889 -> "1767 | CO" [label=""]
	"1768 | CC(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	889 -> "1768 | CC(C)OC(=O)O" [label=""]
	"1769 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	890 -> "1769 | Nc1nccs1" [label=""]
	"1770 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	890 -> "1770 | O=CC(=O)O" [label=""]
	"1771 | Nc1nc(CO)cs1" [color=lightyellow shape=box style=filled]
	891 -> "1771 | Nc1nc(CO)cs1" [label=""]
	"1772 | O=C=O" [color=lightyellow shape=box style=filled]
	891 -> "1772 | O=C=O" [label=""]
	"1773 | O=C(O)C(=O)O" [color=lightyellow shape=box style=filled]
	892 -> "1773 | O=C(O)C(=O)O" [label=""]
	"1774 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	892 -> "1774 | Nc1nccs1" [label=""]
	"1775 | O=C(O)C(O)c1csc([N+](=O)[O-])n1" [color=lightgrey shape=box style=filled]
	893 -> "1775 | O=C(O)C(O)c1csc([N+](=O)[O-])n1" [label=""]
	"1776 | Nc1nc(Br)cs1" [color=lightyellow shape=box style=filled]
	894 -> "1776 | Nc1nc(Br)cs1" [label=""]
	"1777 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	894 -> "1777 | O=C(O)CO" [label=""]
	"1778 | Nc1nc(C(=O)C(=O)O)cs1" [color=lightyellow shape=box style=filled]
	895 -> "1778 | Nc1nc(C(=O)C(=O)O)cs1" [label=""]
	"1779 | O" [color=lightyellow shape=box style=filled]
	895 -> "1779 | O" [label=""]
	"1780 | Nc1nc(Cl)cs1" [color=lightyellow shape=box style=filled]
	896 -> "1780 | Nc1nc(Cl)cs1" [label=""]
	"1781 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	896 -> "1781 | O=C(O)CO" [label=""]
	"1782 | O=CO" [color=lightyellow shape=box style=filled]
	897 -> "1782 | O=CO" [label=""]
	"1783 | Nc1nc(C=O)cs1" [color=lightyellow shape=box style=filled]
	897 -> "1783 | Nc1nc(C=O)cs1" [label=""]
	"1784 | O=C(O)C(O)c1csc(N[O-])n1" [color=lightgrey shape=box style=filled]
	898 -> "1784 | O=C(O)C(O)c1csc(N[O-])n1" [label=""]
	"1785 | Nc1nc(C(=O)C(=O)O)cs1" [color=lightyellow shape=box style=filled]
	899 -> "1785 | Nc1nc(C(=O)C(=O)O)cs1" [label=""]
	"1786 | OO" [color=lightyellow shape=box style=filled]
	899 -> "1786 | OO" [label=""]
	"1787 | O=C=O" [color=lightyellow shape=box style=filled]
	900 -> "1787 | O=C=O" [label=""]
	"1788 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	900 -> "1788 | CCC(C)(C)O" [label=""]
	"1789 | O=C(O)O" [color=lightyellow shape=box style=filled]
	901 -> "1789 | O=C(O)O" [label=""]
	"1790 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	901 -> "1790 | CCC(C)(C)O" [label=""]
	"1791 | CCC(C)(C)Cl" [color=lightyellow shape=box style=filled]
	902 -> "1791 | CCC(C)(C)Cl" [label=""]
	"1792 | O=C(O)O" [color=lightyellow shape=box style=filled]
	902 -> "1792 | O=C(O)O" [label=""]
	"1793 | CC(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	903 -> "1793 | CC(C)OC(=O)O" [label=""]
	"1794 | CCI" [color=lightyellow shape=box style=filled]
	903 -> "1794 | CCI" [label=""]
	"1795 | O=C(O)O" [color=lightyellow shape=box style=filled]
	904 -> "1795 | O=C(O)O" [label=""]
	"1796 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	904 -> "1796 | CCC(C)(C)O" [label=""]
	"1797 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	905 -> "1797 | O=C(O)Cl" [label=""]
	"1798 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	905 -> "1798 | CCC(C)(C)O" [label=""]
	"1799 | CCO" [color=lightyellow shape=box style=filled]
	906 -> "1799 | CCO" [label=""]
	"1800 | CC(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	906 -> "1800 | CC(C)OC(=O)O" [label=""]
	"1801 | CCOP(=O)(OCC)OC(=O)OC(C)C" [color=lightgrey shape=box style=filled]
	907 -> "1801 | CCOP(=O)(OCC)OC(=O)OC(C)C" [label=""]
	"1802 | CCI" [color=lightyellow shape=box style=filled]
	907 -> "1802 | CCI" [label=""]
	"1803 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	908 -> "1803 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"1804 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	908 -> "1804 | Nc1nccs1" [label=""]
	"1805 | CCC(C)(C)OC(N)=O" [color=lightgrey shape=box style=filled]
	909 -> "1805 | CCC(C)(C)OC(N)=O" [label=""]
	"1806 | Brc1nccs1" [color=lightyellow shape=box style=filled]
	909 -> "1806 | Brc1nccs1" [label=""]
	"1807 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	910 -> "1807 | Nc1nccs1" [label=""]
	"1808 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	910 -> "1808 | CCC(C)(C)OC(=O)O" [label=""]
	"1809 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	911 -> "1809 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"1810 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	911 -> "1810 | Nc1nccs1" [label=""]
	"1811 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	911 -> "1811 | CCC(C)(C)OC(=O)O" [label=""]
	"1812 | CC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	912 -> "1812 | CC(C)(C)OC(=O)O" [label=""]
	"1813 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	912 -> "1813 | Nc1nccs1" [label=""]
	"1814 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	912 -> "1814 | CCC(C)(C)OC(=O)O" [label=""]
	"1815 | CCC(C)(C)OC(N)=O" [color=lightgrey shape=box style=filled]
	913 -> "1815 | CCC(C)(C)OC(N)=O" [label=""]
	"1816 | Clc1nccs1" [color=lightyellow shape=box style=filled]
	913 -> "1816 | Clc1nccs1" [label=""]
	"1817 | CC(C)(C)OC(=O)Cl" [color=lightyellow shape=box style=filled]
	914 -> "1817 | CC(C)(C)OC(=O)Cl" [label=""]
	"1818 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	914 -> "1818 | Nc1nccs1" [label=""]
	"1819 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	914 -> "1819 | CCC(C)(C)OC(=O)O" [label=""]
	"1820 | CC(C)(CC=O)OC(N)=O" [color=lightgrey shape=box style=filled]
	915 -> "1820 | CC(C)(CC=O)OC(N)=O" [label=""]
	"1821 | Brc1nccs1" [color=lightyellow shape=box style=filled]
	915 -> "1821 | Brc1nccs1" [label=""]
	"1822 | CC(C)(C)O[C]=O" [color=lightgrey shape=box style=filled]
	916 -> "1822 | CC(C)(C)O[C]=O" [label=""]
	"1823 | CCC(C)(C)OC([O])=O" [color=lightgrey shape=box style=filled]
	916 -> "1823 | CCC(C)(C)OC([O])=O" [label=""]
	"1824 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	916 -> "1824 | Nc1nccs1" [label=""]
	"1825 | CC(C)(C)O[C]=O" [color=lightgrey shape=box style=filled]
	917 -> "1825 | CC(C)(C)O[C]=O" [label=""]
	"1826 | CCC(C)(C)OC([O])=O" [color=lightgrey shape=box style=filled]
	917 -> "1826 | CCC(C)(C)OC([O])=O" [label=""]
	"1827 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	917 -> "1827 | Nc1nccs1" [label=""]
	"1828 | CC1=C(C(=O)O)N[C@@H](C(N)C(=O)O)SC1" [color=lightgrey shape=box style=filled]
	918 -> "1828 | CC1=C(C(=O)O)N[C@@H](C(N)C(=O)O)SC1" [label=""]
	"1829 | O=C=O" [color=lightyellow shape=box style=filled]
	919 -> "1829 | O=C=O" [label=""]
	"1830 | CC1=CN2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	919 -> "1830 | CC1=CN2C(=O)C(N)[C@H]2SC1" [label=""]
	"1831 | CC(CS[C@H]1NC(=O)C1N)CC(=O)O" [color=lightgrey shape=box style=filled]
	920 -> "1831 | CC(CS[C@H]1NC(=O)C1N)CC(=O)O" [label=""]
	"1832 | CC(CS[C@H]1NC(=O)C1N)C(=O)C(=O)O" [color=lightgrey shape=box style=filled]
	921 -> "1832 | CC(CS[C@H]1NC(=O)C1N)C(=O)C(=O)O" [label=""]
	"1833 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)OC(C)(C)C)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	922 -> "1833 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)OC(C)(C)C)[C@H]2SC1" [label=""]
	"1834 | CCCS[C@H]1NC(=O)C1N" [color=lightgrey shape=box style=filled]
	923 -> "1834 | CCCS[C@H]1NC(=O)C1N" [label=""]
	"1835 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	923 -> "1835 | O=CC(=O)O" [label=""]
	"1836 | C[C]CS[C@H]1[N]C(=O)C1N" [color=lightgrey shape=box style=filled]
	924 -> "1836 | C[C]CS[C@H]1[N]C(=O)C1N" [label=""]
	"1837 | [C]C(=O)O" [color=lightgrey shape=box style=filled]
	924 -> "1837 | [C]C(=O)O" [label=""]
	"1838 | CCCS[C@H]1NC(=O)C1N" [color=lightgrey shape=box style=filled]
	925 -> "1838 | CCCS[C@H]1NC(=O)C1N" [label=""]
	"1839 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	925 -> "1839 | O=C(O)CO" [label=""]
	"1840 | CCCS[C@@H]1C(NC(=O)OC(C)(C)C)C(=O)N1CC(=O)O" [color=lightgrey shape=box style=filled]
	926 -> "1840 | CCCS[C@@H]1C(NC(=O)OC(C)(C)C)C(=O)N1CC(=O)O" [label=""]
	"1841 | CCCS[C@@H]1C(N)C(=O)N1C(O)C(=O)O" [color=lightgrey shape=box style=filled]
	927 -> "1841 | CCCS[C@@H]1C(N)C(=O)N1C(O)C(=O)O" [label=""]
	"1842 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	928 -> "1842 | O=C1CCC(=O)N1Br" [label=""]
	"1843 | CC1=CN2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	928 -> "1843 | CC1=CN2C(=O)C(N)[C@H]2SC1" [label=""]
	"1844 | NC1C(=O)N2C=CCS[C@H]12" [color=lightgrey shape=box style=filled]
	929 -> "1844 | NC1C(=O)N2C=CCS[C@H]12" [label=""]
	"1845 | BrCBr" [color=lightyellow shape=box style=filled]
	929 -> "1845 | BrCBr" [label=""]
	"1846 | NC(C(=O)O)[C@@H]1NC=C(CBr)CS1" [color=lightgrey shape=box style=filled]
	930 -> "1846 | NC(C(=O)O)[C@@H]1NC=C(CBr)CS1" [label=""]
	"1847 | [CH]=C([CH2])CBr" [color=lightgrey shape=box style=filled]
	931 -> "1847 | [CH]=C([CH2])CBr" [label=""]
	"1848 | NC1C(=O)[N][C@@H]1[S]" [color=lightgrey shape=box style=filled]
	931 -> "1848 | NC1C(=O)[N][C@@H]1[S]" [label=""]
	"1849 | NC1C(=O)N[C@@H]1SCCCBr" [color=lightgrey shape=box style=filled]
	932 -> "1849 | NC1C(=O)N[C@@H]1SCCCBr" [label=""]
	"1850 | C[P+](c1ccccc1)(c1ccccc1)c1ccccc1" [color=lightyellow shape=box style=filled]
	932 -> "1850 | C[P+](c1ccccc1)(c1ccccc1)c1ccccc1" [label=""]
	"1851 | [CH]=[C]CBr" [color=lightgrey shape=box style=filled]
	933 -> "1851 | [CH]=[C]CBr" [label=""]
	"1852 | [CH2]S[C@H]1[N]C(=O)C1N" [color=lightgrey shape=box style=filled]
	933 -> "1852 | [CH2]S[C@H]1[N]C(=O)C1N" [label=""]
	"1853 | CCCBr" [color=lightyellow shape=box style=filled]
	934 -> "1853 | CCCBr" [label=""]
	"1854 | CS[C@H]1NC(=O)C1N" [color=lightgrey shape=box style=filled]
	934 -> "1854 | CS[C@H]1NC(=O)C1N" [label=""]
	"1855 | NC1C(=O)N[C@@H]1SCCCBr" [color=lightgrey shape=box style=filled]
	935 -> "1855 | NC1C(=O)N[C@@H]1SCCCBr" [label=""]
	"1856 | C=O" [color=lightyellow shape=box style=filled]
	935 -> "1856 | C=O" [label=""]
	"1857 | NC1C(=O)N[C@@H]1SCC(=CBr)CBr" [color=lightgrey shape=box style=filled]
	936 -> "1857 | NC1C(=O)N[C@@H]1SCC(=CBr)CBr" [label=""]
	"1858 | C=C(CBr)CBr" [color=lightyellow shape=box style=filled]
	937 -> "1858 | C=C(CBr)CBr" [label=""]
	"1859 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	937 -> "1859 | NC1C(=O)N[C@@H]1S" [label=""]
	"1860 | BrC(Br)Br" [color=lightyellow shape=box style=filled]
	938 -> "1860 | BrC(Br)Br" [label=""]
	"1861 | NC1C(=O)N[C@@H]1SCC=CC(=O)O" [color=lightgrey shape=box style=filled]
	938 -> "1861 | NC1C(=O)N[C@@H]1SCC=CC(=O)O" [label=""]
	"1862 | O=C(O)C=C(CBr)C(Br)Br" [color=lightgrey shape=box style=filled]
	939 -> "1862 | O=C(O)C=C(CBr)C(Br)Br" [label=""]
	"1863 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	939 -> "1863 | NC1C(=O)N[C@@H]1S" [label=""]
	"1864 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	940 -> "1864 | NC1C(=O)N[C@@H]1S" [label=""]
	"1865 | O=CC(=CC(=O)O)C(Br)Br" [color=lightgrey shape=box style=filled]
	940 -> "1865 | O=CC(=CC(=O)O)C(Br)Br" [label=""]
	"1866 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	941 -> "1866 | NC1C(=O)N[C@@H]1S" [label=""]
	"1867 | O=C(O)C=C(CCl)C(Br)Br" [color=lightgrey shape=box style=filled]
	941 -> "1867 | O=C(O)C=C(CCl)C(Br)Br" [label=""]
	"1868 | BrCBr" [color=lightyellow shape=box style=filled]
	942 -> "1868 | BrCBr" [label=""]
	"1869 | NC1C(=O)N[C@@H]1SCCCC(=O)O" [color=lightgrey shape=box style=filled]
	942 -> "1869 | NC1C(=O)N[C@@H]1SCCCC(=O)O" [label=""]
	"1870 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	943 -> "1870 | NC1C(=O)N[C@@H]1S" [label=""]
	"1871 | O=C(O)C=C(CO)C(Br)Br" [color=lightgrey shape=box style=filled]
	943 -> "1871 | O=C(O)C=C(CO)C(Br)Br" [label=""]
	"1872 | O=C(O)C=CC(Br)Br" [color=lightgrey shape=box style=filled]
	944 -> "1872 | O=C(O)C=CC(Br)Br" [label=""]
	"1873 | NC1C(=O)N[C@@H]1SCBr" [color=lightgrey shape=box style=filled]
	944 -> "1873 | NC1C(=O)N[C@@H]1SCBr" [label=""]
	"1874 | NC1C(=O)NC1=O" [color=lightgrey shape=box style=filled]
	945 -> "1874 | NC1C(=O)NC1=O" [label=""]
	"1875 | O=C(O)C=C(CS)C(Br)Br" [color=lightgrey shape=box style=filled]
	945 -> "1875 | O=C(O)C=C(CS)C(Br)Br" [label=""]
	"1876 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	946 -> "1876 | NC1C(=O)N[C@@H]1S" [label=""]
	"1877 | CC(CC(=O)O)C(Br)Br" [color=lightgrey shape=box style=filled]
	946 -> "1877 | CC(CC(=O)O)C(Br)Br" [label=""]
	"1878 | CS[C@H]1NC(=O)C1N" [color=lightgrey shape=box style=filled]
	947 -> "1878 | CS[C@H]1NC(=O)C1N" [label=""]
	"1879 | O=C(O)CCC(Br)Br" [color=lightgrey shape=box style=filled]
	947 -> "1879 | O=C(O)CCC(Br)Br" [label=""]
	"1880 | CC1=C(C(=O)O)N[C@@H](C(N)C(=O)O)SC1" [color=lightgrey shape=box style=filled]
	948 -> "1880 | CC1=C(C(=O)O)N[C@@H](C(N)C(=O)O)SC1" [label=""]
	"1881 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	948 -> "1881 | O=C1CCC(=O)N1Br" [label=""]
	"1882 | NC(C(=O)O)[C@@H]1NC=C(CBr)CS1" [color=lightgrey shape=box style=filled]
	949 -> "1882 | NC(C(=O)O)[C@@H]1NC=C(CBr)CS1" [label=""]
	"1883 | O=C=O" [color=lightyellow shape=box style=filled]
	949 -> "1883 | O=C=O" [label=""]
	"1884 | NC(=O)C(=O)O" [color=lightyellow shape=box style=filled]
	950 -> "1884 | NC(=O)C(=O)O" [label=""]
	"1885 | O=C(O)C1=C(CBr)CSCN1" [color=lightgrey shape=box style=filled]
	950 -> "1885 | O=C(O)C1=C(CBr)CSCN1" [label=""]
	"1886 | NCC(=O)O" [color=lightyellow shape=box style=filled]
	951 -> "1886 | NCC(=O)O" [label=""]
	"1887 | O=C(O)C1=C(CBr)CS[C@H](Br)N1" [color=lightgrey shape=box style=filled]
	951 -> "1887 | O=C(O)C1=C(CBr)CS[C@H](Br)N1" [label=""]
	"1888 | O=C(O)C[C@@H]1NC(C(=O)O)=C(CBr)CS1" [color=lightgrey shape=box style=filled]
	952 -> "1888 | O=C(O)C[C@@H]1NC(C(=O)O)=C(CBr)CS1" [label=""]
	"1889 | CC(C)(C)OC(N)=O" [color=lightyellow shape=box style=filled]
	952 -> "1889 | CC(C)(C)OC(N)=O" [label=""]
	"1890 | N" [color=lightyellow shape=box style=filled]
	953 -> "1890 | N" [label=""]
	"1891 | O=C(O)C(=O)[C@@H]1NC(C(=O)O)=C(CBr)CS1" [color=lightgrey shape=box style=filled]
	953 -> "1891 | O=C(O)C(=O)[C@@H]1NC(C(=O)O)=C(CBr)CS1" [label=""]
	"1892 | O=C(O)C1=C(CBr)CSCN1" [color=lightgrey shape=box style=filled]
	954 -> "1892 | O=C(O)C1=C(CBr)CSCN1" [label=""]
	"1893 | NC(Br)C(=O)O" [color=lightgrey shape=box style=filled]
	954 -> "1893 | NC(Br)C(=O)O" [label=""]
	"1894 | NC(O)C(=O)O" [color=lightgrey shape=box style=filled]
	955 -> "1894 | NC(O)C(=O)O" [label=""]
	"1895 | O=C(O)C1=C(CBr)CSCN1" [color=lightgrey shape=box style=filled]
	955 -> "1895 | O=C(O)C1=C(CBr)CSCN1" [label=""]
	"1896 | CC(C)(C)OC(=O)NCC(=O)O" [color=lightyellow shape=box style=filled]
	956 -> "1896 | CC(C)(C)OC(=O)NCC(=O)O" [label=""]
	"1897 | O=C(O)C1=C(CBr)CSCN1" [color=lightgrey shape=box style=filled]
	956 -> "1897 | O=C(O)C1=C(CBr)CSCN1" [label=""]
	"1898 | O=C(O)C(O)=C(CCl)CBr" [color=lightgrey shape=box style=filled]
	957 -> "1898 | O=C(O)C(O)=C(CCl)CBr" [label=""]
	"1899 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	957 -> "1899 | NC1C(=O)N[C@@H]1S" [label=""]
	"1900 | O=C(O)C(O)=C(CBr)CBr" [color=lightgrey shape=box style=filled]
	958 -> "1900 | O=C(O)C(O)=C(CBr)CBr" [label=""]
	"1901 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	958 -> "1901 | NC1C(=O)N[C@@H]1S" [label=""]
	"1902 | O=CC(CBr)=C(O)C(=O)O" [color=lightgrey shape=box style=filled]
	959 -> "1902 | O=CC(CBr)=C(O)C(=O)O" [label=""]
	"1903 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	959 -> "1903 | NC1C(=O)N[C@@H]1S" [label=""]
	"1904 | O=C(O)C(=O)O" [color=lightyellow shape=box style=filled]
	960 -> "1904 | O=C(O)C(=O)O" [label=""]
	"1905 | NC1C(=O)N[C@@H]1SCCCBr" [color=lightgrey shape=box style=filled]
	960 -> "1905 | NC1C(=O)N[C@@H]1SCCCBr" [label=""]
	"1906 | [CH2]C(CBr)=C(O)C(=O)O" [color=lightgrey shape=box style=filled]
	961 -> "1906 | [CH2]C(CBr)=C(O)C(=O)O" [label=""]
	"1907 | O=C1[CH][C@@H]([S])N1" [color=lightgrey shape=box style=filled]
	961 -> "1907 | O=C1[CH][C@@H]([S])N1" [label=""]
	"1908 | [NH2]" [color=lightyellow shape=box style=filled]
	961 -> "1908 | [NH2]" [label=""]
	"1909 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	962 -> "1909 | O=C1CCC(=O)N1Br" [label=""]
	"1910 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	962 -> "1910 | NC1C(=O)N[C@@H]1S" [label=""]
	"1911 | CC(CBr)=C(O)C(=O)O" [color=lightgrey shape=box style=filled]
	962 -> "1911 | CC(CBr)=C(O)C(=O)O" [label=""]
	"1912 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	963 -> "1912 | NC1C(=O)N[C@@H]1S" [label=""]
	"1913 | CC(C)(C)OC(=O)CC(CBr)=C(O)C(=O)O" [color=lightgrey shape=box style=filled]
	963 -> "1913 | CC(C)(C)OC(=O)CC(CBr)=C(O)C(=O)O" [label=""]
	"1914 | NC1C(=O)N[C@@H]1SCC(=O)CBr" [color=lightgrey shape=box style=filled]
	964 -> "1914 | NC1C(=O)N[C@@H]1SCC(=O)CBr" [label=""]
	"1915 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	964 -> "1915 | O=C(O)CO" [label=""]
	"1916 | CC(CBr)=C(O)C(=O)O" [color=lightgrey shape=box style=filled]
	965 -> "1916 | CC(CBr)=C(O)C(=O)O" [label=""]
	"1917 | O=C1C[C@@H](S)N1" [color=lightgrey shape=box style=filled]
	965 -> "1917 | O=C1C[C@@H](S)N1" [label=""]
	"1918 | CC(C)(C)OC(N)=O" [color=lightyellow shape=box style=filled]
	965 -> "1918 | CC(C)(C)OC(N)=O" [label=""]
	"1919 | NC1C(=O)N[C@@H]1SCCCBr" [color=lightgrey shape=box style=filled]
	966 -> "1919 | NC1C(=O)N[C@@H]1SCCCBr" [label=""]
	"1920 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	966 -> "1920 | O=CC(=O)O" [label=""]
	"1921 | NC1C(=O)N[C@@H]1SCC(=O)CBr" [color=lightgrey shape=box style=filled]
	967 -> "1921 | NC1C(=O)N[C@@H]1SCC(=O)CBr" [label=""]
	"1922 | O=C(O)CCl" [color=lightgrey shape=box style=filled]
	967 -> "1922 | O=C(O)CCl" [label=""]
	"1923 | NC1C(=O)N[C@@H]1SCCCBr" [color=lightgrey shape=box style=filled]
	968 -> "1923 | NC1C(=O)N[C@@H]1SCCCBr" [label=""]
	"1924 | O=C(O)C(Cl)Cl" [color=lightyellow shape=box style=filled]
	968 -> "1924 | O=C(O)C(Cl)Cl" [label=""]
	"1925 | CC(CBr)=C(Cl)C(=O)[O+]=O" [color=lightgrey shape=box style=filled]
	969 -> "1925 | CC(CBr)=C(Cl)C(=O)[O+]=O" [label=""]
	"1926 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	969 -> "1926 | NC1C(=O)N[C@@H]1S" [label=""]
	"1927 | CC(C)(C)OC(=O)NC1C(=O)N[C@@H]1SCCCBr" [color=lightgrey shape=box style=filled]
	970 -> "1927 | CC(C)(C)OC(=O)NC1C(=O)N[C@@H]1SCCCBr" [label=""]
	"1928 | O=C(O)CCl" [color=lightgrey shape=box style=filled]
	970 -> "1928 | O=C(O)CCl" [label=""]
	"1929 | CC(CBr)=C(Cl)C(=O)O" [color=lightgrey shape=box style=filled]
	971 -> "1929 | CC(CBr)=C(Cl)C(=O)O" [label=""]
	"1930 | CC(C)(C)OC(=O)NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	971 -> "1930 | CC(C)(C)OC(=O)NC1C(=O)N[C@@H]1S" [label=""]
	"1931 | O=C(O)C(Cl)=C(CCl)CBr" [color=lightgrey shape=box style=filled]
	972 -> "1931 | O=C(O)C(Cl)=C(CCl)CBr" [label=""]
	"1932 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	972 -> "1932 | NC1C(=O)N[C@@H]1S" [label=""]
	"1933 | O=C(O)C(Cl)=C(CBr)CBr" [color=lightgrey shape=box style=filled]
	973 -> "1933 | O=C(O)C(Cl)=C(CBr)CBr" [label=""]
	"1934 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	973 -> "1934 | NC1C(=O)N[C@@H]1S" [label=""]
	"1935 | O=CC(CBr)=C(Cl)C(=O)O" [color=lightgrey shape=box style=filled]
	974 -> "1935 | O=CC(CBr)=C(Cl)C(=O)O" [label=""]
	"1936 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	974 -> "1936 | NC1C(=O)N[C@@H]1S" [label=""]
	"1937 | NC1C(=O)N[C@@H]1SCC(O)CBr" [color=lightgrey shape=box style=filled]
	975 -> "1937 | NC1C(=O)N[C@@H]1SCC(O)CBr" [label=""]
	"1938 | O=C(O)CCl" [color=lightgrey shape=box style=filled]
	975 -> "1938 | O=C(O)CCl" [label=""]
	"1939 | O=C(O)C(Cl)=C(CS)CBr" [color=lightgrey shape=box style=filled]
	976 -> "1939 | O=C(O)C(Cl)=C(CS)CBr" [label=""]
	"1940 | NC1CNC1=O" [color=lightyellow shape=box style=filled]
	976 -> "1940 | NC1CNC1=O" [label=""]
	"1941 | O=C(O)C(=O)C(CBr)CBr" [color=lightgrey shape=box style=filled]
	977 -> "1941 | O=C(O)C(=O)C(CBr)CBr" [label=""]
	"1942 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	977 -> "1942 | NC1C(=O)N[C@@H]1S" [label=""]
	"1943 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	978 -> "1943 | NC1C(=O)N[C@@H]1S" [label=""]
	"1944 | O=C(O)C(=O)C(CO)CBr" [color=lightgrey shape=box style=filled]
	978 -> "1944 | O=C(O)C(=O)C(CO)CBr" [label=""]
	"1945 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	979 -> "1945 | NC1C(=O)N[C@@H]1S" [label=""]
	"1946 | O=CC(CBr)C(=O)C(=O)O" [color=lightgrey shape=box style=filled]
	979 -> "1946 | O=CC(CBr)C(=O)C(=O)O" [label=""]
	"1947 | O=C(O)C(=O)C(CCl)CBr" [color=lightgrey shape=box style=filled]
	980 -> "1947 | O=C(O)C(=O)C(CCl)CBr" [label=""]
	"1948 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	980 -> "1948 | NC1C(=O)N[C@@H]1S" [label=""]
	"1949 | CC(=O)[Br+]CS[C@H]1NC(=O)C1NC(=O)OC(CBr)(CBr)C(=O)Cl" [color=lightgrey shape=box style=filled]
	981 -> "1949 | CC(=O)[Br+]CS[C@H]1NC(=O)C1NC(=O)OC(CBr)(CBr)C(=O)Cl" [label=""]
	"1950 | O=C(O)C(=O)C(=O)CBr" [color=lightgrey shape=box style=filled]
	981 -> "1950 | O=C(O)C(=O)C(=O)CBr" [label=""]
	"1951 | O=C(O)CC(CBr)CBr" [color=lightgrey shape=box style=filled]
	982 -> "1951 | O=C(O)CC(CBr)CBr" [label=""]
	"1952 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	982 -> "1952 | NC1C(=O)N[C@@H]1S" [label=""]
	"1953 | O=C(O)CC(CCl)CBr" [color=lightgrey shape=box style=filled]
	983 -> "1953 | O=C(O)CC(CCl)CBr" [label=""]
	"1954 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	983 -> "1954 | NC1C(=O)N[C@@H]1S" [label=""]
	"1955 | O=CC(CBr)CC(=O)O" [color=lightgrey shape=box style=filled]
	984 -> "1955 | O=CC(CBr)CC(=O)O" [label=""]
	"1956 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	984 -> "1956 | NC1C(=O)N[C@@H]1S" [label=""]
	"1957 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	985 -> "1957 | NC1C(=O)N[C@@H]1S" [label=""]
	"1958 | BrCCCBr" [color=lightyellow shape=box style=filled]
	985 -> "1958 | BrCCCBr" [label=""]
	"1959 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	986 -> "1959 | NC1C(=O)N[C@@H]1S" [label=""]
	"1960 | O=CCCBr" [color=lightyellow shape=box style=filled]
	986 -> "1960 | O=CCCBr" [label=""]
	"1961 | [Br]" [color=lightyellow shape=box style=filled]
	987 -> "1961 | [Br]" [label=""]
	"1962 | CCOC(=O)C(N)[C@H](N)SCC[CH][Br+]C(=O)c1ccc(Br)cc1" [color=lightgrey shape=box style=filled]
	987 -> "1962 | CCOC(=O)C(N)[C@H](N)SCC[CH][Br+]C(=O)c1ccc(Br)cc1" [label=""]
	"1963 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	988 -> "1963 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"1964 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	988 -> "1964 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"1965 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	989 -> "1965 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"1966 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	989 -> "1966 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"1967 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	989 -> "1967 | CCC(C)(C)OC(=O)O" [label=""]
	"1968 | CCC(C)(C)OC(=O)Nc1nccs1" [color=lightgrey shape=box style=filled]
	990 -> "1968 | CCC(C)(C)OC(=O)Nc1nccs1" [label=""]
	"1969 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	990 -> "1969 | O=CC(=O)O" [label=""]
	"1970 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	991 -> "1970 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"1971 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	991 -> "1971 | CCC(C)(C)OC(=O)O" [label=""]
	"1972 | CCC(C)(C)OC(N)=O" [color=lightgrey shape=box style=filled]
	992 -> "1972 | CCC(C)(C)OC(N)=O" [label=""]
	"1973 | O=C(O)C(O)c1csc(Br)n1" [color=lightyellow shape=box style=filled]
	992 -> "1973 | O=C(O)C(O)c1csc(Br)n1" [label=""]
	"1974 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	993 -> "1974 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"1975 | CCC(C)(C)OCO" [color=lightgrey shape=box style=filled]
	993 -> "1975 | CCC(C)(C)OCO" [label=""]
	"1976 | CCC(C)(C)OC(=O)Nc1nc(CO)cs1" [color=lightgrey shape=box style=filled]
	994 -> "1976 | CCC(C)(C)OC(=O)Nc1nc(CO)cs1" [label=""]
	"1977 | O=C=O" [color=lightyellow shape=box style=filled]
	994 -> "1977 | O=C=O" [label=""]
	"1978 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	995 -> "1978 | O=C(O)CO" [label=""]
	"1979 | CCC(C)(C)OC(=O)Nc1nc(Br)cs1" [color=lightgrey shape=box style=filled]
	995 -> "1979 | CCC(C)(C)OC(=O)Nc1nc(Br)cs1" [label=""]
	"1980 | CC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	996 -> "1980 | CC(C)(C)OC(=O)O" [label=""]
	"1981 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	996 -> "1981 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"1982 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	996 -> "1982 | CCC(C)(C)OC(=O)O" [label=""]
	"1983 | O=C(O)C(=O)O" [color=lightyellow shape=box style=filled]
	997 -> "1983 | O=C(O)C(=O)O" [label=""]
	"1984 | CCC(C)(C)OC(=O)Nc1nccs1" [color=lightgrey shape=box style=filled]
	997 -> "1984 | CCC(C)(C)OC(=O)Nc1nccs1" [label=""]
	"1985 | CC1=C(C(=O)O)N[C@@H](C(N)C(=O)O)SC1" [color=lightgrey shape=box style=filled]
	998 -> "1985 | CC1=C(C(=O)O)N[C@@H](C(N)C(=O)O)SC1" [label=""]
	"1986 | O=C=O" [color=lightyellow shape=box style=filled]
	999 -> "1986 | O=C=O" [label=""]
	"1987 | CC1=CN2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	999 -> "1987 | CC1=CN2C(=O)C(N)[C@H]2SC1" [label=""]
	"1988 | CC(CS[C@H]1NC(=O)C1N)CC(=O)O" [color=lightgrey shape=box style=filled]
	1000 -> "1988 | CC(CS[C@H]1NC(=O)C1N)CC(=O)O" [label=""]
	"1989 | CC(CS[C@H]1NC(=O)C1N)C(=O)C(=O)O" [color=lightgrey shape=box style=filled]
	1001 -> "1989 | CC(CS[C@H]1NC(=O)C1N)C(=O)C(=O)O" [label=""]
	"1990 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)OC(C)(C)C)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1002 -> "1990 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)OC(C)(C)C)[C@H]2SC1" [label=""]
	"1991 | CCCS[C@H]1NC(=O)C1N" [color=lightgrey shape=box style=filled]
	1003 -> "1991 | CCCS[C@H]1NC(=O)C1N" [label=""]
	"1992 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	1003 -> "1992 | O=CC(=O)O" [label=""]
	"1993 | C[C]CS[C@H]1[N]C(=O)C1N" [color=lightgrey shape=box style=filled]
	1004 -> "1993 | C[C]CS[C@H]1[N]C(=O)C1N" [label=""]
	"1994 | [C]C(=O)O" [color=lightgrey shape=box style=filled]
	1004 -> "1994 | [C]C(=O)O" [label=""]
	"1995 | CCCS[C@H]1NC(=O)C1N" [color=lightgrey shape=box style=filled]
	1005 -> "1995 | CCCS[C@H]1NC(=O)C1N" [label=""]
	"1996 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	1005 -> "1996 | O=C(O)CO" [label=""]
	"1997 | CCCS[C@@H]1C(NC(=O)OC(C)(C)C)C(=O)N1CC(=O)O" [color=lightgrey shape=box style=filled]
	1006 -> "1997 | CCCS[C@@H]1C(NC(=O)OC(C)(C)C)C(=O)N1CC(=O)O" [label=""]
	"1998 | CCCS[C@@H]1C(N)C(=O)N1C(O)C(=O)O" [color=lightgrey shape=box style=filled]
	1007 -> "1998 | CCCS[C@@H]1C(N)C(=O)N1C(O)C(=O)O" [label=""]
	"1999 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	1008 -> "1999 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"2000 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	1008 -> "2000 | CCC(C)(C)OC(=O)O" [label=""]
	"2001 | CC(C)(C)OC(=O)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	1009 -> "2001 | CC(C)(C)OC(=O)OC(=O)Cl" [label=""]
	"2002 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	1009 -> "2002 | CCC(C)(C)O" [label=""]
	"2003 | CC(C)(C)OC(=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	1010 -> "2003 | CC(C)(C)OC(=O)OC(=O)O" [label=""]
	"2004 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	1010 -> "2004 | CCC(C)(C)O" [label=""]
	"2005 | CCC(C)(C)OC(=O)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	1011 -> "2005 | CCC(C)(C)OC(=O)OC(=O)Cl" [label=""]
	"2006 | CC(C)(C)O" [color=lightyellow shape=box style=filled]
	1011 -> "2006 | CC(C)(C)O" [label=""]
	"2007 | CC(C)(C)OC(=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	1012 -> "2007 | CC(C)(C)OC(=O)OC(=O)O" [label=""]
	"2008 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	1012 -> "2008 | CCC(C)(C)O" [label=""]
	"2009 | CC(C)(C)OC(=O)O[C]=O" [color=lightgrey shape=box style=filled]
	1013 -> "2009 | CC(C)(C)OC(=O)O[C]=O" [label=""]
	"2010 | CCC(C)(C)[O]" [color=lightgrey shape=box style=filled]
	1013 -> "2010 | CCC(C)(C)[O]" [label=""]
	"2011 | CC(C)(C)O" [color=lightyellow shape=box style=filled]
	1014 -> "2011 | CC(C)(C)O" [label=""]
	"2012 | CCC(C)(C)OC(=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	1014 -> "2012 | CCC(C)(C)OC(=O)OC(=O)O" [label=""]
	"2013 | CC(C)(C)OC(=O)OC=O" [color=lightgrey shape=box style=filled]
	1015 -> "2013 | CC(C)(C)OC(=O)OC=O" [label=""]
	"2014 | CC(Br)C(C)(C)O" [color=lightyellow shape=box style=filled]
	1015 -> "2014 | CC(Br)C(C)(C)O" [label=""]
	"2015 | CC(C)(C)OC(=O)OC(=O)Br" [color=lightgrey shape=box style=filled]
	1016 -> "2015 | CC(C)(C)OC(=O)OC(=O)Br" [label=""]
	"2016 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	1016 -> "2016 | CCC(C)(C)O" [label=""]
	"2017 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1017 -> "2017 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"2018 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1017 -> "2018 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [label=""]
	"2019 | Nc1nc(C(O)C(=O)Cl)cs1" [color=lightgrey shape=box style=filled]
	1018 -> "2019 | Nc1nc(C(O)C(=O)Cl)cs1" [label=""]
	"2020 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1018 -> "2020 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [label=""]
	"2021 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1019 -> "2021 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [label=""]
	"2022 | Nc1nc(C=O)cs1" [color=lightyellow shape=box style=filled]
	1019 -> "2022 | Nc1nc(C=O)cs1" [label=""]
	"2023 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)C(=O)C(=O)O" [color=lightgrey shape=box style=filled]
	1020 -> "2023 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)C(=O)C(=O)O" [label=""]
	"2024 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)CC(=O)O" [color=lightgrey shape=box style=filled]
	1021 -> "2024 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)CC(=O)O" [label=""]
	"2025 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1022 -> "2025 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)O)[C@H]2SC1" [label=""]
	"2026 | Nc1nc(C=O)cs1" [color=lightyellow shape=box style=filled]
	1022 -> "2026 | Nc1nc(C=O)cs1" [label=""]
	"2027 | Nc1nc(CO)cs1" [color=lightyellow shape=box style=filled]
	1023 -> "2027 | Nc1nc(CO)cs1" [label=""]
	"2028 | CC1=C(C(=O)O)N2C(=O)C(N=C=O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1023 -> "2028 | CC1=C(C(=O)O)N2C(=O)C(N=C=O)[C@H]2SC1" [label=""]
	"2029 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1024 -> "2029 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [label=""]
	"2030 | Nc1nc(C(=O)O)cs1" [color=lightyellow shape=box style=filled]
	1024 -> "2030 | Nc1nc(C(=O)O)cs1" [label=""]
	"2031 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(O)C(=O)O" [color=lightgrey shape=box style=filled]
	1025 -> "2031 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(O)C(=O)O" [label=""]
	"2032 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(Cl)C(=O)O" [color=lightgrey shape=box style=filled]
	1026 -> "2032 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(Cl)C(=O)O" [label=""]
	"2033 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1027 -> "2033 | CCC(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"2034 | CC1=CN2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1027 -> "2034 | CC1=CN2C(=O)C(N)[C@H]2SC1" [label=""]
	"2035 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	1028 -> "2035 | CCC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"2036 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1028 -> "2036 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"2037 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	1029 -> "2037 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"2038 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1029 -> "2038 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"2039 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	1029 -> "2039 | CCC(C)(C)OC(=O)O" [label=""]
	"2040 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1030 -> "2040 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"2041 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	1030 -> "2041 | CCC(C)(C)OC(=O)O" [label=""]
	"2042 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1031 -> "2042 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"2043 | CCC(C)(C)OCO" [color=lightgrey shape=box style=filled]
	1031 -> "2043 | CCC(C)(C)OCO" [label=""]
	"2044 | CC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	1032 -> "2044 | CC(C)(C)OC(=O)O" [label=""]
	"2045 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1032 -> "2045 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"2046 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	1032 -> "2046 | CCC(C)(C)OC(=O)O" [label=""]
	"2047 | CC(C)(C)OC(=O)Cl" [color=lightyellow shape=box style=filled]
	1033 -> "2047 | CC(C)(C)OC(=O)Cl" [label=""]
	"2048 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1033 -> "2048 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"2049 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	1033 -> "2049 | CCC(C)(C)OC(=O)O" [label=""]
	"2050 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1034 -> "2050 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"2051 | CC(C)(C)O[C]=O" [color=lightgrey shape=box style=filled]
	1034 -> "2051 | CC(C)(C)O[C]=O" [label=""]
	"2052 | CCC(C)(C)OC([O])=O" [color=lightgrey shape=box style=filled]
	1034 -> "2052 | CCC(C)(C)OC([O])=O" [label=""]
	"2053 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1035 -> "2053 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"2054 | CC(C)(C)O[C]=O" [color=lightgrey shape=box style=filled]
	1035 -> "2054 | CC(C)(C)O[C]=O" [label=""]
	"2055 | CCC(C)(C)OC([O])=O" [color=lightgrey shape=box style=filled]
	1035 -> "2055 | CCC(C)(C)OC([O])=O" [label=""]
	"2056 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1036 -> "2056 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"2057 | CC(C)(C)OC([O])=O" [color=lightgrey shape=box style=filled]
	1036 -> "2057 | CC(C)(C)OC([O])=O" [label=""]
	"2058 | CC(C)(C)O[C]=O" [color=lightgrey shape=box style=filled]
	1036 -> "2058 | CC(C)(C)O[C]=O" [label=""]
	"2059 | CCC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	1036 -> "2059 | CCC(C)(C)OC(=O)O" [label=""]
	"2060 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1037 -> "2060 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"2061 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1037 -> "2061 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [label=""]
	"2062 | Nc1nc(C(O)C(=O)Cl)cs1" [color=lightgrey shape=box style=filled]
	1038 -> "2062 | Nc1nc(C(O)C(=O)Cl)cs1" [label=""]
	"2063 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1038 -> "2063 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [label=""]
	"2064 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1039 -> "2064 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [label=""]
	"2065 | Nc1nc(C=O)cs1" [color=lightyellow shape=box style=filled]
	1039 -> "2065 | Nc1nc(C=O)cs1" [label=""]
	"2066 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)C(=O)C(=O)O" [color=lightgrey shape=box style=filled]
	1040 -> "2066 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)C(=O)C(=O)O" [label=""]
	"2067 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)CC(=O)O" [color=lightgrey shape=box style=filled]
	1041 -> "2067 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)CC(=O)O" [label=""]
	"2068 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1042 -> "2068 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)O)[C@H]2SC1" [label=""]
	"2069 | Nc1nc(C=O)cs1" [color=lightyellow shape=box style=filled]
	1042 -> "2069 | Nc1nc(C=O)cs1" [label=""]
	"2070 | Nc1nc(CO)cs1" [color=lightyellow shape=box style=filled]
	1043 -> "2070 | Nc1nc(CO)cs1" [label=""]
	"2071 | CC1=C(C(=O)O)N2C(=O)C(N=C=O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1043 -> "2071 | CC1=C(C(=O)O)N2C(=O)C(N=C=O)[C@H]2SC1" [label=""]
	"2072 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1044 -> "2072 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [label=""]
	"2073 | Nc1nc(C(=O)O)cs1" [color=lightyellow shape=box style=filled]
	1044 -> "2073 | Nc1nc(C(=O)O)cs1" [label=""]
	"2074 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(O)C(=O)O" [color=lightgrey shape=box style=filled]
	1045 -> "2074 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(O)C(=O)O" [label=""]
	"2075 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(Cl)C(=O)O" [color=lightgrey shape=box style=filled]
	1046 -> "2075 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(Cl)C(=O)O" [label=""]
	"2076 | O=C=O" [color=lightyellow shape=box style=filled]
	1047 -> "2076 | O=C=O" [label=""]
	"2077 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	1047 -> "2077 | CCC(C)(C)O" [label=""]
	"2078 | O=C(O)O" [color=lightyellow shape=box style=filled]
	1048 -> "2078 | O=C(O)O" [label=""]
	"2079 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	1048 -> "2079 | CCC(C)(C)O" [label=""]
	"2080 | CCC(C)(C)Cl" [color=lightyellow shape=box style=filled]
	1049 -> "2080 | CCC(C)(C)Cl" [label=""]
	"2081 | O=C(O)O" [color=lightyellow shape=box style=filled]
	1049 -> "2081 | O=C(O)O" [label=""]
	"2082 | CC(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	1050 -> "2082 | CC(C)OC(=O)O" [label=""]
	"2083 | CCI" [color=lightyellow shape=box style=filled]
	1050 -> "2083 | CCI" [label=""]
	"2084 | O=C(O)O" [color=lightyellow shape=box style=filled]
	1051 -> "2084 | O=C(O)O" [label=""]
	"2085 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	1051 -> "2085 | CCC(C)(C)O" [label=""]
	"2086 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	1052 -> "2086 | O=C(O)Cl" [label=""]
	"2087 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	1052 -> "2087 | CCC(C)(C)O" [label=""]
	"2088 | CCO" [color=lightyellow shape=box style=filled]
	1053 -> "2088 | CCO" [label=""]
	"2089 | CC(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	1053 -> "2089 | CC(C)OC(=O)O" [label=""]
	"2090 | CCOP(=O)(OCC)OC(=O)OC(C)C" [color=lightgrey shape=box style=filled]
	1054 -> "2090 | CCOP(=O)(OCC)OC(=O)OC(C)C" [label=""]
	"2091 | CCI" [color=lightyellow shape=box style=filled]
	1054 -> "2091 | CCI" [label=""]
	"2092 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	1055 -> "2092 | Nc1nccs1" [label=""]
	"2093 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	1055 -> "2093 | O=CC(=O)O" [label=""]
	"2094 | Nc1nc(CO)cs1" [color=lightyellow shape=box style=filled]
	1056 -> "2094 | Nc1nc(CO)cs1" [label=""]
	"2095 | O=C=O" [color=lightyellow shape=box style=filled]
	1056 -> "2095 | O=C=O" [label=""]
	"2096 | O=C(O)C(=O)O" [color=lightyellow shape=box style=filled]
	1057 -> "2096 | O=C(O)C(=O)O" [label=""]
	"2097 | Nc1nccs1" [color=lightyellow shape=box style=filled]
	1057 -> "2097 | Nc1nccs1" [label=""]
	"2098 | O=C(O)C(O)c1csc([N+](=O)[O-])n1" [color=lightgrey shape=box style=filled]
	1058 -> "2098 | O=C(O)C(O)c1csc([N+](=O)[O-])n1" [label=""]
	"2099 | Nc1nc(Br)cs1" [color=lightyellow shape=box style=filled]
	1059 -> "2099 | Nc1nc(Br)cs1" [label=""]
	"2100 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	1059 -> "2100 | O=C(O)CO" [label=""]
	"2101 | Nc1nc(C(=O)C(=O)O)cs1" [color=lightyellow shape=box style=filled]
	1060 -> "2101 | Nc1nc(C(=O)C(=O)O)cs1" [label=""]
	"2102 | O" [color=lightyellow shape=box style=filled]
	1060 -> "2102 | O" [label=""]
	"2103 | Nc1nc(Cl)cs1" [color=lightyellow shape=box style=filled]
	1061 -> "2103 | Nc1nc(Cl)cs1" [label=""]
	"2104 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	1061 -> "2104 | O=C(O)CO" [label=""]
	"2105 | O=CO" [color=lightyellow shape=box style=filled]
	1062 -> "2105 | O=CO" [label=""]
	"2106 | Nc1nc(C=O)cs1" [color=lightyellow shape=box style=filled]
	1062 -> "2106 | Nc1nc(C=O)cs1" [label=""]
	"2107 | O=C(O)C(O)c1csc(N[O-])n1" [color=lightgrey shape=box style=filled]
	1063 -> "2107 | O=C(O)C(O)c1csc(N[O-])n1" [label=""]
	"2108 | Nc1nc(C(=O)C(=O)O)cs1" [color=lightyellow shape=box style=filled]
	1064 -> "2108 | Nc1nc(C(=O)C(=O)O)cs1" [label=""]
	"2109 | OO" [color=lightyellow shape=box style=filled]
	1064 -> "2109 | OO" [label=""]
	"2110 | CC1=C(C(=O)O)N[C@@H](C(N)C(=O)O)SC1" [color=lightgrey shape=box style=filled]
	1065 -> "2110 | CC1=C(C(=O)O)N[C@@H](C(N)C(=O)O)SC1" [label=""]
	"2111 | O=C=O" [color=lightyellow shape=box style=filled]
	1066 -> "2111 | O=C=O" [label=""]
	"2112 | CC1=CN2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1066 -> "2112 | CC1=CN2C(=O)C(N)[C@H]2SC1" [label=""]
	"2113 | CC(CS[C@H]1NC(=O)C1N)CC(=O)O" [color=lightgrey shape=box style=filled]
	1067 -> "2113 | CC(CS[C@H]1NC(=O)C1N)CC(=O)O" [label=""]
	"2114 | CC(CS[C@H]1NC(=O)C1N)C(=O)C(=O)O" [color=lightgrey shape=box style=filled]
	1068 -> "2114 | CC(CS[C@H]1NC(=O)C1N)C(=O)C(=O)O" [label=""]
	"2115 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)OC(C)(C)C)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1069 -> "2115 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)OC(C)(C)C)[C@H]2SC1" [label=""]
	"2116 | CCCS[C@H]1NC(=O)C1N" [color=lightgrey shape=box style=filled]
	1070 -> "2116 | CCCS[C@H]1NC(=O)C1N" [label=""]
	"2117 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	1070 -> "2117 | O=CC(=O)O" [label=""]
	"2118 | C[C]CS[C@H]1[N]C(=O)C1N" [color=lightgrey shape=box style=filled]
	1071 -> "2118 | C[C]CS[C@H]1[N]C(=O)C1N" [label=""]
	"2119 | [C]C(=O)O" [color=lightgrey shape=box style=filled]
	1071 -> "2119 | [C]C(=O)O" [label=""]
	"2120 | CCCS[C@H]1NC(=O)C1N" [color=lightgrey shape=box style=filled]
	1072 -> "2120 | CCCS[C@H]1NC(=O)C1N" [label=""]
	"2121 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	1072 -> "2121 | O=C(O)CO" [label=""]
	"2122 | CCCS[C@@H]1C(NC(=O)OC(C)(C)C)C(=O)N1CC(=O)O" [color=lightgrey shape=box style=filled]
	1073 -> "2122 | CCCS[C@@H]1C(NC(=O)OC(C)(C)C)C(=O)N1CC(=O)O" [label=""]
	"2123 | CCCS[C@@H]1C(N)C(=O)N1C(O)C(=O)O" [color=lightgrey shape=box style=filled]
	1074 -> "2123 | CCCS[C@@H]1C(N)C(=O)N1C(O)C(=O)O" [label=""]
	"2124 | O=CO" [color=lightyellow shape=box style=filled]
	1075 -> "2124 | O=CO" [label=""]
	"2125 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	1075 -> "2125 | CCC(C)(C)O" [label=""]
	"2126 | CCI" [color=lightyellow shape=box style=filled]
	1076 -> "2126 | CCI" [label=""]
	"2127 | CC(C)OC=O" [color=lightyellow shape=box style=filled]
	1076 -> "2127 | CC(C)OC=O" [label=""]
	"2128 | CN(C)C=O" [color=lightyellow shape=box style=filled]
	1077 -> "2128 | CN(C)C=O" [label=""]
	"2129 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	1077 -> "2129 | CCC(C)(C)O" [label=""]
	"2130 | O=C(OO)c1cccc(Cl)c1" [color=lightyellow shape=box style=filled]
	1078 -> "2130 | O=C(OO)c1cccc(Cl)c1" [label=""]
	"2131 | CCC(C)(C)OC" [color=lightyellow shape=box style=filled]
	1078 -> "2131 | CCC(C)(C)OC" [label=""]
	"2132 | CCBr" [color=lightyellow shape=box style=filled]
	1079 -> "2132 | CCBr" [label=""]
	"2133 | CC(C)OC=O" [color=lightyellow shape=box style=filled]
	1079 -> "2133 | CC(C)OC=O" [label=""]
	"2134 | CCC(C)(C)Cl" [color=lightyellow shape=box style=filled]
	1080 -> "2134 | CCC(C)(C)Cl" [label=""]
	"2135 | O=CO" [color=lightyellow shape=box style=filled]
	1080 -> "2135 | O=CO" [label=""]
	"2136 | CCO" [color=lightyellow shape=box style=filled]
	1081 -> "2136 | CCO" [label=""]
	"2137 | CC(C)OC=O" [color=lightyellow shape=box style=filled]
	1081 -> "2137 | CC(C)OC=O" [label=""]
	"2138 | O=CO" [color=lightyellow shape=box style=filled]
	1082 -> "2138 | O=CO" [label=""]
	"2139 | C=C(C)CC" [color=lightgrey shape=box style=filled]
	1082 -> "2139 | C=C(C)CC" [label=""]
	"2140 | O=CO" [color=lightyellow shape=box style=filled]
	1083 -> "2140 | O=CO" [label=""]
	"2141 | C=C(C)CC" [color=lightgrey shape=box style=filled]
	1083 -> "2141 | C=C(C)CC" [label=""]
	"2142 | CC(=O)C(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1084 -> "2142 | CC(=O)C(C)(C)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"2143 | CC1=CN2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1084 -> "2143 | CC1=CN2C(=O)C(N)[C@H]2SC1" [label=""]
	"2144 | CC(=O)C(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	1085 -> "2144 | CC(=O)C(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"2145 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1085 -> "2145 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"2146 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	1086 -> "2146 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"2147 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1086 -> "2147 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"2148 | CC(=O)C(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	1086 -> "2148 | CC(=O)C(C)(C)OC(=O)O" [label=""]
	"2149 | CC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	1087 -> "2149 | CC(C)(C)OC(=O)O" [label=""]
	"2150 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1087 -> "2150 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"2151 | CC(=O)C(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	1087 -> "2151 | CC(=O)C(C)(C)OC(=O)O" [label=""]
	"2152 | CC(C)(C)OC(=O)Cl" [color=lightyellow shape=box style=filled]
	1088 -> "2152 | CC(C)(C)OC(=O)Cl" [label=""]
	"2153 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1088 -> "2153 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"2154 | CC(=O)C(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	1088 -> "2154 | CC(=O)C(C)(C)OC(=O)O" [label=""]
	"2155 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1089 -> "2155 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"2156 | CC(C)(C)O[C]=O" [color=lightgrey shape=box style=filled]
	1089 -> "2156 | CC(C)(C)O[C]=O" [label=""]
	"2157 | CC(=O)C(C)(C)OC([O])=O" [color=lightgrey shape=box style=filled]
	1089 -> "2157 | CC(=O)C(C)(C)OC([O])=O" [label=""]
	"2158 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1090 -> "2158 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"2159 | CC(=O)C(C)(C)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	1090 -> "2159 | CC(=O)C(C)(C)OC(=O)Cl" [label=""]
	"2160 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1091 -> "2160 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"2161 | CC(C)(C)O[C]=O" [color=lightgrey shape=box style=filled]
	1091 -> "2161 | CC(C)(C)O[C]=O" [label=""]
	"2162 | CC(=O)C(C)(C)OC([O])=O" [color=lightgrey shape=box style=filled]
	1091 -> "2162 | CC(=O)C(C)(C)OC([O])=O" [label=""]
	"2163 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1092 -> "2163 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"2164 | CC(C)(C)OC([O])=O" [color=lightgrey shape=box style=filled]
	1092 -> "2164 | CC(C)(C)OC([O])=O" [label=""]
	"2165 | CC(C)(C)O[C]=O" [color=lightgrey shape=box style=filled]
	1092 -> "2165 | CC(C)(C)O[C]=O" [label=""]
	"2166 | CC(=O)C(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	1092 -> "2166 | CC(=O)C(C)(C)OC(=O)O" [label=""]
	"2167 | CC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	1093 -> "2167 | CC(C)(C)OC(=O)O" [label=""]
	"2168 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	1093 -> "2168 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"2169 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1093 -> "2169 | CC1=CN2C(=O)C(NC(=O)C(O)c3csc(N)n3)[C@H]2SC1" [label=""]
	"2170 | CC(=O)C(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	1093 -> "2170 | CC(=O)C(C)(C)OC(=O)O" [label=""]
	"2171 | O=C=O" [color=lightyellow shape=box style=filled]
	1094 -> "2171 | O=C=O" [label=""]
	"2172 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	1094 -> "2172 | CCC(C)(C)O" [label=""]
	"2173 | O=C(O)O" [color=lightyellow shape=box style=filled]
	1095 -> "2173 | O=C(O)O" [label=""]
	"2174 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	1095 -> "2174 | CCC(C)(C)O" [label=""]
	"2175 | CCC(C)(C)Cl" [color=lightyellow shape=box style=filled]
	1096 -> "2175 | CCC(C)(C)Cl" [label=""]
	"2176 | O=C(O)O" [color=lightyellow shape=box style=filled]
	1096 -> "2176 | O=C(O)O" [label=""]
	"2177 | CC(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	1097 -> "2177 | CC(C)OC(=O)O" [label=""]
	"2178 | CCI" [color=lightyellow shape=box style=filled]
	1097 -> "2178 | CCI" [label=""]
	"2179 | O=C(O)O" [color=lightyellow shape=box style=filled]
	1098 -> "2179 | O=C(O)O" [label=""]
	"2180 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	1098 -> "2180 | CCC(C)(C)O" [label=""]
	"2181 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	1099 -> "2181 | O=C(O)Cl" [label=""]
	"2182 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	1099 -> "2182 | CCC(C)(C)O" [label=""]
	"2183 | CCO" [color=lightyellow shape=box style=filled]
	1100 -> "2183 | CCO" [label=""]
	"2184 | CC(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	1100 -> "2184 | CC(C)OC(=O)O" [label=""]
	"2185 | CCOP(=O)(OCC)OC(=O)OC(C)C" [color=lightgrey shape=box style=filled]
	1101 -> "2185 | CCOP(=O)(OCC)OC(=O)OC(C)C" [label=""]
	"2186 | CCI" [color=lightyellow shape=box style=filled]
	1101 -> "2186 | CCI" [label=""]
	"2187 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1102 -> "2187 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"2188 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1102 -> "2188 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [label=""]
	"2189 | Nc1nc(C(O)C(=O)Cl)cs1" [color=lightgrey shape=box style=filled]
	1103 -> "2189 | Nc1nc(C(O)C(=O)Cl)cs1" [label=""]
	"2190 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1103 -> "2190 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [label=""]
	"2191 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1104 -> "2191 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [label=""]
	"2192 | Nc1nc(C=O)cs1" [color=lightyellow shape=box style=filled]
	1104 -> "2192 | Nc1nc(C=O)cs1" [label=""]
	"2193 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)C(=O)C(=O)O" [color=lightgrey shape=box style=filled]
	1105 -> "2193 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)C(=O)C(=O)O" [label=""]
	"2194 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)CC(=O)O" [color=lightgrey shape=box style=filled]
	1106 -> "2194 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)CC(=O)O" [label=""]
	"2195 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1107 -> "2195 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)O)[C@H]2SC1" [label=""]
	"2196 | Nc1nc(C=O)cs1" [color=lightyellow shape=box style=filled]
	1107 -> "2196 | Nc1nc(C=O)cs1" [label=""]
	"2197 | Nc1nc(CO)cs1" [color=lightyellow shape=box style=filled]
	1108 -> "2197 | Nc1nc(CO)cs1" [label=""]
	"2198 | CC1=C(C(=O)O)N2C(=O)C(N=C=O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1108 -> "2198 | CC1=C(C(=O)O)N2C(=O)C(N=C=O)[C@H]2SC1" [label=""]
	"2199 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1109 -> "2199 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [label=""]
	"2200 | Nc1nc(C(=O)O)cs1" [color=lightyellow shape=box style=filled]
	1109 -> "2200 | Nc1nc(C(=O)O)cs1" [label=""]
	"2201 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(O)C(=O)O" [color=lightgrey shape=box style=filled]
	1110 -> "2201 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(O)C(=O)O" [label=""]
	"2202 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(Cl)C(=O)O" [color=lightgrey shape=box style=filled]
	1111 -> "2202 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(Cl)C(=O)O" [label=""]
	"2203 | C=O" [color=lightyellow shape=box style=filled]
	1112 -> "2203 | C=O" [label=""]
	"2204 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	1112 -> "2204 | CCC(C)(C)O" [label=""]
	"2205 | O=CO" [color=lightyellow shape=box style=filled]
	1113 -> "2205 | O=CO" [label=""]
	"2206 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	1113 -> "2206 | CCC(C)(C)O" [label=""]
	"2207 | OCO" [color=lightyellow shape=box style=filled]
	1114 -> "2207 | OCO" [label=""]
	"2208 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	1114 -> "2208 | CCC(C)(C)O" [label=""]
	"2209 | CCC(C)(C)Cl" [color=lightyellow shape=box style=filled]
	1115 -> "2209 | CCC(C)(C)Cl" [label=""]
	"2210 | OCO" [color=lightyellow shape=box style=filled]
	1115 -> "2210 | OCO" [label=""]
	"2211 | CO" [color=lightyellow shape=box style=filled]
	1116 -> "2211 | CO" [label=""]
	"2212 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	1116 -> "2212 | CCC(C)(C)O" [label=""]
	"2213 | CO" [color=lightyellow shape=box style=filled]
	1117 -> "2213 | CO" [label=""]
	"2214 | O" [color=lightyellow shape=box style=filled]
	1117 -> "2214 | O" [label=""]
	"2215 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	1117 -> "2215 | CCC(C)(C)O" [label=""]
	"2216 | O=CO" [color=lightyellow shape=box style=filled]
	1118 -> "2216 | O=CO" [label=""]
	"2217 | CCC(C)C" [color=lightyellow shape=box style=filled]
	1118 -> "2217 | CCC(C)C" [label=""]
	"2218 | OC[P+](c1ccccc1)(c1ccccc1)c1ccccc1" [color=lightyellow shape=box style=filled]
	1119 -> "2218 | OC[P+](c1ccccc1)(c1ccccc1)c1ccccc1" [label=""]
	"2219 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	1119 -> "2219 | CCC(C)(C)O" [label=""]
	"2220 | C=O" [color=lightyellow shape=box style=filled]
	1120 -> "2220 | C=O" [label=""]
	"2221 | CC(=O)C(C)(C)O" [color=lightyellow shape=box style=filled]
	1120 -> "2221 | CC(=O)C(C)(C)O" [label=""]
	"2222 | O=CO" [color=lightyellow shape=box style=filled]
	1121 -> "2222 | O=CO" [label=""]
	"2223 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	1121 -> "2223 | CCC(C)(C)O" [label=""]
	"2224 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1122 -> "2224 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"2225 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1122 -> "2225 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [label=""]
	"2226 | Nc1nc(C(O)C(=O)Cl)cs1" [color=lightgrey shape=box style=filled]
	1123 -> "2226 | Nc1nc(C(O)C(=O)Cl)cs1" [label=""]
	"2227 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1123 -> "2227 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [label=""]
	"2228 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1124 -> "2228 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [label=""]
	"2229 | Nc1nc(C=O)cs1" [color=lightyellow shape=box style=filled]
	1124 -> "2229 | Nc1nc(C=O)cs1" [label=""]
	"2230 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)C(=O)C(=O)O" [color=lightgrey shape=box style=filled]
	1125 -> "2230 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)C(=O)C(=O)O" [label=""]
	"2231 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)CC(=O)O" [color=lightgrey shape=box style=filled]
	1126 -> "2231 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)CC(=O)O" [label=""]
	"2232 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1127 -> "2232 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)O)[C@H]2SC1" [label=""]
	"2233 | Nc1nc(C=O)cs1" [color=lightyellow shape=box style=filled]
	1127 -> "2233 | Nc1nc(C=O)cs1" [label=""]
	"2234 | Nc1nc(CO)cs1" [color=lightyellow shape=box style=filled]
	1128 -> "2234 | Nc1nc(CO)cs1" [label=""]
	"2235 | CC1=C(C(=O)O)N2C(=O)C(N=C=O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1128 -> "2235 | CC1=C(C(=O)O)N2C(=O)C(N=C=O)[C@H]2SC1" [label=""]
	"2236 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1129 -> "2236 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [label=""]
	"2237 | Nc1nc(C(=O)O)cs1" [color=lightyellow shape=box style=filled]
	1129 -> "2237 | Nc1nc(C(=O)O)cs1" [label=""]
	"2238 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(O)C(=O)O" [color=lightgrey shape=box style=filled]
	1130 -> "2238 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(O)C(=O)O" [label=""]
	"2239 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(Cl)C(=O)O" [color=lightgrey shape=box style=filled]
	1131 -> "2239 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(Cl)C(=O)O" [label=""]
	"2240 | CC(C)(C)O" [color=lightyellow shape=box style=filled]
	1132 -> "2240 | CC(C)(C)O" [label=""]
	"2241 | O=C=O" [color=lightyellow shape=box style=filled]
	1132 -> "2241 | O=C=O" [label=""]
	"2242 | CC(C)(C)Cl" [color=lightyellow shape=box style=filled]
	1133 -> "2242 | CC(C)(C)Cl" [label=""]
	"2243 | O=C(O)O" [color=lightyellow shape=box style=filled]
	1133 -> "2243 | O=C(O)O" [label=""]
	"2244 | O=C(O)O" [color=lightyellow shape=box style=filled]
	1134 -> "2244 | O=C(O)O" [label=""]
	"2245 | CC(C)(C)Br" [color=lightyellow shape=box style=filled]
	1134 -> "2245 | CC(C)(C)Br" [label=""]
	"2246 | O=C(OO)c1cccc(Cl)c1" [color=lightyellow shape=box style=filled]
	1135 -> "2246 | O=C(OO)c1cccc(Cl)c1" [label=""]
	"2247 | CC(C)(C)OCO" [color=lightgrey shape=box style=filled]
	1135 -> "2247 | CC(C)(C)OCO" [label=""]
	"2248 | CC(C)(C)O" [color=lightyellow shape=box style=filled]
	1136 -> "2248 | CC(C)(C)O" [label=""]
	"2249 | O=C(O)O" [color=lightyellow shape=box style=filled]
	1136 -> "2249 | O=C(O)O" [label=""]
	"2250 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	1137 -> "2250 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"2251 | O" [color=lightyellow shape=box style=filled]
	1137 -> "2251 | O" [label=""]
	"2252 | CI" [color=lightyellow shape=box style=filled]
	1138 -> "2252 | CI" [label=""]
	"2253 | CCOP(=O)(OCC)OC(=O)OC(C)C" [color=lightgrey shape=box style=filled]
	1138 -> "2253 | CCOP(=O)(OCC)OC(=O)OC(C)C" [label=""]
	"2254 | CC(C)(C)O" [color=lightyellow shape=box style=filled]
	1139 -> "2254 | CC(C)(C)O" [label=""]
	"2255 | O=C(O)O" [color=lightyellow shape=box style=filled]
	1139 -> "2255 | O=C(O)O" [label=""]
	"2256 | CC(C)(C)OC(=O)OC(O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	1140 -> "2256 | CC(C)(C)OC(=O)OC(O)OC(C)(C)C" [label=""]
	"2257 | O" [color=lightyellow shape=box style=filled]
	1140 -> "2257 | O" [label=""]
	"2258 | CO" [color=lightyellow shape=box style=filled]
	1141 -> "2258 | CO" [label=""]
	"2259 | CC(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	1141 -> "2259 | CC(C)OC(=O)O" [label=""]
	"2260 | O=C=O" [color=lightyellow shape=box style=filled]
	1142 -> "2260 | O=C=O" [label=""]
	"2261 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	1142 -> "2261 | CCC(C)(C)O" [label=""]
	"2262 | O=C(O)O" [color=lightyellow shape=box style=filled]
	1143 -> "2262 | O=C(O)O" [label=""]
	"2263 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	1143 -> "2263 | CCC(C)(C)O" [label=""]
	"2264 | CCC(C)(C)Cl" [color=lightyellow shape=box style=filled]
	1144 -> "2264 | CCC(C)(C)Cl" [label=""]
	"2265 | O=C(O)O" [color=lightyellow shape=box style=filled]
	1144 -> "2265 | O=C(O)O" [label=""]
	"2266 | CC(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	1145 -> "2266 | CC(C)OC(=O)O" [label=""]
	"2267 | CCI" [color=lightyellow shape=box style=filled]
	1145 -> "2267 | CCI" [label=""]
	"2268 | O=C(O)O" [color=lightyellow shape=box style=filled]
	1146 -> "2268 | O=C(O)O" [label=""]
	"2269 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	1146 -> "2269 | CCC(C)(C)O" [label=""]
	"2270 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	1147 -> "2270 | O=C(O)Cl" [label=""]
	"2271 | CCC(C)(C)O" [color=lightyellow shape=box style=filled]
	1147 -> "2271 | CCC(C)(C)O" [label=""]
	"2272 | CCO" [color=lightyellow shape=box style=filled]
	1148 -> "2272 | CCO" [label=""]
	"2273 | CC(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	1148 -> "2273 | CC(C)OC(=O)O" [label=""]
	"2274 | CCOP(=O)(OCC)OC(=O)OC(C)C" [color=lightgrey shape=box style=filled]
	1149 -> "2274 | CCOP(=O)(OCC)OC(=O)OC(C)C" [label=""]
	"2275 | CCI" [color=lightyellow shape=box style=filled]
	1149 -> "2275 | CCI" [label=""]
	"2276 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1150 -> "2276 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"2277 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1150 -> "2277 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [label=""]
	"2278 | Nc1nc(C(O)C(=O)Cl)cs1" [color=lightgrey shape=box style=filled]
	1151 -> "2278 | Nc1nc(C(O)C(=O)Cl)cs1" [label=""]
	"2279 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1151 -> "2279 | CC1=C(C(=O)O)N2C(=O)C(N)[C@H]2SC1" [label=""]
	"2280 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1152 -> "2280 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [label=""]
	"2281 | Nc1nc(C=O)cs1" [color=lightyellow shape=box style=filled]
	1152 -> "2281 | Nc1nc(C=O)cs1" [label=""]
	"2282 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)C(=O)C(=O)O" [color=lightgrey shape=box style=filled]
	1153 -> "2282 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)C(=O)C(=O)O" [label=""]
	"2283 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)CC(=O)O" [color=lightgrey shape=box style=filled]
	1154 -> "2283 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)CC(=O)O" [label=""]
	"2284 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1155 -> "2284 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)O)[C@H]2SC1" [label=""]
	"2285 | Nc1nc(C=O)cs1" [color=lightyellow shape=box style=filled]
	1155 -> "2285 | Nc1nc(C=O)cs1" [label=""]
	"2286 | Nc1nc(CO)cs1" [color=lightyellow shape=box style=filled]
	1156 -> "2286 | Nc1nc(CO)cs1" [label=""]
	"2287 | CC1=C(C(=O)O)N2C(=O)C(N=C=O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1156 -> "2287 | CC1=C(C(=O)O)N2C(=O)C(N=C=O)[C@H]2SC1" [label=""]
	"2288 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1157 -> "2288 | CC1=C(C(=O)O)N2C(=O)C(NC=O)[C@H]2SC1" [label=""]
	"2289 | Nc1nc(C(=O)O)cs1" [color=lightyellow shape=box style=filled]
	1157 -> "2289 | Nc1nc(C(=O)O)cs1" [label=""]
	"2290 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(O)C(=O)O" [color=lightgrey shape=box style=filled]
	1158 -> "2290 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(O)C(=O)O" [label=""]
	"2291 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(Cl)C(=O)O" [color=lightgrey shape=box style=filled]
	1159 -> "2291 | CC(CS[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1)=C(Cl)C(=O)O" [label=""]
	"2292 | CC(Br)C(C)(C=O)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	1160 -> "2292 | CC(Br)C(C)(C=O)OC(=O)Cl" [label=""]
	"2293 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1160 -> "2293 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"2294 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(CO)cs1" [color=lightgrey shape=box style=filled]
	1161 -> "2294 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(CO)cs1" [label=""]
	"2295 | O=C=O" [color=lightyellow shape=box style=filled]
	1161 -> "2295 | O=C=O" [label=""]
	"2296 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1162 -> "2296 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"2297 | O=CO" [color=lightyellow shape=box style=filled]
	1162 -> "2297 | O=CO" [label=""]
	"2298 | CC(Br)C(C)(O)C=O" [color=lightgrey shape=box style=filled]
	1162 -> "2298 | CC(Br)C(C)(O)C=O" [label=""]
	"2299 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1163 -> "2299 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"2300 | CC(Br)C(C)(C=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	1163 -> "2300 | CC(Br)C(C)(C=O)OC(=O)O" [label=""]
	"2301 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	1164 -> "2301 | O=C1CCC(=O)N1Br" [label=""]
	"2302 | CCC(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1164 -> "2302 | CCC(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"2303 | CC(Br)C(C)(C=O)OC(=O)Nc1nccs1" [color=lightgrey shape=box style=filled]
	1165 -> "2303 | CC(Br)C(C)(C=O)OC(=O)Nc1nccs1" [label=""]
	"2304 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	1165 -> "2304 | O=CC(=O)O" [label=""]
	"2305 | O=CO" [color=lightyellow shape=box style=filled]
	1166 -> "2305 | O=CO" [label=""]
	"2306 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C=O)cs1" [color=lightgrey shape=box style=filled]
	1166 -> "2306 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C=O)cs1" [label=""]
	"2307 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	1167 -> "2307 | O=C(O)CO" [label=""]
	"2308 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(Br)cs1" [color=lightgrey shape=box style=filled]
	1167 -> "2308 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(Br)cs1" [label=""]
	"2309 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	1168 -> "2309 | O=C(O)CO" [label=""]
	"2310 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(Cl)cs1" [color=lightgrey shape=box style=filled]
	1168 -> "2310 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(Cl)cs1" [label=""]
	"2311 | NC1C(=O)N[C@@H]1SC=O" [color=lightgrey shape=box style=filled]
	1169 -> "2311 | NC1C(=O)N[C@@H]1SC=O" [label=""]
	"2312 | O=C1CCC(=O)N1[Br+][O+]" [color=lightgrey shape=box style=filled]
	1169 -> "2312 | O=C1CCC(=O)N1[Br+][O+]" [label=""]
	"2313 | [O+][Br+]Cl" [color=lightgrey shape=box style=filled]
	1170 -> "2313 | [O+][Br+]Cl" [label=""]
	"2314 | NC1C(=O)N[C@@H]1SC=O" [color=lightgrey shape=box style=filled]
	1170 -> "2314 | NC1C(=O)N[C@@H]1SC=O" [label=""]
	"2315 | O=CO" [color=lightyellow shape=box style=filled]
	1171 -> "2315 | O=CO" [label=""]
	"2316 | NC1C(=O)N[C@@H]1[S]=[O+]Br" [color=lightgrey shape=box style=filled]
	1171 -> "2316 | NC1C(=O)N[C@@H]1[S]=[O+]Br" [label=""]
	"2317 | NC1C(=O)N[C@@H]1SC=O" [color=lightgrey shape=box style=filled]
	1172 -> "2317 | NC1C(=O)N[C@@H]1SC=O" [label=""]
	"2318 | [O+][Br+]C(Cl)(Cl)Cl" [color=lightgrey shape=box style=filled]
	1172 -> "2318 | [O+][Br+]C(Cl)(Cl)Cl" [label=""]
	"2319 | [O+][Br+]O" [color=lightgrey shape=box style=filled]
	1173 -> "2319 | [O+][Br+]O" [label=""]
	"2320 | NC1C(=O)N[C@@H]1SC=O" [color=lightgrey shape=box style=filled]
	1173 -> "2320 | NC1C(=O)N[C@@H]1SC=O" [label=""]
	"2321 | CN(C)C=O" [color=lightyellow shape=box style=filled]
	1174 -> "2321 | CN(C)C=O" [label=""]
	"2322 | NC1C(=O)N[C@@H]1[S]=[O+]Br" [color=lightgrey shape=box style=filled]
	1174 -> "2322 | NC1C(=O)N[C@@H]1[S]=[O+]Br" [label=""]
	"2323 | NC1C(=O)N[C@@H]1[S](O)C=O" [color=lightgrey shape=box style=filled]
	1175 -> "2323 | NC1C(=O)N[C@@H]1[S](O)C=O" [label=""]
	"2324 | [O+]Br" [color=lightgrey shape=box style=filled]
	1175 -> "2324 | [O+]Br" [label=""]
	"2325 | O=CS(Br)=[O+]Br" [color=lightgrey shape=box style=filled]
	1176 -> "2325 | O=CS(Br)=[O+]Br" [label=""]
	"2326 | NC1CNC1=O" [color=lightyellow shape=box style=filled]
	1176 -> "2326 | NC1CNC1=O" [label=""]
	"2327 | NC1C(=O)N[C@@H]1S(Cl)=[O+]Br" [color=lightgrey shape=box style=filled]
	1177 -> "2327 | NC1C(=O)N[C@@H]1S(Cl)=[O+]Br" [label=""]
	"2328 | C=O" [color=lightyellow shape=box style=filled]
	1177 -> "2328 | C=O" [label=""]
	"2329 | O=CS(Cl)=[O+]Br" [color=lightgrey shape=box style=filled]
	1178 -> "2329 | O=CS(Cl)=[O+]Br" [label=""]
	"2330 | NC1CNC1=O" [color=lightyellow shape=box style=filled]
	1178 -> "2330 | NC1CNC1=O" [label=""]
	"2331 | NC1C(=O)N[C@@H]1[S]=[O+]Br" [color=lightgrey shape=box style=filled]
	1179 -> "2331 | NC1C(=O)N[C@@H]1[S]=[O+]Br" [label=""]
	"2332 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1179 -> "2332 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"2333 | CC(Br)C(C)(C=O)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	1180 -> "2333 | CC(Br)C(C)(C=O)OC(=O)Cl" [label=""]
	"2334 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=[O+]Br)cs1" [color=lightgrey shape=box style=filled]
	1180 -> "2334 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=[O+]Br)cs1" [label=""]
	"2335 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S)cs1" [color=lightgrey shape=box style=filled]
	1181 -> "2335 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S)cs1" [label=""]
	"2336 | [O+][Br+]Cl" [color=lightgrey shape=box style=filled]
	1181 -> "2336 | [O+][Br+]Cl" [label=""]
	"2337 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S)cs1" [color=lightgrey shape=box style=filled]
	1182 -> "2337 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S)cs1" [label=""]
	"2338 | [O+][Br+]O" [color=lightgrey shape=box style=filled]
	1182 -> "2338 | [O+][Br+]O" [label=""]
	"2339 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S)cs1" [color=lightgrey shape=box style=filled]
	1183 -> "2339 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S)cs1" [label=""]
	"2340 | O=C(O[Br+][O+])c1cccc(Cl)c1" [color=lightgrey shape=box style=filled]
	1183 -> "2340 | O=C(O[Br+][O+])c1cccc(Cl)c1" [label=""]
	"2341 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=[O+]Br)cs1" [color=lightgrey shape=box style=filled]
	1184 -> "2341 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=[O+]Br)cs1" [label=""]
	"2342 | CC(Br)C(C)(C=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	1184 -> "2342 | CC(Br)C(C)(C=O)OC(=O)O" [label=""]
	"2343 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S)cs1" [color=lightgrey shape=box style=filled]
	1185 -> "2343 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S)cs1" [label=""]
	"2344 | [O+][Br+]C(Cl)(Cl)Cl" [color=lightgrey shape=box style=filled]
	1185 -> "2344 | [O+][Br+]C(Cl)(Cl)Cl" [label=""]
	"2345 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S)cs1" [color=lightgrey shape=box style=filled]
	1186 -> "2345 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S)cs1" [label=""]
	"2346 | O=C1CCC(=O)N1[Br+][O+]" [color=lightgrey shape=box style=filled]
	1186 -> "2346 | O=C1CCC(=O)N1[Br+][O+]" [label=""]
	"2347 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S)cs1" [color=lightgrey shape=box style=filled]
	1187 -> "2347 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S)cs1" [label=""]
	"2348 | [O+][Br+]O" [color=lightgrey shape=box style=filled]
	1187 -> "2348 | [O+][Br+]O" [label=""]
	"2349 | O=C(O)c1cccc(Cl)c1" [color=lightyellow shape=box style=filled]
	1187 -> "2349 | O=C(O)c1cccc(Cl)c1" [label=""]
	"2350 | O=C(O[O+])c1cccc(Cl)c1" [color=lightgrey shape=box style=filled]
	1188 -> "2350 | O=C(O[O+])c1cccc(Cl)c1" [label=""]
	"2351 | ClBr" [color=lightgrey shape=box style=filled]
	1188 -> "2351 | ClBr" [label=""]
	"2352 | ClC(Cl)(Cl)Cl" [color=lightyellow shape=box style=filled]
	1189 -> "2352 | ClC(Cl)(Cl)Cl" [label=""]
	"2353 | [O+]Br" [color=lightgrey shape=box style=filled]
	1189 -> "2353 | [O+]Br" [label=""]
	"2354 | Cl[Br+]" [color=lightgrey shape=box style=filled]
	1190 -> "2354 | Cl[Br+]" [label=""]
	"2355 | [O+]" [color=lightgrey shape=box style=filled]
	1190 -> "2355 | [O+]" [label=""]
	"2356 | Br[Cl+]Br" [color=lightgrey shape=box style=filled]
	1191 -> "2356 | Br[Cl+]Br" [label=""]
	"2357 | [O+]" [color=lightgrey shape=box style=filled]
	1191 -> "2357 | [O+]" [label=""]
	"2358 | [O+]C(Cl)(Cl)Cl" [color=lightgrey shape=box style=filled]
	1192 -> "2358 | [O+]C(Cl)(Cl)Cl" [label=""]
	"2359 | ClBr" [color=lightgrey shape=box style=filled]
	1192 -> "2359 | ClBr" [label=""]
	"2360 | [O+][Br+]" [color=lightgrey shape=box style=filled]
	1193 -> "2360 | [O+][Br+]" [label=""]
	"2361 | [Cl]" [color=lightyellow shape=box style=filled]
	1193 -> "2361 | [Cl]" [label=""]
	"2362 | O=C1CCC(=O)N1Cl" [color=lightyellow shape=box style=filled]
	1194 -> "2362 | O=C1CCC(=O)N1Cl" [label=""]
	"2363 | [O+]Br" [color=lightgrey shape=box style=filled]
	1194 -> "2363 | [O+]Br" [label=""]
	"2364 | O=C(O[O+])c1cccc(Cl)c1" [color=lightgrey shape=box style=filled]
	1195 -> "2364 | O=C(O[O+])c1cccc(Cl)c1" [label=""]
	"2365 | Br[Cl+]Br" [color=lightgrey shape=box style=filled]
	1195 -> "2365 | Br[Cl+]Br" [label=""]
	"2366 | NC1C(=O)N[C@@H]1SC=O" [color=lightgrey shape=box style=filled]
	1196 -> "2366 | NC1C(=O)N[C@@H]1SC=O" [label=""]
	"2367 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1196 -> "2367 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"2368 | CC(Br)C(C)(C=O)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	1197 -> "2368 | CC(Br)C(C)(C=O)OC(=O)Cl" [label=""]
	"2369 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [color=lightgrey shape=box style=filled]
	1197 -> "2369 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [label=""]
	"2370 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [color=lightgrey shape=box style=filled]
	1198 -> "2370 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [label=""]
	"2371 | CC(Br)C(C)(C=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	1198 -> "2371 | CC(Br)C(C)(C=O)OC(=O)O" [label=""]
	"2372 | CC(Br)C(C)(C=O)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	1199 -> "2372 | CC(Br)C(C)(C=O)OC(=O)Cl" [label=""]
	"2373 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)Cl)cs1" [color=lightgrey shape=box style=filled]
	1199 -> "2373 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)Cl)cs1" [label=""]
	"2374 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1200 -> "2374 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)O)cs1" [label=""]
	"2375 | CC(Br)C(C)(C=O)OC=O" [color=lightgrey shape=box style=filled]
	1200 -> "2375 | CC(Br)C(C)(C=O)OC=O" [label=""]
	"2376 | CC(Br)C(C)(C=O)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	1201 -> "2376 | CC(Br)C(C)(C=O)OC(=O)Cl" [label=""]
	"2377 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1201 -> "2377 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)O)cs1" [label=""]
	"2378 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)Cl)cs1" [color=lightgrey shape=box style=filled]
	1202 -> "2378 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)Cl)cs1" [label=""]
	"2379 | CC(Br)C(C)(C=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	1202 -> "2379 | CC(Br)C(C)(C=O)OC(=O)O" [label=""]
	"2380 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1203 -> "2380 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)O)cs1" [label=""]
	"2381 | CC(Br)C(C)(C=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	1203 -> "2381 | CC(Br)C(C)(C=O)OC(=O)O" [label=""]
	"2382 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1204 -> "2382 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)O)cs1" [label=""]
	"2383 | CC(Br)C(C)(C=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	1204 -> "2383 | CC(Br)C(C)(C=O)OC(=O)O" [label=""]
	"2384 | O=C(Cl)Cl" [color=lightyellow shape=box style=filled]
	1205 -> "2384 | O=C(Cl)Cl" [label=""]
	"2385 | CC(Br)C(C)(O)C=O" [color=lightgrey shape=box style=filled]
	1205 -> "2385 | CC(Br)C(C)(O)C=O" [label=""]
	"2386 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	1206 -> "2386 | O=C1CCC(=O)N1Br" [label=""]
	"2387 | CCC(C)(C=O)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	1206 -> "2387 | CCC(C)(C=O)OC(=O)Cl" [label=""]
	"2388 | CC(Br)Br" [color=lightyellow shape=box style=filled]
	1207 -> "2388 | CC(Br)Br" [label=""]
	"2389 | CC(C=O)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	1207 -> "2389 | CC(C=O)OC(=O)Cl" [label=""]
	"2390 | CN(C)C=O" [color=lightyellow shape=box style=filled]
	1208 -> "2390 | CN(C)C=O" [label=""]
	"2391 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	1208 -> "2391 | O=C(O)Cl" [label=""]
	"2392 | CCC(C)Br" [color=lightyellow shape=box style=filled]
	1208 -> "2392 | CCC(C)Br" [label=""]
	"2393 | CC(Br)B(O)O" [color=lightgrey shape=box style=filled]
	1209 -> "2393 | CC(Br)B(O)O" [label=""]
	"2394 | CC(C=O)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	1209 -> "2394 | CC(C=O)OC(=O)Cl" [label=""]
	"2395 | CC(Br)C(C)C(=O)O" [color=lightgrey shape=box style=filled]
	1210 -> "2395 | CC(Br)C(C)C(=O)O" [label=""]
	"2396 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	1210 -> "2396 | O=C(O)Cl" [label=""]
	"2397 | CC(Br)Br" [color=lightyellow shape=box style=filled]
	1211 -> "2397 | CC(Br)Br" [label=""]
	"2398 | CCC=O" [color=lightyellow shape=box style=filled]
	1211 -> "2398 | CCC=O" [label=""]
	"2399 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	1211 -> "2399 | O=C(O)Cl" [label=""]
	"2400 | CC(OC(=O)Cl)C(=O)O" [color=lightgrey shape=box style=filled]
	1212 -> "2400 | CC(OC(=O)Cl)C(=O)O" [label=""]
	"2401 | CCBr" [color=lightyellow shape=box style=filled]
	1212 -> "2401 | CCBr" [label=""]
	"2402 | CC(Br)C(C)(Br)C=O" [color=lightgrey shape=box style=filled]
	1213 -> "2402 | CC(Br)C(C)(Br)C=O" [label=""]
	"2403 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	1213 -> "2403 | O=C(O)Cl" [label=""]
	"2404 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1214 -> "2404 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"2405 | NC1C(=O)N[C@@H]1S(C=O)=[O+]Br" [color=lightgrey shape=box style=filled]
	1214 -> "2405 | NC1C(=O)N[C@@H]1S(C=O)=[O+]Br" [label=""]
	"2406 | [O+][Br+]Cl" [color=lightgrey shape=box style=filled]
	1215 -> "2406 | [O+][Br+]Cl" [label=""]
	"2407 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [color=lightgrey shape=box style=filled]
	1215 -> "2407 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [label=""]
	"2408 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [color=lightgrey shape=box style=filled]
	1216 -> "2408 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [label=""]
	"2409 | [O+][Br+]C(Cl)(Cl)Cl" [color=lightgrey shape=box style=filled]
	1216 -> "2409 | [O+][Br+]C(Cl)(Cl)Cl" [label=""]
	"2410 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=[O+]Br)cs1" [color=lightgrey shape=box style=filled]
	1217 -> "2410 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=[O+]Br)cs1" [label=""]
	"2411 | O=CO" [color=lightyellow shape=box style=filled]
	1217 -> "2411 | O=CO" [label=""]
	"2412 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [color=lightgrey shape=box style=filled]
	1218 -> "2412 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [label=""]
	"2413 | O=C1CCC(=O)N1[Br+][O+]" [color=lightgrey shape=box style=filled]
	1218 -> "2413 | O=C1CCC(=O)N1[Br+][O+]" [label=""]
	"2414 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=[O+]Br)cs1" [color=lightgrey shape=box style=filled]
	1219 -> "2414 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=[O+]Br)cs1" [label=""]
	"2415 | CN(C)C=O" [color=lightyellow shape=box style=filled]
	1219 -> "2415 | CN(C)C=O" [label=""]
	"2416 | [O+][Br+]O" [color=lightgrey shape=box style=filled]
	1220 -> "2416 | [O+][Br+]O" [label=""]
	"2417 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [color=lightgrey shape=box style=filled]
	1220 -> "2417 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [label=""]
	"2418 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [color=lightgrey shape=box style=filled]
	1221 -> "2418 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [label=""]
	"2419 | ClC(Cl)(Cl)Cl" [color=lightyellow shape=box style=filled]
	1221 -> "2419 | ClC(Cl)(Cl)Cl" [label=""]
	"2420 | [O+]Br" [color=lightgrey shape=box style=filled]
	1221 -> "2420 | [O+]Br" [label=""]
	"2421 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [color=lightgrey shape=box style=filled]
	1222 -> "2421 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [label=""]
	"2422 | [O+][Br+]Br" [color=lightgrey shape=box style=filled]
	1222 -> "2422 | [O+][Br+]Br" [label=""]
	"2423 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=[O+]Br)cs1" [color=lightgrey shape=box style=filled]
	1223 -> "2423 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=[O+]Br)cs1" [label=""]
	"2424 | O=COC(=O)c1cccc(Cl)c1" [color=lightgrey shape=box style=filled]
	1223 -> "2424 | O=COC(=O)c1cccc(Cl)c1" [label=""]
	"2425 | [O][Br+][O+]" [color=lightgrey shape=box style=filled]
	1224 -> "2425 | [O][Br+][O+]" [label=""]
	"2426 | OBr" [color=lightgrey shape=box style=filled]
	1225 -> "2426 | OBr" [label=""]
	"2427 | O=C(O[O+])c1cccc(Cl)c1" [color=lightgrey shape=box style=filled]
	1225 -> "2427 | O=C(O[O+])c1cccc(Cl)c1" [label=""]
	"2428 | [O+][Br+]OCl" [color=lightgrey shape=box style=filled]
	1226 -> "2428 | [O+][Br+]OCl" [label=""]
	"2429 | [O+][Br+]OO" [color=lightgrey shape=box style=filled]
	1227 -> "2429 | [O+][Br+]OO" [label=""]
	"2430 | O=[C]CCC(=O)[N]Br" [color=lightgrey shape=box style=filled]
	1228 -> "2430 | O=[C]CCC(=O)[N]Br" [label=""]
	"2431 | BrOBr" [color=lightgrey shape=box style=filled]
	1228 -> "2431 | BrOBr" [label=""]
	"2432 | [O+][Br+]OBr" [color=lightgrey shape=box style=filled]
	1228 -> "2432 | [O+][Br+]OBr" [label=""]
	"2433 | NC1C(=O)N[C@@H]1SC=O" [color=lightgrey shape=box style=filled]
	1229 -> "2433 | NC1C(=O)N[C@@H]1SC=O" [label=""]
	"2434 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1229 -> "2434 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"2435 | CC(Br)C(C)(C=O)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	1230 -> "2435 | CC(Br)C(C)(C=O)OC(=O)Cl" [label=""]
	"2436 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [color=lightgrey shape=box style=filled]
	1230 -> "2436 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [label=""]
	"2437 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [color=lightgrey shape=box style=filled]
	1231 -> "2437 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [label=""]
	"2438 | CC(Br)C(C)(C=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	1231 -> "2438 | CC(Br)C(C)(C=O)OC(=O)O" [label=""]
	"2439 | CC(Br)C(C)(C=O)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	1232 -> "2439 | CC(Br)C(C)(C=O)OC(=O)Cl" [label=""]
	"2440 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)Cl)cs1" [color=lightgrey shape=box style=filled]
	1232 -> "2440 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)Cl)cs1" [label=""]
	"2441 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1233 -> "2441 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)O)cs1" [label=""]
	"2442 | CC(Br)C(C)(C=O)OC=O" [color=lightgrey shape=box style=filled]
	1233 -> "2442 | CC(Br)C(C)(C=O)OC=O" [label=""]
	"2443 | CC(Br)C(C)(C=O)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	1234 -> "2443 | CC(Br)C(C)(C=O)OC(=O)Cl" [label=""]
	"2444 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1234 -> "2444 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)O)cs1" [label=""]
	"2445 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)Cl)cs1" [color=lightgrey shape=box style=filled]
	1235 -> "2445 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)Cl)cs1" [label=""]
	"2446 | CC(Br)C(C)(C=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	1235 -> "2446 | CC(Br)C(C)(C=O)OC(=O)O" [label=""]
	"2447 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1236 -> "2447 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)O)cs1" [label=""]
	"2448 | CC(Br)C(C)(C=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	1236 -> "2448 | CC(Br)C(C)(C=O)OC(=O)O" [label=""]
	"2449 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1237 -> "2449 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)O)cs1" [label=""]
	"2450 | CC(Br)C(C)(C=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	1237 -> "2450 | CC(Br)C(C)(C=O)OC(=O)O" [label=""]
	"2451 | NC1C(=O)N[C@@H]1S(=O)C=O" [color=lightgrey shape=box style=filled]
	1238 -> "2451 | NC1C(=O)N[C@@H]1S(=O)C=O" [label=""]
	"2452 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1238 -> "2452 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"2453 | O=C(OO)c1cccc(Cl)c1" [color=lightyellow shape=box style=filled]
	1239 -> "2453 | O=C(OO)c1cccc(Cl)c1" [label=""]
	"2454 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [color=lightgrey shape=box style=filled]
	1239 -> "2454 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [label=""]
	"2455 | CC(Br)C(C)(C=O)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	1240 -> "2455 | CC(Br)C(C)(C=O)OC(=O)Cl" [label=""]
	"2456 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C=O)cs1" [color=lightgrey shape=box style=filled]
	1240 -> "2456 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C=O)cs1" [label=""]
	"2457 | O=CS(=O)O" [color=lightgrey shape=box style=filled]
	1241 -> "2457 | O=CS(=O)O" [label=""]
	"2458 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2CNC2=O)cs1" [color=lightgrey shape=box style=filled]
	1241 -> "2458 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2CNC2=O)cs1" [label=""]
	"2459 | O=CS(=O)Cl" [color=lightgrey shape=box style=filled]
	1242 -> "2459 | O=CS(=O)Cl" [label=""]
	"2460 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2CNC2=O)cs1" [color=lightgrey shape=box style=filled]
	1242 -> "2460 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2CNC2=O)cs1" [label=""]
	"2461 | OO" [color=lightyellow shape=box style=filled]
	1243 -> "2461 | OO" [label=""]
	"2462 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [color=lightgrey shape=box style=filled]
	1243 -> "2462 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [label=""]
	"2463 | O=C(O)c1cccc(Cl)c1" [color=lightyellow shape=box style=filled]
	1243 -> "2463 | O=C(O)c1cccc(Cl)c1" [label=""]
	"2464 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C=O)cs1" [color=lightgrey shape=box style=filled]
	1244 -> "2464 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C=O)cs1" [label=""]
	"2465 | CC(Br)C(C)(C=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	1244 -> "2465 | CC(Br)C(C)(C=O)OC(=O)O" [label=""]
	"2466 | OO" [color=lightyellow shape=box style=filled]
	1245 -> "2466 | OO" [label=""]
	"2467 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [color=lightgrey shape=box style=filled]
	1245 -> "2467 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [label=""]
	"2468 | O=C(OO)c1ccccc1" [color=lightgrey shape=box style=filled]
	1246 -> "2468 | O=C(OO)c1ccccc1" [label=""]
	"2469 | O=C1CCC(=O)N1Cl" [color=lightyellow shape=box style=filled]
	1246 -> "2469 | O=C1CCC(=O)N1Cl" [label=""]
	"2470 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [color=lightgrey shape=box style=filled]
	1246 -> "2470 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [label=""]
	"2471 | NC1C(=O)N[C@@H]1S(=O)C=O" [color=lightgrey shape=box style=filled]
	1247 -> "2471 | NC1C(=O)N[C@@H]1S(=O)C=O" [label=""]
	"2472 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1247 -> "2472 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"2473 | O=C(OO)c1cccc(Cl)c1" [color=lightyellow shape=box style=filled]
	1248 -> "2473 | O=C(OO)c1cccc(Cl)c1" [label=""]
	"2474 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [color=lightgrey shape=box style=filled]
	1248 -> "2474 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [label=""]
	"2475 | CC(Br)C(C)(C=O)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	1249 -> "2475 | CC(Br)C(C)(C=O)OC(=O)Cl" [label=""]
	"2476 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C=O)cs1" [color=lightgrey shape=box style=filled]
	1249 -> "2476 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C=O)cs1" [label=""]
	"2477 | O=CS(=O)O" [color=lightgrey shape=box style=filled]
	1250 -> "2477 | O=CS(=O)O" [label=""]
	"2478 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2CNC2=O)cs1" [color=lightgrey shape=box style=filled]
	1250 -> "2478 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2CNC2=O)cs1" [label=""]
	"2479 | O=CS(=O)Cl" [color=lightgrey shape=box style=filled]
	1251 -> "2479 | O=CS(=O)Cl" [label=""]
	"2480 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2CNC2=O)cs1" [color=lightgrey shape=box style=filled]
	1251 -> "2480 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2CNC2=O)cs1" [label=""]
	"2481 | OO" [color=lightyellow shape=box style=filled]
	1252 -> "2481 | OO" [label=""]
	"2482 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [color=lightgrey shape=box style=filled]
	1252 -> "2482 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [label=""]
	"2483 | O=C(O)c1cccc(Cl)c1" [color=lightyellow shape=box style=filled]
	1252 -> "2483 | O=C(O)c1cccc(Cl)c1" [label=""]
	"2484 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C=O)cs1" [color=lightgrey shape=box style=filled]
	1253 -> "2484 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C=O)cs1" [label=""]
	"2485 | CC(Br)C(C)(C=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	1253 -> "2485 | CC(Br)C(C)(C=O)OC(=O)O" [label=""]
	"2486 | OO" [color=lightyellow shape=box style=filled]
	1254 -> "2486 | OO" [label=""]
	"2487 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [color=lightgrey shape=box style=filled]
	1254 -> "2487 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [label=""]
	"2488 | O=C(OO)c1ccccc1" [color=lightgrey shape=box style=filled]
	1255 -> "2488 | O=C(OO)c1ccccc1" [label=""]
	"2489 | O=C1CCC(=O)N1Cl" [color=lightyellow shape=box style=filled]
	1255 -> "2489 | O=C1CCC(=O)N1Cl" [label=""]
	"2490 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [color=lightgrey shape=box style=filled]
	1255 -> "2490 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [label=""]
	"2491 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	1256 -> "2491 | O=C1CCC(=O)N1Br" [label=""]
	"2492 | [O+]" [color=lightgrey shape=box style=filled]
	1256 -> "2492 | [O+]" [label=""]
	"2493 | Br" [color=lightyellow shape=box style=filled]
	1257 -> "2493 | Br" [label=""]
	"2494 | [O+]C(Cl)(Cl)Cl" [color=lightgrey shape=box style=filled]
	1257 -> "2494 | [O+]C(Cl)(Cl)Cl" [label=""]
	"2495 | BrC(Br)(Br)Br" [color=lightyellow shape=box style=filled]
	1258 -> "2495 | BrC(Br)(Br)Br" [label=""]
	"2496 | [O+]" [color=lightgrey shape=box style=filled]
	1258 -> "2496 | [O+]" [label=""]
	"2497 | ClC(Cl)(Cl)Cl" [color=lightyellow shape=box style=filled]
	1259 -> "2497 | ClC(Cl)(Cl)Cl" [label=""]
	"2498 | [O+]Br" [color=lightgrey shape=box style=filled]
	1259 -> "2498 | [O+]Br" [label=""]
	"2499 | ClC(Cl)Cl" [color=lightyellow shape=box style=filled]
	1260 -> "2499 | ClC(Cl)Cl" [label=""]
	"2500 | OBr" [color=lightgrey shape=box style=filled]
	1260 -> "2500 | OBr" [label=""]
	"2501 | [O+]" [color=lightgrey shape=box style=filled]
	1260 -> "2501 | [O+]" [label=""]
	"2502 | ClC(Cl)Cl" [color=lightyellow shape=box style=filled]
	1261 -> "2502 | ClC(Cl)Cl" [label=""]
	"2503 | O=C(OBr)c1cccc(Cl)c1" [color=lightgrey shape=box style=filled]
	1261 -> "2503 | O=C(OBr)c1cccc(Cl)c1" [label=""]
	"2504 | [O+]" [color=lightgrey shape=box style=filled]
	1261 -> "2504 | [O+]" [label=""]
	"2505 | [O+][Br+]Cl" [color=lightgrey shape=box style=filled]
	1262 -> "2505 | [O+][Br+]Cl" [label=""]
	"2506 | ClC(Cl)Cl" [color=lightyellow shape=box style=filled]
	1262 -> "2506 | ClC(Cl)Cl" [label=""]
	"2507 | [Br+]" [color=lightgrey shape=box style=filled]
	1263 -> "2507 | [Br+]" [label=""]
	"2508 | ClC(Cl)Cl" [color=lightyellow shape=box style=filled]
	1263 -> "2508 | ClC(Cl)Cl" [label=""]
	"2509 | O=C(O[O+])c1cccc(Cl)c1" [color=lightgrey shape=box style=filled]
	1263 -> "2509 | O=C(O[O+])c1cccc(Cl)c1" [label=""]
	"2510 | ClC(Cl)Cl" [color=lightyellow shape=box style=filled]
	1264 -> "2510 | ClC(Cl)Cl" [label=""]
	"2511 | [O+]Br" [color=lightgrey shape=box style=filled]
	1264 -> "2511 | [O+]Br" [label=""]
	"2512 | Cl[C](Cl)Cl" [color=lightgrey shape=box style=filled]
	1265 -> "2512 | Cl[C](Cl)Cl" [label=""]
	"2513 | [Br+]" [color=lightgrey shape=box style=filled]
	1265 -> "2513 | [Br+]" [label=""]
	"2514 | [O+]" [color=lightgrey shape=box style=filled]
	1265 -> "2514 | [O+]" [label=""]
	"2515 | ClC(Cl)Cl" [color=lightyellow shape=box style=filled]
	1266 -> "2515 | ClC(Cl)Cl" [label=""]
	"2516 | [O+]O" [color=lightgrey shape=box style=filled]
	1266 -> "2516 | [O+]O" [label=""]
	"2517 | [Br+]" [color=lightgrey shape=box style=filled]
	1266 -> "2517 | [Br+]" [label=""]
	"2518 | ClC(Cl)Cl" [color=lightyellow shape=box style=filled]
	1267 -> "2518 | ClC(Cl)Cl" [label=""]
	"2519 | [O+]O" [color=lightgrey shape=box style=filled]
	1267 -> "2519 | [O+]O" [label=""]
	"2520 | O=C(OBr)c1cccc(Cl)c1" [color=lightgrey shape=box style=filled]
	1267 -> "2520 | O=C(OBr)c1cccc(Cl)c1" [label=""]
	"2521 | ClC(Cl)Cl" [color=lightyellow shape=box style=filled]
	1268 -> "2521 | ClC(Cl)Cl" [label=""]
	"2522 | O=C(O[O+])c1cccc(Cl)c1" [color=lightgrey shape=box style=filled]
	1268 -> "2522 | O=C(O[O+])c1cccc(Cl)c1" [label=""]
	"2523 | O=C(OBr)c1cccc(Cl)c1" [color=lightgrey shape=box style=filled]
	1268 -> "2523 | O=C(OBr)c1cccc(Cl)c1" [label=""]
	"2524 | NC1C(=O)N[C@@H]1SC=O" [color=lightgrey shape=box style=filled]
	1269 -> "2524 | NC1C(=O)N[C@@H]1SC=O" [label=""]
	"2525 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1269 -> "2525 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"2526 | CC(Br)C(C)(C=O)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	1270 -> "2526 | CC(Br)C(C)(C=O)OC(=O)Cl" [label=""]
	"2527 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [color=lightgrey shape=box style=filled]
	1270 -> "2527 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [label=""]
	"2528 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [color=lightgrey shape=box style=filled]
	1271 -> "2528 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [label=""]
	"2529 | CC(Br)C(C)(C=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	1271 -> "2529 | CC(Br)C(C)(C=O)OC(=O)O" [label=""]
	"2530 | CC(Br)C(C)(C=O)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	1272 -> "2530 | CC(Br)C(C)(C=O)OC(=O)Cl" [label=""]
	"2531 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)Cl)cs1" [color=lightgrey shape=box style=filled]
	1272 -> "2531 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)Cl)cs1" [label=""]
	"2532 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1273 -> "2532 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)O)cs1" [label=""]
	"2533 | CC(Br)C(C)(C=O)OC=O" [color=lightgrey shape=box style=filled]
	1273 -> "2533 | CC(Br)C(C)(C=O)OC=O" [label=""]
	"2534 | CC(Br)C(C)(C=O)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	1274 -> "2534 | CC(Br)C(C)(C=O)OC(=O)Cl" [label=""]
	"2535 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1274 -> "2535 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)O)cs1" [label=""]
	"2536 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)Cl)cs1" [color=lightgrey shape=box style=filled]
	1275 -> "2536 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)Cl)cs1" [label=""]
	"2537 | CC(Br)C(C)(C=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	1275 -> "2537 | CC(Br)C(C)(C=O)OC(=O)O" [label=""]
	"2538 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1276 -> "2538 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)O)cs1" [label=""]
	"2539 | CC(Br)C(C)(C=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	1276 -> "2539 | CC(Br)C(C)(C=O)OC(=O)O" [label=""]
	"2540 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1277 -> "2540 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)O)cs1" [label=""]
	"2541 | CC(Br)C(C)(C=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	1277 -> "2541 | CC(Br)C(C)(C=O)OC(=O)O" [label=""]
	"2542 | NC1C(=O)N[C@@H]1[S]=[O+]Br" [color=lightgrey shape=box style=filled]
	1278 -> "2542 | NC1C(=O)N[C@@H]1[S]=[O+]Br" [label=""]
	"2543 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1278 -> "2543 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"2544 | CC(Br)C(C)(C=O)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	1279 -> "2544 | CC(Br)C(C)(C=O)OC(=O)Cl" [label=""]
	"2545 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=[O+]Br)cs1" [color=lightgrey shape=box style=filled]
	1279 -> "2545 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=[O+]Br)cs1" [label=""]
	"2546 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S)cs1" [color=lightgrey shape=box style=filled]
	1280 -> "2546 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S)cs1" [label=""]
	"2547 | [O+][Br+]Cl" [color=lightgrey shape=box style=filled]
	1280 -> "2547 | [O+][Br+]Cl" [label=""]
	"2548 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S)cs1" [color=lightgrey shape=box style=filled]
	1281 -> "2548 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S)cs1" [label=""]
	"2549 | [O+][Br+]O" [color=lightgrey shape=box style=filled]
	1281 -> "2549 | [O+][Br+]O" [label=""]
	"2550 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S)cs1" [color=lightgrey shape=box style=filled]
	1282 -> "2550 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S)cs1" [label=""]
	"2551 | O=C(O[Br+][O+])c1cccc(Cl)c1" [color=lightgrey shape=box style=filled]
	1282 -> "2551 | O=C(O[Br+][O+])c1cccc(Cl)c1" [label=""]
	"2552 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=[O+]Br)cs1" [color=lightgrey shape=box style=filled]
	1283 -> "2552 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=[O+]Br)cs1" [label=""]
	"2553 | CC(Br)C(C)(C=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	1283 -> "2553 | CC(Br)C(C)(C=O)OC(=O)O" [label=""]
	"2554 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S)cs1" [color=lightgrey shape=box style=filled]
	1284 -> "2554 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S)cs1" [label=""]
	"2555 | [O+][Br+]C(Cl)(Cl)Cl" [color=lightgrey shape=box style=filled]
	1284 -> "2555 | [O+][Br+]C(Cl)(Cl)Cl" [label=""]
	"2556 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S)cs1" [color=lightgrey shape=box style=filled]
	1285 -> "2556 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S)cs1" [label=""]
	"2557 | O=C1CCC(=O)N1[Br+][O+]" [color=lightgrey shape=box style=filled]
	1285 -> "2557 | O=C1CCC(=O)N1[Br+][O+]" [label=""]
	"2558 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S)cs1" [color=lightgrey shape=box style=filled]
	1286 -> "2558 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S)cs1" [label=""]
	"2559 | [O+][Br+]O" [color=lightgrey shape=box style=filled]
	1286 -> "2559 | [O+][Br+]O" [label=""]
	"2560 | O=C(O)c1cccc(Cl)c1" [color=lightyellow shape=box style=filled]
	1286 -> "2560 | O=C(O)c1cccc(Cl)c1" [label=""]
	"2561 | O=C(Cl)Cl" [color=lightyellow shape=box style=filled]
	1287 -> "2561 | O=C(Cl)Cl" [label=""]
	"2562 | O=[C]Cl" [color=lightgrey shape=box style=filled]
	1288 -> "2562 | O=[C]Cl" [label=""]
	"2563 | CCl" [color=lightyellow shape=box style=filled]
	1289 -> "2563 | CCl" [label=""]
	"2564 | O=C(OO)c1cccc(Cl)c1" [color=lightyellow shape=box style=filled]
	1289 -> "2564 | O=C(OO)c1cccc(Cl)c1" [label=""]
	"2565 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	1290 -> "2565 | O=C1CCC(=O)N1Br" [label=""]
	"2566 | [O+]" [color=lightgrey shape=box style=filled]
	1290 -> "2566 | [O+]" [label=""]
	"2567 | Br" [color=lightyellow shape=box style=filled]
	1291 -> "2567 | Br" [label=""]
	"2568 | [O+]C(Cl)(Cl)Cl" [color=lightgrey shape=box style=filled]
	1291 -> "2568 | [O+]C(Cl)(Cl)Cl" [label=""]
	"2569 | BrC(Br)(Br)Br" [color=lightyellow shape=box style=filled]
	1292 -> "2569 | BrC(Br)(Br)Br" [label=""]
	"2570 | [O+]" [color=lightgrey shape=box style=filled]
	1292 -> "2570 | [O+]" [label=""]
	"2571 | NC1C(=O)N[C@@H]1[S](Cl)C=O" [color=lightgrey shape=box style=filled]
	1293 -> "2571 | NC1C(=O)N[C@@H]1[S](Cl)C=O" [label=""]
	"2572 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1293 -> "2572 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"2573 | CC(Br)C(C)(C=O)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	1294 -> "2573 | CC(Br)C(C)(C=O)OC(=O)Cl" [label=""]
	"2574 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S](Cl)C=O)cs1" [color=lightgrey shape=box style=filled]
	1294 -> "2574 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S](Cl)C=O)cs1" [label=""]
	"2575 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCl)cs1" [color=lightgrey shape=box style=filled]
	1295 -> "2575 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SCl)cs1" [label=""]
	"2576 | O=CO" [color=lightyellow shape=box style=filled]
	1295 -> "2576 | O=CO" [label=""]
	"2577 | O=C1CCC(=O)N1Cl" [color=lightyellow shape=box style=filled]
	1296 -> "2577 | O=C1CCC(=O)N1Cl" [label=""]
	"2578 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [color=lightgrey shape=box style=filled]
	1296 -> "2578 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [label=""]
	"2579 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S](Cl)C=O)cs1" [color=lightgrey shape=box style=filled]
	1297 -> "2579 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S](Cl)C=O)cs1" [label=""]
	"2580 | CC(Br)C(C)(C=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	1297 -> "2580 | CC(Br)C(C)(C=O)OC(=O)O" [label=""]
	"2581 | ClC(Cl)(Cl)Cl" [color=lightyellow shape=box style=filled]
	1298 -> "2581 | ClC(Cl)(Cl)Cl" [label=""]
	"2582 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [color=lightgrey shape=box style=filled]
	1298 -> "2582 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC=O)cs1" [label=""]
	"2583 | CC(Br)C(C)(C=O)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	1299 -> "2583 | CC(Br)C(C)(C=O)OC(=O)Cl" [label=""]
	"2584 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S](Cl)C(=O)Br)cs1" [color=lightgrey shape=box style=filled]
	1299 -> "2584 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S](Cl)C(=O)Br)cs1" [label=""]
	"2585 | CC(Br)C(C)(C=O)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	1300 -> "2585 | CC(Br)C(C)(C=O)OC(=O)Cl" [label=""]
	"2586 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S](Cl)C(=O)Cl)cs1" [color=lightgrey shape=box style=filled]
	1300 -> "2586 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S](Cl)C(=O)Cl)cs1" [label=""]
	"2587 | NC1C(=O)N[C@@H]1SCl" [color=lightgrey shape=box style=filled]
	1301 -> "2587 | NC1C(=O)N[C@@H]1SCl" [label=""]
	"2588 | C=O" [color=lightyellow shape=box style=filled]
	1301 -> "2588 | C=O" [label=""]
	"2589 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1301 -> "2589 | CC(Br)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"2590 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	1302 -> "2590 | O=C1CCC(=O)N1Br" [label=""]
	"2591 | CC=O" [color=lightgrey shape=box style=filled]
	1302 -> "2591 | CC=O" [label=""]
	"2592 | O=C(Cl)Br" [color=lightgrey shape=box style=filled]
	1303 -> "2592 | O=C(Cl)Br" [label=""]
	"2593 | CI" [color=lightyellow shape=box style=filled]
	1303 -> "2593 | CI" [label=""]
	"2594 | O=C(OO)c1cccc(Cl)c1" [color=lightyellow shape=box style=filled]
	1304 -> "2594 | O=C(OO)c1cccc(Cl)c1" [label=""]
	"2595 | CCBr" [color=lightyellow shape=box style=filled]
	1304 -> "2595 | CCBr" [label=""]
	"2596 | O=C(Cl)Br" [color=lightgrey shape=box style=filled]
	1305 -> "2596 | O=C(Cl)Br" [label=""]
	"2597 | C[Mg+]" [color=lightyellow shape=box style=filled]
	1305 -> "2597 | C[Mg+]" [label=""]
	"2598 | CC(=O)Cl" [color=lightyellow shape=box style=filled]
	1306 -> "2598 | CC(=O)Cl" [label=""]
	"2599 | Br" [color=lightyellow shape=box style=filled]
	1306 -> "2599 | Br" [label=""]
	"2600 | O=C(OO)c1cccc(Cl)c1" [color=lightyellow shape=box style=filled]
	1307 -> "2600 | O=C(OO)c1cccc(Cl)c1" [label=""]
	"2601 | CC(Br)Br" [color=lightyellow shape=box style=filled]
	1307 -> "2601 | CC(Br)Br" [label=""]
	"2602 | CC(Br)Br" [color=lightyellow shape=box style=filled]
	1308 -> "2602 | CC(Br)Br" [label=""]
	"2603 | O" [color=lightyellow shape=box style=filled]
	1308 -> "2603 | O" [label=""]
	"2604 | CC(Br)Br" [color=lightyellow shape=box style=filled]
	1309 -> "2604 | CC(Br)Br" [label=""]
	"2605 | CN(C)O" [color=lightyellow shape=box style=filled]
	1309 -> "2605 | CN(C)O" [label=""]
	"2606 | CC(Br)Br" [color=lightyellow shape=box style=filled]
	1310 -> "2606 | CC(Br)Br" [label=""]
	"2607 | OO" [color=lightyellow shape=box style=filled]
	1310 -> "2607 | OO" [label=""]
	"2608 | OBr" [color=lightgrey shape=box style=filled]
	1311 -> "2608 | OBr" [label=""]
	"2609 | CC(=O)OC(=O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	1311 -> "2609 | CC(=O)OC(=O)OC(C)(C)C" [label=""]
	"2610 | O=C(Cl)Br" [color=lightgrey shape=box style=filled]
	1312 -> "2610 | O=C(Cl)Br" [label=""]
	"2611 | C=O" [color=lightyellow shape=box style=filled]
	1312 -> "2611 | C=O" [label=""]
	"2612 | O=CO" [color=lightyellow shape=box style=filled]
	1313 -> "2612 | O=CO" [label=""]
	"2613 | O=CBr" [color=lightgrey shape=box style=filled]
	1313 -> "2613 | O=CBr" [label=""]
	"2614 | O=CBr" [color=lightgrey shape=box style=filled]
	1314 -> "2614 | O=CBr" [label=""]
	"2615 | CN(C)C=O" [color=lightyellow shape=box style=filled]
	1314 -> "2615 | CN(C)C=O" [label=""]
	"2616 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	1315 -> "2616 | O=C1CCC(=O)N1Br" [label=""]
	"2617 | O=CC=O" [color=lightyellow shape=box style=filled]
	1315 -> "2617 | O=CC=O" [label=""]
	"2618 | O=C(O)Br" [color=lightgrey shape=box style=filled]
	1316 -> "2618 | O=C(O)Br" [label=""]
	"2619 | C=O" [color=lightyellow shape=box style=filled]
	1316 -> "2619 | C=O" [label=""]
	"2620 | O=C(Br)Br" [color=lightgrey shape=box style=filled]
	1317 -> "2620 | O=C(Br)Br" [label=""]
	"2621 | C=O" [color=lightyellow shape=box style=filled]
	1317 -> "2621 | C=O" [label=""]
	"2622 | Br" [color=lightyellow shape=box style=filled]
	1318 -> "2622 | Br" [label=""]
	"2623 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	1318 -> "2623 | O=CC(=O)O" [label=""]
	"2624 | O=C(Cl)Br" [color=lightgrey shape=box style=filled]
	1319 -> "2624 | O=C(Cl)Br" [label=""]
	"2625 | CN(C)C=O" [color=lightyellow shape=box style=filled]
	1319 -> "2625 | CN(C)C=O" [label=""]
	"2626 | O=C(Br)Br" [color=lightgrey shape=box style=filled]
	1320 -> "2626 | O=C(Br)Br" [label=""]
	"2627 | CN(C)C=O" [color=lightyellow shape=box style=filled]
	1320 -> "2627 | CN(C)C=O" [label=""]
	"2628 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	1321 -> "2628 | O=C1CCC(=O)N1Br" [label=""]
	"2629 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	1321 -> "2629 | O=CC(=O)O" [label=""]
	"2630 | CC(=O)O" [color=lightyellow shape=box style=filled]
	1322 -> "2630 | CC(=O)O" [label=""]
	"2631 | ClC(Cl)(Cl)Cl" [color=lightyellow shape=box style=filled]
	1322 -> "2631 | ClC(Cl)(Cl)Cl" [label=""]
	"2632 | O=C(O)CBr" [color=lightyellow shape=box style=filled]
	1323 -> "2632 | O=C(O)CBr" [label=""]
	"2633 | Cl" [color=lightyellow shape=box style=filled]
	1323 -> "2633 | Cl" [label=""]
	"2634 | O=CO" [color=lightyellow shape=box style=filled]
	1324 -> "2634 | O=CO" [label=""]
	"2635 | ClCCl" [color=lightyellow shape=box style=filled]
	1324 -> "2635 | ClCCl" [label=""]
	"2636 | CCl" [color=lightyellow shape=box style=filled]
	1325 -> "2636 | CCl" [label=""]
	"2637 | O=C=O" [color=lightyellow shape=box style=filled]
	1325 -> "2637 | O=C=O" [label=""]
	"2638 | CC(=O)O" [color=lightyellow shape=box style=filled]
	1326 -> "2638 | CC(=O)O" [label=""]
	"2639 | ClCl" [color=lightyellow shape=box style=filled]
	1326 -> "2639 | ClCl" [label=""]
	"2640 | CC(=O)O" [color=lightyellow shape=box style=filled]
	1327 -> "2640 | CC(=O)O" [label=""]
	"2641 | OCl" [color=lightyellow shape=box style=filled]
	1327 -> "2641 | OCl" [label=""]
	"2642 | O=C(Cl)CCl" [color=lightgrey shape=box style=filled]
	1328 -> "2642 | O=C(Cl)CCl" [label=""]
	"2643 | O" [color=lightyellow shape=box style=filled]
	1328 -> "2643 | O" [label=""]
	"2644 | CCl" [color=lightyellow shape=box style=filled]
	1329 -> "2644 | CCl" [label=""]
	"2645 | O=C(O)O" [color=lightyellow shape=box style=filled]
	1329 -> "2645 | O=C(O)O" [label=""]
	"2646 | CCl" [color=lightyellow shape=box style=filled]
	1330 -> "2646 | CCl" [label=""]
	"2647 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	1330 -> "2647 | O=C(O)Cl" [label=""]
	"2648 | ClCC(Cl)Br" [color=lightgrey shape=box style=filled]
	1331 -> "2648 | ClCC(Cl)Br" [label=""]
	"2649 | O" [color=lightyellow shape=box style=filled]
	1331 -> "2649 | O" [label=""]
	"2650 | ClCCBr" [color=lightyellow shape=box style=filled]
	1332 -> "2650 | ClCCBr" [label=""]
	"2651 | O=C(OO)c1cccc(Cl)c1" [color=lightyellow shape=box style=filled]
	1332 -> "2651 | O=C(OO)c1cccc(Cl)c1" [label=""]
	"2652 | O=C(OO)c1cccc(Cl)c1" [color=lightyellow shape=box style=filled]
	1333 -> "2652 | O=C(OO)c1cccc(Cl)c1" [label=""]
	"2653 | ClCC(Cl)Br" [color=lightgrey shape=box style=filled]
	1333 -> "2653 | ClCC(Cl)Br" [label=""]
	"2654 | CC(=O)Br" [color=lightgrey shape=box style=filled]
	1334 -> "2654 | CC(=O)Br" [label=""]
	"2655 | ClC(Cl)(Cl)Cl" [color=lightyellow shape=box style=filled]
	1334 -> "2655 | ClC(Cl)(Cl)Cl" [label=""]
	"2656 | O" [color=lightyellow shape=box style=filled]
	1335 -> "2656 | O" [label=""]
	"2657 | ClCC(Br)Br" [color=lightgrey shape=box style=filled]
	1335 -> "2657 | ClCC(Br)Br" [label=""]
	"2658 | O=C(OO)c1cccc(Cl)c1" [color=lightyellow shape=box style=filled]
	1336 -> "2658 | O=C(OO)c1cccc(Cl)c1" [label=""]
	"2659 | ClCC(Br)Br" [color=lightgrey shape=box style=filled]
	1336 -> "2659 | ClCC(Br)Br" [label=""]
	"2660 | CN(C)O" [color=lightyellow shape=box style=filled]
	1337 -> "2660 | CN(C)O" [label=""]
	"2661 | ClCC(Cl)Br" [color=lightgrey shape=box style=filled]
	1337 -> "2661 | ClCC(Cl)Br" [label=""]
	"2662 | OO" [color=lightyellow shape=box style=filled]
	1338 -> "2662 | OO" [label=""]
	"2663 | ClCC(Cl)Br" [color=lightgrey shape=box style=filled]
	1338 -> "2663 | ClCC(Cl)Br" [label=""]
	"2664 | CN(C)O" [color=lightyellow shape=box style=filled]
	1339 -> "2664 | CN(C)O" [label=""]
	"2665 | ClCC(Br)Br" [color=lightgrey shape=box style=filled]
	1339 -> "2665 | ClCC(Br)Br" [label=""]
	"2666 | CC(=O)Br" [color=lightgrey shape=box style=filled]
	1340 -> "2666 | CC(=O)Br" [label=""]
	"2667 | O=C1CCC(=O)N1Cl" [color=lightyellow shape=box style=filled]
	1340 -> "2667 | O=C1CCC(=O)N1Cl" [label=""]
	"2668 | CC(=O)O" [color=lightyellow shape=box style=filled]
	1341 -> "2668 | CC(=O)O" [label=""]
	"2669 | ClC(Cl)(Cl)Cl" [color=lightyellow shape=box style=filled]
	1341 -> "2669 | ClC(Cl)(Cl)Cl" [label=""]
	"2670 | O=C(O)CBr" [color=lightyellow shape=box style=filled]
	1342 -> "2670 | O=C(O)CBr" [label=""]
	"2671 | Cl" [color=lightyellow shape=box style=filled]
	1342 -> "2671 | Cl" [label=""]
	"2672 | O=CO" [color=lightyellow shape=box style=filled]
	1343 -> "2672 | O=CO" [label=""]
	"2673 | ClCCl" [color=lightyellow shape=box style=filled]
	1343 -> "2673 | ClCCl" [label=""]
	"2674 | CCl" [color=lightyellow shape=box style=filled]
	1344 -> "2674 | CCl" [label=""]
	"2675 | O=C=O" [color=lightyellow shape=box style=filled]
	1344 -> "2675 | O=C=O" [label=""]
	"2676 | CC(=O)O" [color=lightyellow shape=box style=filled]
	1345 -> "2676 | CC(=O)O" [label=""]
	"2677 | ClCl" [color=lightyellow shape=box style=filled]
	1345 -> "2677 | ClCl" [label=""]
	"2678 | CC(=O)O" [color=lightyellow shape=box style=filled]
	1346 -> "2678 | CC(=O)O" [label=""]
	"2679 | OCl" [color=lightyellow shape=box style=filled]
	1346 -> "2679 | OCl" [label=""]
	"2680 | O=C(Cl)CCl" [color=lightgrey shape=box style=filled]
	1347 -> "2680 | O=C(Cl)CCl" [label=""]
	"2681 | O" [color=lightyellow shape=box style=filled]
	1347 -> "2681 | O" [label=""]
	"2682 | CCl" [color=lightyellow shape=box style=filled]
	1348 -> "2682 | CCl" [label=""]
	"2683 | O=C(O)O" [color=lightyellow shape=box style=filled]
	1348 -> "2683 | O=C(O)O" [label=""]
	"2684 | CCl" [color=lightyellow shape=box style=filled]
	1349 -> "2684 | CCl" [label=""]
	"2685 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	1349 -> "2685 | O=C(O)Cl" [label=""]
	"2686 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	1350 -> "2686 | O=C1CCC(=O)N1Br" [label=""]
	"2687 | CC=O" [color=lightgrey shape=box style=filled]
	1350 -> "2687 | CC=O" [label=""]
	"2688 | O=C(Cl)Br" [color=lightgrey shape=box style=filled]
	1351 -> "2688 | O=C(Cl)Br" [label=""]
	"2689 | CI" [color=lightyellow shape=box style=filled]
	1351 -> "2689 | CI" [label=""]
	"2690 | O=C(OO)c1cccc(Cl)c1" [color=lightyellow shape=box style=filled]
	1352 -> "2690 | O=C(OO)c1cccc(Cl)c1" [label=""]
	"2691 | CCBr" [color=lightyellow shape=box style=filled]
	1352 -> "2691 | CCBr" [label=""]
	"2692 | O=C(Cl)Br" [color=lightgrey shape=box style=filled]
	1353 -> "2692 | O=C(Cl)Br" [label=""]
	"2693 | C[Mg+]" [color=lightyellow shape=box style=filled]
	1353 -> "2693 | C[Mg+]" [label=""]
	"2694 | CC(=O)Cl" [color=lightyellow shape=box style=filled]
	1354 -> "2694 | CC(=O)Cl" [label=""]
	"2695 | Br" [color=lightyellow shape=box style=filled]
	1354 -> "2695 | Br" [label=""]
	"2696 | O=C(OO)c1cccc(Cl)c1" [color=lightyellow shape=box style=filled]
	1355 -> "2696 | O=C(OO)c1cccc(Cl)c1" [label=""]
	"2697 | CC(Br)Br" [color=lightyellow shape=box style=filled]
	1355 -> "2697 | CC(Br)Br" [label=""]
	"2698 | CC(Br)Br" [color=lightyellow shape=box style=filled]
	1356 -> "2698 | CC(Br)Br" [label=""]
	"2699 | O" [color=lightyellow shape=box style=filled]
	1356 -> "2699 | O" [label=""]
	"2700 | CC(Br)Br" [color=lightyellow shape=box style=filled]
	1357 -> "2700 | CC(Br)Br" [label=""]
	"2701 | CN(C)O" [color=lightyellow shape=box style=filled]
	1357 -> "2701 | CN(C)O" [label=""]
	"2702 | CC(Br)Br" [color=lightyellow shape=box style=filled]
	1358 -> "2702 | CC(Br)Br" [label=""]
	"2703 | OO" [color=lightyellow shape=box style=filled]
	1358 -> "2703 | OO" [label=""]
	"2704 | OBr" [color=lightgrey shape=box style=filled]
	1359 -> "2704 | OBr" [label=""]
	"2705 | CC(=O)OC(=O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	1359 -> "2705 | CC(=O)OC(=O)OC(C)(C)C" [label=""]
	"2706 | O=CO" [color=lightyellow shape=box style=filled]
	1360 -> "2706 | O=CO" [label=""]
	"2707 | O=C(Cl)Cl" [color=lightyellow shape=box style=filled]
	1360 -> "2707 | O=C(Cl)Cl" [label=""]
	"2708 | O=C(Cl)Cl" [color=lightyellow shape=box style=filled]
	1361 -> "2708 | O=C(Cl)Cl" [label=""]
	"2709 | O=C=O" [color=lightyellow shape=box style=filled]
	1361 -> "2709 | O=C=O" [label=""]
	"2710 | O=CCl" [color=lightgrey shape=box style=filled]
	1362 -> "2710 | O=CCl" [label=""]
	"2711 | O=C=O" [color=lightyellow shape=box style=filled]
	1362 -> "2711 | O=C=O" [label=""]
	"2712 | O=C(Cl)CO" [color=lightgrey shape=box style=filled]
	1363 -> "2712 | O=C(Cl)CO" [label=""]
	"2713 | O=C(OO)c1cccc(Cl)c1" [color=lightyellow shape=box style=filled]
	1363 -> "2713 | O=C(OO)c1cccc(Cl)c1" [label=""]
	"2714 | O=C(Cl)C(=O)Cl" [color=lightyellow shape=box style=filled]
	1364 -> "2714 | O=C(Cl)C(=O)Cl" [label=""]
	"2715 | O" [color=lightyellow shape=box style=filled]
	1364 -> "2715 | O" [label=""]
	"2716 | CC(=O)O" [color=lightyellow shape=box style=filled]
	1365 -> "2716 | CC(=O)O" [label=""]
	"2717 | ClC(Cl)(Cl)Cl" [color=lightyellow shape=box style=filled]
	1365 -> "2717 | ClC(Cl)(Cl)Cl" [label=""]
	"2718 | O=C(O)CBr" [color=lightyellow shape=box style=filled]
	1366 -> "2718 | O=C(O)CBr" [label=""]
	"2719 | Cl" [color=lightyellow shape=box style=filled]
	1366 -> "2719 | Cl" [label=""]
	"2720 | O=CO" [color=lightyellow shape=box style=filled]
	1367 -> "2720 | O=CO" [label=""]
	"2721 | ClCCl" [color=lightyellow shape=box style=filled]
	1367 -> "2721 | ClCCl" [label=""]
	"2722 | CCl" [color=lightyellow shape=box style=filled]
	1368 -> "2722 | CCl" [label=""]
	"2723 | O=C=O" [color=lightyellow shape=box style=filled]
	1368 -> "2723 | O=C=O" [label=""]
	"2724 | CC(=O)O" [color=lightyellow shape=box style=filled]
	1369 -> "2724 | CC(=O)O" [label=""]
	"2725 | ClCl" [color=lightyellow shape=box style=filled]
	1369 -> "2725 | ClCl" [label=""]
	"2726 | CC(=O)O" [color=lightyellow shape=box style=filled]
	1370 -> "2726 | CC(=O)O" [label=""]
	"2727 | OCl" [color=lightyellow shape=box style=filled]
	1370 -> "2727 | OCl" [label=""]
	"2728 | O=C(Cl)CCl" [color=lightgrey shape=box style=filled]
	1371 -> "2728 | O=C(Cl)CCl" [label=""]
	"2729 | O" [color=lightyellow shape=box style=filled]
	1371 -> "2729 | O" [label=""]
	"2730 | CCl" [color=lightyellow shape=box style=filled]
	1372 -> "2730 | CCl" [label=""]
	"2731 | O=C(O)O" [color=lightyellow shape=box style=filled]
	1372 -> "2731 | O=C(O)O" [label=""]
	"2732 | CCl" [color=lightyellow shape=box style=filled]
	1373 -> "2732 | CCl" [label=""]
	"2733 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	1373 -> "2733 | O=C(O)Cl" [label=""]
	"2734 | O=C(Cl)Br" [color=lightgrey shape=box style=filled]
	1374 -> "2734 | O=C(Cl)Br" [label=""]
	"2735 | C=O" [color=lightyellow shape=box style=filled]
	1374 -> "2735 | C=O" [label=""]
	"2736 | O=CO" [color=lightyellow shape=box style=filled]
	1375 -> "2736 | O=CO" [label=""]
	"2737 | O=CBr" [color=lightgrey shape=box style=filled]
	1375 -> "2737 | O=CBr" [label=""]
	"2738 | O=CBr" [color=lightgrey shape=box style=filled]
	1376 -> "2738 | O=CBr" [label=""]
	"2739 | CN(C)C=O" [color=lightyellow shape=box style=filled]
	1376 -> "2739 | CN(C)C=O" [label=""]
	"2740 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	1377 -> "2740 | O=C1CCC(=O)N1Br" [label=""]
	"2741 | O=CC=O" [color=lightyellow shape=box style=filled]
	1377 -> "2741 | O=CC=O" [label=""]
	"2742 | O=C(O)Br" [color=lightgrey shape=box style=filled]
	1378 -> "2742 | O=C(O)Br" [label=""]
	"2743 | C=O" [color=lightyellow shape=box style=filled]
	1378 -> "2743 | C=O" [label=""]
	"2744 | O=C(Br)Br" [color=lightgrey shape=box style=filled]
	1379 -> "2744 | O=C(Br)Br" [label=""]
	"2745 | C=O" [color=lightyellow shape=box style=filled]
	1379 -> "2745 | C=O" [label=""]
	"2746 | Br" [color=lightyellow shape=box style=filled]
	1380 -> "2746 | Br" [label=""]
	"2747 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	1380 -> "2747 | O=CC(=O)O" [label=""]
	"2748 | O=C(Cl)Br" [color=lightgrey shape=box style=filled]
	1381 -> "2748 | O=C(Cl)Br" [label=""]
	"2749 | CN(C)C=O" [color=lightyellow shape=box style=filled]
	1381 -> "2749 | CN(C)C=O" [label=""]
	"2750 | O=C(Br)Br" [color=lightgrey shape=box style=filled]
	1382 -> "2750 | O=C(Br)Br" [label=""]
	"2751 | CN(C)C=O" [color=lightyellow shape=box style=filled]
	1382 -> "2751 | CN(C)C=O" [label=""]
	"2752 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	1383 -> "2752 | O=C1CCC(=O)N1Br" [label=""]
	"2753 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	1383 -> "2753 | O=CC(=O)O" [label=""]
	"2754 | O=C(Cl)Br" [color=lightgrey shape=box style=filled]
	1384 -> "2754 | O=C(Cl)Br" [label=""]
	"2755 | C=O" [color=lightyellow shape=box style=filled]
	1384 -> "2755 | C=O" [label=""]
	"2756 | O=CO" [color=lightyellow shape=box style=filled]
	1385 -> "2756 | O=CO" [label=""]
	"2757 | O=CBr" [color=lightgrey shape=box style=filled]
	1385 -> "2757 | O=CBr" [label=""]
	"2758 | O=CBr" [color=lightgrey shape=box style=filled]
	1386 -> "2758 | O=CBr" [label=""]
	"2759 | CN(C)C=O" [color=lightyellow shape=box style=filled]
	1386 -> "2759 | CN(C)C=O" [label=""]
	"2760 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	1387 -> "2760 | O=C1CCC(=O)N1Br" [label=""]
	"2761 | O=CC=O" [color=lightyellow shape=box style=filled]
	1387 -> "2761 | O=CC=O" [label=""]
	"2762 | O=C(O)Br" [color=lightgrey shape=box style=filled]
	1388 -> "2762 | O=C(O)Br" [label=""]
	"2763 | C=O" [color=lightyellow shape=box style=filled]
	1388 -> "2763 | C=O" [label=""]
	"2764 | O=C(Br)Br" [color=lightgrey shape=box style=filled]
	1389 -> "2764 | O=C(Br)Br" [label=""]
	"2765 | C=O" [color=lightyellow shape=box style=filled]
	1389 -> "2765 | C=O" [label=""]
	"2766 | Br" [color=lightyellow shape=box style=filled]
	1390 -> "2766 | Br" [label=""]
	"2767 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	1390 -> "2767 | O=CC(=O)O" [label=""]
	"2768 | O=C(Cl)Br" [color=lightgrey shape=box style=filled]
	1391 -> "2768 | O=C(Cl)Br" [label=""]
	"2769 | CN(C)C=O" [color=lightyellow shape=box style=filled]
	1391 -> "2769 | CN(C)C=O" [label=""]
	"2770 | O=C(Br)Br" [color=lightgrey shape=box style=filled]
	1392 -> "2770 | O=C(Br)Br" [label=""]
	"2771 | CN(C)C=O" [color=lightyellow shape=box style=filled]
	1392 -> "2771 | CN(C)C=O" [label=""]
	"2772 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	1393 -> "2772 | O=C1CCC(=O)N1Br" [label=""]
	"2773 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	1393 -> "2773 | O=CC(=O)O" [label=""]
	"2774 | O=CO" [color=lightyellow shape=box style=filled]
	1394 -> "2774 | O=CO" [label=""]
	"2775 | O=C(Cl)Cl" [color=lightyellow shape=box style=filled]
	1394 -> "2775 | O=C(Cl)Cl" [label=""]
	"2776 | O=C(Cl)Cl" [color=lightyellow shape=box style=filled]
	1395 -> "2776 | O=C(Cl)Cl" [label=""]
	"2777 | O=C=O" [color=lightyellow shape=box style=filled]
	1395 -> "2777 | O=C=O" [label=""]
	"2778 | O=CCl" [color=lightgrey shape=box style=filled]
	1396 -> "2778 | O=CCl" [label=""]
	"2779 | O=C=O" [color=lightyellow shape=box style=filled]
	1396 -> "2779 | O=C=O" [label=""]
	"2780 | O=C(Cl)CO" [color=lightgrey shape=box style=filled]
	1397 -> "2780 | O=C(Cl)CO" [label=""]
	"2781 | O=C(OO)c1cccc(Cl)c1" [color=lightyellow shape=box style=filled]
	1397 -> "2781 | O=C(OO)c1cccc(Cl)c1" [label=""]
	"2782 | O=C(Cl)C(=O)Cl" [color=lightyellow shape=box style=filled]
	1398 -> "2782 | O=C(Cl)C(=O)Cl" [label=""]
	"2783 | O" [color=lightyellow shape=box style=filled]
	1398 -> "2783 | O" [label=""]
	"2784 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	1399 -> "2784 | O=CC(=O)O" [label=""]
	"2785 | O=C(CCl)[O+]=[O+]O" [color=lightgrey shape=box style=filled]
	1399 -> "2785 | O=C(CCl)[O+]=[O+]O" [label=""]
	"2786 | CC(=O)O" [color=lightyellow shape=box style=filled]
	1400 -> "2786 | CC(=O)O" [label=""]
	"2787 | O=C([O+]=[O+]O)C(Cl)Cl" [color=lightgrey shape=box style=filled]
	1400 -> "2787 | O=C([O+]=[O+]O)C(Cl)Cl" [label=""]
	"2788 | O=C([O+]=[O+]O)C(Cl)Cl" [color=lightgrey shape=box style=filled]
	1401 -> "2788 | O=C([O+]=[O+]O)C(Cl)Cl" [label=""]
	"2789 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	1401 -> "2789 | O=CC(=O)O" [label=""]
	"2790 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	1402 -> "2790 | O=C1CCC(=O)N1Br" [label=""]
	"2791 | ClBr" [color=lightgrey shape=box style=filled]
	1402 -> "2791 | ClBr" [label=""]
	"2792 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1403 -> "2792 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"2793 | NC1C(=O)N[C@@H]1S(=O)C(=O)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1403 -> "2793 | NC1C(=O)N[C@@H]1S(=O)C(=O)CC(=O)Br" [label=""]
	"2794 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1404 -> "2794 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [label=""]
	"2795 | O=CCC(=O)Br" [color=lightgrey shape=box style=filled]
	1404 -> "2795 | O=CCC(=O)Br" [label=""]
	"2796 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=O)cs1" [color=lightgrey shape=box style=filled]
	1405 -> "2796 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=O)cs1" [label=""]
	"2797 | O=C(O)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1405 -> "2797 | O=C(O)CC(=O)Br" [label=""]
	"2798 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1406 -> "2798 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [label=""]
	"2799 | O=C(O)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1406 -> "2799 | O=C(O)CC(=O)Br" [label=""]
	"2800 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1407 -> "2800 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [label=""]
	"2801 | O=C(O)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1407 -> "2801 | O=C(O)CC(=O)Br" [label=""]
	"2802 | CC(=O)C(C)(C=O)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	1408 -> "2802 | CC(=O)C(C)(C=O)OC(=O)Cl" [label=""]
	"2803 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" [color=lightgrey shape=box style=filled]
	1408 -> "2803 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" [label=""]
	"2804 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=O)cs1" [color=lightgrey shape=box style=filled]
	1409 -> "2804 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=O)cs1" [label=""]
	"2805 | O=C(Cl)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1409 -> "2805 | O=C(Cl)CC(=O)Br" [label=""]
	"2806 | O=CCC(=O)Br" [color=lightgrey shape=box style=filled]
	1410 -> "2806 | O=CCC(=O)Br" [label=""]
	"2807 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)Cl)cs1" [color=lightgrey shape=box style=filled]
	1410 -> "2807 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)Cl)cs1" [label=""]
	"2808 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1411 -> "2808 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [label=""]
	"2809 | O=C(Cl)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1411 -> "2809 | O=C(Cl)CC(=O)Br" [label=""]
	"2810 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)CC(=O)Br)cs1" [color=lightgrey shape=box style=filled]
	1412 -> "2810 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)CC(=O)Br)cs1" [label=""]
	"2811 | O=C(OO)c1cccc(Cl)c1" [color=lightyellow shape=box style=filled]
	1412 -> "2811 | O=C(OO)c1cccc(Cl)c1" [label=""]
	"2812 | CC(=O)C(C)(C=O)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	1413 -> "2812 | CC(=O)C(C)(C=O)OC(=O)Cl" [label=""]
	"2813 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1413 -> "2813 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"2814 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1414 -> "2814 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"2815 | CC(=O)C(C)(C=O)OC(=O)OC(=O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	1414 -> "2815 | CC(=O)C(C)(C=O)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"2816 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1415 -> "2816 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"2817 | CC(=O)C(C)(C=O)OC(=O)Br" [color=lightgrey shape=box style=filled]
	1415 -> "2817 | CC(=O)C(C)(C=O)OC(=O)Br" [label=""]
	"2818 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1416 -> "2818 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"2819 | O=CO" [color=lightyellow shape=box style=filled]
	1416 -> "2819 | O=CO" [label=""]
	"2820 | CC(=O)C(C)(O)C=O" [color=lightyellow shape=box style=filled]
	1416 -> "2820 | CC(=O)C(C)(O)C=O" [label=""]
	"2821 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1417 -> "2821 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"2822 | CC(=O)C(C)(C=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	1417 -> "2822 | CC(=O)C(C)(C=O)OC(=O)O" [label=""]
	"2823 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(CO)cs1" [color=lightgrey shape=box style=filled]
	1418 -> "2823 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(CO)cs1" [label=""]
	"2824 | O=C=O" [color=lightyellow shape=box style=filled]
	1418 -> "2824 | O=C=O" [label=""]
	"2825 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1419 -> "2825 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"2826 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	1419 -> "2826 | CC(C)(C)OC(=O)OC(=O)OC(C)(C)C" [label=""]
	"2827 | CC(=O)C(C)(C=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	1419 -> "2827 | CC(=O)C(C)(C=O)OC(=O)O" [label=""]
	"2828 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1420 -> "2828 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"2829 | CC(C)(C)OC(=O)Cl" [color=lightyellow shape=box style=filled]
	1420 -> "2829 | CC(C)(C)OC(=O)Cl" [label=""]
	"2830 | CC(=O)C(C)(C=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	1420 -> "2830 | CC(=O)C(C)(C=O)OC(=O)O" [label=""]
	"2831 | CC(C)(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	1421 -> "2831 | CC(C)(C)OC(=O)O" [label=""]
	"2832 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1421 -> "2832 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"2833 | CC(=O)C(C)(C=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	1421 -> "2833 | CC(=O)C(C)(C=O)OC(=O)O" [label=""]
	"2834 | O=CNc1nc(C(=O)C(=O)O)cs1" [color=lightyellow shape=box style=filled]
	1422 -> "2834 | O=CNc1nc(C(=O)C(=O)O)cs1" [label=""]
	"2835 | CC(=O)C(C)(O)C=O" [color=lightyellow shape=box style=filled]
	1422 -> "2835 | CC(=O)C(C)(O)C=O" [label=""]
	"2836 | O=C(O)C(Cl)Cl" [color=lightyellow shape=box style=filled]
	1423 -> "2836 | O=C(O)C(Cl)Cl" [label=""]
	"2837 | NC1C(=O)N[C@@H]1S(=O)C(=O)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1423 -> "2837 | NC1C(=O)N[C@@H]1S(=O)C(=O)CC(=O)Br" [label=""]
	"2838 | CC(C)(C)OC(=O)NC1C(=O)N[C@@H]1S(=O)C(=O)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1424 -> "2838 | CC(C)(C)OC(=O)NC1C(=O)N[C@@H]1S(=O)C(=O)CC(=O)Br" [label=""]
	"2839 | O=C(O)CCl" [color=lightgrey shape=box style=filled]
	1424 -> "2839 | O=C(O)CCl" [label=""]
	"2840 | O=C(O)C(Cl)Br" [color=lightyellow shape=box style=filled]
	1425 -> "2840 | O=C(O)C(Cl)Br" [label=""]
	"2841 | NC1C(=O)N[C@@H]1S(=O)C(=O)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1425 -> "2841 | NC1C(=O)N[C@@H]1S(=O)C(=O)CC(=O)Br" [label=""]
	"2842 | O=C(O)C(O)Cl" [color=lightgrey shape=box style=filled]
	1426 -> "2842 | O=C(O)C(O)Cl" [label=""]
	"2843 | NC1C(=O)N[C@@H]1S(=O)C(=O)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1426 -> "2843 | NC1C(=O)N[C@@H]1S(=O)C(=O)CC(=O)Br" [label=""]
	"2844 | O=NC1C(=O)N[C@@H]1[S](=O)=O" [color=lightgrey shape=box style=filled]
	1427 -> "2844 | O=NC1C(=O)N[C@@H]1[S](=O)=O" [label=""]
	"2845 | O=C(Cl)Br" [color=lightgrey shape=box style=filled]
	1427 -> "2845 | O=C(Cl)Br" [label=""]
	"2846 | O=CC=C(Cl)C(=O)[O+]=O" [color=lightgrey shape=box style=filled]
	1427 -> "2846 | O=CC=C(Cl)C(=O)[O+]=O" [label=""]
	"2847 | OO" [color=lightyellow shape=box style=filled]
	1427 -> "2847 | OO" [label=""]
	"2848 | CC(=O)O" [color=lightyellow shape=box style=filled]
	1428 -> "2848 | CC(=O)O" [label=""]
	"2849 | ClC(Cl)(Cl)Cl" [color=lightyellow shape=box style=filled]
	1428 -> "2849 | ClC(Cl)(Cl)Cl" [label=""]
	"2850 | O=C(O)CBr" [color=lightyellow shape=box style=filled]
	1429 -> "2850 | O=C(O)CBr" [label=""]
	"2851 | Cl" [color=lightyellow shape=box style=filled]
	1429 -> "2851 | Cl" [label=""]
	"2852 | O=CO" [color=lightyellow shape=box style=filled]
	1430 -> "2852 | O=CO" [label=""]
	"2853 | ClCCl" [color=lightyellow shape=box style=filled]
	1430 -> "2853 | ClCCl" [label=""]
	"2854 | CCl" [color=lightyellow shape=box style=filled]
	1431 -> "2854 | CCl" [label=""]
	"2855 | O=C=O" [color=lightyellow shape=box style=filled]
	1431 -> "2855 | O=C=O" [label=""]
	"2856 | CC(=O)O" [color=lightyellow shape=box style=filled]
	1432 -> "2856 | CC(=O)O" [label=""]
	"2857 | ClCl" [color=lightyellow shape=box style=filled]
	1432 -> "2857 | ClCl" [label=""]
	"2858 | CC(=O)O" [color=lightyellow shape=box style=filled]
	1433 -> "2858 | CC(=O)O" [label=""]
	"2859 | OCl" [color=lightyellow shape=box style=filled]
	1433 -> "2859 | OCl" [label=""]
	"2860 | O=C(Cl)CCl" [color=lightgrey shape=box style=filled]
	1434 -> "2860 | O=C(Cl)CCl" [label=""]
	"2861 | O" [color=lightyellow shape=box style=filled]
	1434 -> "2861 | O" [label=""]
	"2862 | CCl" [color=lightyellow shape=box style=filled]
	1435 -> "2862 | CCl" [label=""]
	"2863 | O=C(O)O" [color=lightyellow shape=box style=filled]
	1435 -> "2863 | O=C(O)O" [label=""]
	"2864 | CCl" [color=lightyellow shape=box style=filled]
	1436 -> "2864 | CCl" [label=""]
	"2865 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	1436 -> "2865 | O=C(O)Cl" [label=""]
	"2866 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(=O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1437 -> "2866 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(=O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [label=""]
	"2867 | O=CCC(=O)Br" [color=lightgrey shape=box style=filled]
	1437 -> "2867 | O=CCC(=O)Br" [label=""]
	"2868 | NC1C(=O)N[C@@H]1S(=O)C(=O)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1438 -> "2868 | NC1C(=O)N[C@@H]1S(=O)C(=O)CC(=O)Br" [label=""]
	"2869 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(=O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1438 -> "2869 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(=O)C(=O)O)cs1" [label=""]
	"2870 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(=O)C(=O)NC2C(=O)N[C@@H]2[S]=O)cs1" [color=lightgrey shape=box style=filled]
	1439 -> "2870 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(=O)C(=O)NC2C(=O)N[C@@H]2[S]=O)cs1" [label=""]
	"2871 | O=C(O)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1439 -> "2871 | O=C(O)CC(=O)Br" [label=""]
	"2872 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(=O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1440 -> "2872 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(=O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [label=""]
	"2873 | O=C(O)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1440 -> "2873 | O=C(O)CC(=O)Br" [label=""]
	"2874 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(=O)C(=O)NC2C(=O)N[C@@H]2SC(=O)CC(=O)Br)cs1" [color=lightgrey shape=box style=filled]
	1441 -> "2874 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(=O)C(=O)NC2C(=O)N[C@@H]2SC(=O)CC(=O)Br)cs1" [label=""]
	"2875 | O=C(OO)c1cccc(Cl)c1" [color=lightyellow shape=box style=filled]
	1441 -> "2875 | O=C(OO)c1cccc(Cl)c1" [label=""]
	"2876 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(=O)C(=O)NC2C(=O)N[C@@H]2[S]=O)cs1" [color=lightgrey shape=box style=filled]
	1442 -> "2876 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(=O)C(=O)NC2C(=O)N[C@@H]2[S]=O)cs1" [label=""]
	"2877 | O=C(Cl)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1442 -> "2877 | O=C(Cl)CC(=O)Br" [label=""]
	"2878 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(=O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1443 -> "2878 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(=O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [label=""]
	"2879 | CCOC(=O)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1443 -> "2879 | CCOC(=O)CC(=O)Br" [label=""]
	"2880 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(=O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1444 -> "2880 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(=O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [label=""]
	"2881 | O=C(O)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1444 -> "2881 | O=C(O)CC(=O)Br" [label=""]
	"2882 | CC(=O)C(C)(C=O)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	1445 -> "2882 | CC(=O)C(C)(C=O)OC(=O)Cl" [label=""]
	"2883 | Nc1nc(C(=O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" [color=lightgrey shape=box style=filled]
	1445 -> "2883 | Nc1nc(C(=O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" [label=""]
	"2884 | O=CCC(=O)Br" [color=lightgrey shape=box style=filled]
	1446 -> "2884 | O=CCC(=O)Br" [label=""]
	"2885 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(=O)C(=O)NC2C(=O)N[C@@H]2S(=O)Cl)cs1" [color=lightgrey shape=box style=filled]
	1446 -> "2885 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(=O)C(=O)NC2C(=O)N[C@@H]2S(=O)Cl)cs1" [label=""]
	"2886 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1447 -> "2886 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"2887 | NC1C(=O)N[C@@H]1S(=O)C(=O)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1447 -> "2887 | NC1C(=O)N[C@@H]1S(=O)C(=O)CC(=O)Br" [label=""]
	"2888 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1448 -> "2888 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [label=""]
	"2889 | O=CCC(=O)Br" [color=lightgrey shape=box style=filled]
	1448 -> "2889 | O=CCC(=O)Br" [label=""]
	"2890 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=O)cs1" [color=lightgrey shape=box style=filled]
	1449 -> "2890 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=O)cs1" [label=""]
	"2891 | O=C(O)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1449 -> "2891 | O=C(O)CC(=O)Br" [label=""]
	"2892 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1450 -> "2892 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [label=""]
	"2893 | O=C(O)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1450 -> "2893 | O=C(O)CC(=O)Br" [label=""]
	"2894 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1451 -> "2894 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [label=""]
	"2895 | O=C(O)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1451 -> "2895 | O=C(O)CC(=O)Br" [label=""]
	"2896 | CC(=O)C(C)(C=O)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	1452 -> "2896 | CC(=O)C(C)(C=O)OC(=O)Cl" [label=""]
	"2897 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" [color=lightgrey shape=box style=filled]
	1452 -> "2897 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" [label=""]
	"2898 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=O)cs1" [color=lightgrey shape=box style=filled]
	1453 -> "2898 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=O)cs1" [label=""]
	"2899 | O=C(Cl)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1453 -> "2899 | O=C(Cl)CC(=O)Br" [label=""]
	"2900 | O=CCC(=O)Br" [color=lightgrey shape=box style=filled]
	1454 -> "2900 | O=CCC(=O)Br" [label=""]
	"2901 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)Cl)cs1" [color=lightgrey shape=box style=filled]
	1454 -> "2901 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)Cl)cs1" [label=""]
	"2902 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1455 -> "2902 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [label=""]
	"2903 | O=C(Cl)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1455 -> "2903 | O=C(Cl)CC(=O)Br" [label=""]
	"2904 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)CC(=O)Br)cs1" [color=lightgrey shape=box style=filled]
	1456 -> "2904 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)CC(=O)Br)cs1" [label=""]
	"2905 | O=C(OO)c1cccc(Cl)c1" [color=lightyellow shape=box style=filled]
	1456 -> "2905 | O=C(OO)c1cccc(Cl)c1" [label=""]
	"2906 | O=CO" [color=lightyellow shape=box style=filled]
	1457 -> "2906 | O=CO" [label=""]
	"2907 | O=C(Cl)Cl" [color=lightyellow shape=box style=filled]
	1457 -> "2907 | O=C(Cl)Cl" [label=""]
	"2908 | O=C(Cl)Cl" [color=lightyellow shape=box style=filled]
	1458 -> "2908 | O=C(Cl)Cl" [label=""]
	"2909 | O=C=O" [color=lightyellow shape=box style=filled]
	1458 -> "2909 | O=C=O" [label=""]
	"2910 | O=CCl" [color=lightgrey shape=box style=filled]
	1459 -> "2910 | O=CCl" [label=""]
	"2911 | O=C=O" [color=lightyellow shape=box style=filled]
	1459 -> "2911 | O=C=O" [label=""]
	"2912 | O=C(Cl)CO" [color=lightgrey shape=box style=filled]
	1460 -> "2912 | O=C(Cl)CO" [label=""]
	"2913 | O=C(OO)c1cccc(Cl)c1" [color=lightyellow shape=box style=filled]
	1460 -> "2913 | O=C(OO)c1cccc(Cl)c1" [label=""]
	"2914 | O=C(Cl)C(=O)Cl" [color=lightyellow shape=box style=filled]
	1461 -> "2914 | O=C(Cl)C(=O)Cl" [label=""]
	"2915 | O" [color=lightyellow shape=box style=filled]
	1461 -> "2915 | O" [label=""]
	"2916 | O=C(Cl)Cl" [color=lightyellow shape=box style=filled]
	1462 -> "2916 | O=C(Cl)Cl" [label=""]
	"2917 | CC(=O)C(C)(O)C=O" [color=lightyellow shape=box style=filled]
	1462 -> "2917 | CC(=O)C(C)(O)C=O" [label=""]
	"2918 | [O]C(=O)Cl" [color=lightgrey shape=box style=filled]
	1463 -> "2918 | [O]C(=O)Cl" [label=""]
	"2919 | C[C]C(C)=O" [color=lightgrey shape=box style=filled]
	1463 -> "2919 | C[C]C(C)=O" [label=""]
	"2920 | [CH]=O" [color=lightgrey shape=box style=filled]
	1463 -> "2920 | [CH]=O" [label=""]
	"2921 | C=C(C=O)C(C)=O" [color=lightgrey shape=box style=filled]
	1464 -> "2921 | C=C(C=O)C(C)=O" [label=""]
	"2922 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	1464 -> "2922 | O=C(O)Cl" [label=""]
	"2923 | CN(C)C=O" [color=lightyellow shape=box style=filled]
	1465 -> "2923 | CN(C)C=O" [label=""]
	"2924 | CC(=O)C(C)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	1465 -> "2924 | CC(=O)C(C)OC(=O)Cl" [label=""]
	"2925 | [O]C(=O)Cl" [color=lightgrey shape=box style=filled]
	1466 -> "2925 | [O]C(=O)Cl" [label=""]
	"2926 | CC(=O)[C]C=O" [color=lightgrey shape=box style=filled]
	1466 -> "2926 | CC(=O)[C]C=O" [label=""]
	"2927 | [CH3]" [color=lightyellow shape=box style=filled]
	1466 -> "2927 | [CH3]" [label=""]
	"2928 | CN(C)C=O" [color=lightyellow shape=box style=filled]
	1467 -> "2928 | CN(C)C=O" [label=""]
	"2929 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	1467 -> "2929 | O=C(O)Cl" [label=""]
	"2930 | CCC(C)=O" [color=lightyellow shape=box style=filled]
	1467 -> "2930 | CCC(C)=O" [label=""]
	"2931 | CC(=O)C(C)(Br)C=O" [color=lightgrey shape=box style=filled]
	1468 -> "2931 | CC(=O)C(C)(Br)C=O" [label=""]
	"2932 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	1468 -> "2932 | O=C(O)Cl" [label=""]
	"2933 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	1469 -> "2933 | O=C(O)Cl" [label=""]
	"2934 | CI" [color=lightyellow shape=box style=filled]
	1469 -> "2934 | CI" [label=""]
	"2935 | CC(=O)CC=O" [color=lightyellow shape=box style=filled]
	1469 -> "2935 | CC(=O)CC=O" [label=""]
	"2936 | CO" [color=lightyellow shape=box style=filled]
	1470 -> "2936 | CO" [label=""]
	"2937 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	1470 -> "2937 | O=C(O)Cl" [label=""]
	"2938 | CC(=O)CC=O" [color=lightyellow shape=box style=filled]
	1470 -> "2938 | CC(=O)CC=O" [label=""]
	"2939 | C=O" [color=lightyellow shape=box style=filled]
	1471 -> "2939 | C=O" [label=""]
	"2940 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	1471 -> "2940 | O=C(O)Cl" [label=""]
	"2941 | CC(=O)CC=O" [color=lightyellow shape=box style=filled]
	1471 -> "2941 | CC(=O)CC=O" [label=""]
	"2942 | CC(=O)O" [color=lightyellow shape=box style=filled]
	1472 -> "2942 | CC(=O)O" [label=""]
	"2943 | ClC(Cl)(Cl)Cl" [color=lightyellow shape=box style=filled]
	1472 -> "2943 | ClC(Cl)(Cl)Cl" [label=""]
	"2944 | O=C(O)CBr" [color=lightyellow shape=box style=filled]
	1473 -> "2944 | O=C(O)CBr" [label=""]
	"2945 | Cl" [color=lightyellow shape=box style=filled]
	1473 -> "2945 | Cl" [label=""]
	"2946 | O=CO" [color=lightyellow shape=box style=filled]
	1474 -> "2946 | O=CO" [label=""]
	"2947 | ClCCl" [color=lightyellow shape=box style=filled]
	1474 -> "2947 | ClCCl" [label=""]
	"2948 | CCl" [color=lightyellow shape=box style=filled]
	1475 -> "2948 | CCl" [label=""]
	"2949 | O=C=O" [color=lightyellow shape=box style=filled]
	1475 -> "2949 | O=C=O" [label=""]
	"2950 | CC(=O)O" [color=lightyellow shape=box style=filled]
	1476 -> "2950 | CC(=O)O" [label=""]
	"2951 | ClCl" [color=lightyellow shape=box style=filled]
	1476 -> "2951 | ClCl" [label=""]
	"2952 | CC(=O)O" [color=lightyellow shape=box style=filled]
	1477 -> "2952 | CC(=O)O" [label=""]
	"2953 | OCl" [color=lightyellow shape=box style=filled]
	1477 -> "2953 | OCl" [label=""]
	"2954 | O=C(Cl)CCl" [color=lightgrey shape=box style=filled]
	1478 -> "2954 | O=C(Cl)CCl" [label=""]
	"2955 | O" [color=lightyellow shape=box style=filled]
	1478 -> "2955 | O" [label=""]
	"2956 | CCl" [color=lightyellow shape=box style=filled]
	1479 -> "2956 | CCl" [label=""]
	"2957 | O=C(O)O" [color=lightyellow shape=box style=filled]
	1479 -> "2957 | O=C(O)O" [label=""]
	"2958 | CCl" [color=lightyellow shape=box style=filled]
	1480 -> "2958 | CCl" [label=""]
	"2959 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	1480 -> "2959 | O=C(O)Cl" [label=""]
	"2960 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1481 -> "2960 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"2961 | NC1C(=O)N[C@@H]1S(=O)C(=O)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1481 -> "2961 | NC1C(=O)N[C@@H]1S(=O)C(=O)CC(=O)Br" [label=""]
	"2962 | O=CCC(=O)Br" [color=lightgrey shape=box style=filled]
	1482 -> "2962 | O=CCC(=O)Br" [label=""]
	"2963 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1482 -> "2963 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [label=""]
	"2964 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=O)cs1" [color=lightgrey shape=box style=filled]
	1483 -> "2964 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=O)cs1" [label=""]
	"2965 | O=C(O)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1483 -> "2965 | O=C(O)CC(=O)Br" [label=""]
	"2966 | O=C(O)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1484 -> "2966 | O=C(O)CC(=O)Br" [label=""]
	"2967 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1484 -> "2967 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [label=""]
	"2968 | O=C(O)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1485 -> "2968 | O=C(O)CC(=O)Br" [label=""]
	"2969 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1485 -> "2969 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [label=""]
	"2970 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=O)cs1" [color=lightgrey shape=box style=filled]
	1486 -> "2970 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=O)cs1" [label=""]
	"2971 | O=C(Cl)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1486 -> "2971 | O=C(Cl)CC(=O)Br" [label=""]
	"2972 | O=C(OO)c1cccc(Cl)c1" [color=lightyellow shape=box style=filled]
	1487 -> "2972 | O=C(OO)c1cccc(Cl)c1" [label=""]
	"2973 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)CC(=O)Br)cs1" [color=lightgrey shape=box style=filled]
	1487 -> "2973 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)CC(=O)Br)cs1" [label=""]
	"2974 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)Cl)cs1" [color=lightgrey shape=box style=filled]
	1488 -> "2974 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)Cl)cs1" [label=""]
	"2975 | O=CCC(=O)Br" [color=lightgrey shape=box style=filled]
	1488 -> "2975 | O=CCC(=O)Br" [label=""]
	"2976 | O=C(Cl)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1489 -> "2976 | O=C(Cl)CC(=O)Br" [label=""]
	"2977 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1489 -> "2977 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [label=""]
	"2978 | CCOC(=O)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1490 -> "2978 | CCOC(=O)CC(=O)Br" [label=""]
	"2979 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1490 -> "2979 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [label=""]
	"2980 | O=C(Cl)Cl" [color=lightyellow shape=box style=filled]
	1491 -> "2980 | O=C(Cl)Cl" [label=""]
	"2981 | CC(=O)C(C)(O)C=O" [color=lightyellow shape=box style=filled]
	1491 -> "2981 | CC(=O)C(C)(O)C=O" [label=""]
	"2982 | [O]C(=O)Cl" [color=lightgrey shape=box style=filled]
	1492 -> "2982 | [O]C(=O)Cl" [label=""]
	"2983 | C[C]C(C)=O" [color=lightgrey shape=box style=filled]
	1492 -> "2983 | C[C]C(C)=O" [label=""]
	"2984 | [CH]=O" [color=lightgrey shape=box style=filled]
	1492 -> "2984 | [CH]=O" [label=""]
	"2985 | C=C(C=O)C(C)=O" [color=lightgrey shape=box style=filled]
	1493 -> "2985 | C=C(C=O)C(C)=O" [label=""]
	"2986 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	1493 -> "2986 | O=C(O)Cl" [label=""]
	"2987 | CN(C)C=O" [color=lightyellow shape=box style=filled]
	1494 -> "2987 | CN(C)C=O" [label=""]
	"2988 | CC(=O)C(C)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	1494 -> "2988 | CC(=O)C(C)OC(=O)Cl" [label=""]
	"2989 | [O]C(=O)Cl" [color=lightgrey shape=box style=filled]
	1495 -> "2989 | [O]C(=O)Cl" [label=""]
	"2990 | CC(=O)[C]C=O" [color=lightgrey shape=box style=filled]
	1495 -> "2990 | CC(=O)[C]C=O" [label=""]
	"2991 | [CH3]" [color=lightyellow shape=box style=filled]
	1495 -> "2991 | [CH3]" [label=""]
	"2992 | CN(C)C=O" [color=lightyellow shape=box style=filled]
	1496 -> "2992 | CN(C)C=O" [label=""]
	"2993 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	1496 -> "2993 | O=C(O)Cl" [label=""]
	"2994 | CCC(C)=O" [color=lightyellow shape=box style=filled]
	1496 -> "2994 | CCC(C)=O" [label=""]
	"2995 | CC(=O)C(C)(Br)C=O" [color=lightgrey shape=box style=filled]
	1497 -> "2995 | CC(=O)C(C)(Br)C=O" [label=""]
	"2996 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	1497 -> "2996 | O=C(O)Cl" [label=""]
	"2997 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	1498 -> "2997 | O=C(O)Cl" [label=""]
	"2998 | CI" [color=lightyellow shape=box style=filled]
	1498 -> "2998 | CI" [label=""]
	"2999 | CC(=O)CC=O" [color=lightyellow shape=box style=filled]
	1498 -> "2999 | CC(=O)CC=O" [label=""]
	"3000 | CO" [color=lightyellow shape=box style=filled]
	1499 -> "3000 | CO" [label=""]
	"3001 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	1499 -> "3001 | O=C(O)Cl" [label=""]
	"3002 | CC(=O)CC=O" [color=lightyellow shape=box style=filled]
	1499 -> "3002 | CC(=O)CC=O" [label=""]
	"3003 | C=O" [color=lightyellow shape=box style=filled]
	1500 -> "3003 | C=O" [label=""]
	"3004 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	1500 -> "3004 | O=C(O)Cl" [label=""]
	"3005 | CC(=O)CC=O" [color=lightyellow shape=box style=filled]
	1500 -> "3005 | CC(=O)CC=O" [label=""]
	"3006 | O=C(O)C(Cl)Cl" [color=lightyellow shape=box style=filled]
	1501 -> "3006 | O=C(O)C(Cl)Cl" [label=""]
	"3007 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" [color=lightgrey shape=box style=filled]
	1501 -> "3007 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" [label=""]
	"3008 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1502 -> "3008 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"3009 | NC1C(=O)N[C@@H]1S(=O)C(=O)C(C(=O)Br)=C(Cl)C(=O)O" [color=lightgrey shape=box style=filled]
	1502 -> "3009 | NC1C(=O)N[C@@H]1S(=O)C(=O)C(C(=O)Br)=C(Cl)C(=O)O" [label=""]
	"3010 | O=C(O)C(=O)Cl" [color=lightgrey shape=box style=filled]
	1503 -> "3010 | O=C(O)C(=O)Cl" [label=""]
	"3011 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" [color=lightgrey shape=box style=filled]
	1503 -> "3011 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" [label=""]
	"3012 | O=C(O)C(Cl)Br" [color=lightyellow shape=box style=filled]
	1504 -> "3012 | O=C(O)C(Cl)Br" [label=""]
	"3013 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" [color=lightgrey shape=box style=filled]
	1504 -> "3013 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" [label=""]
	"3014 | O=C(O)CCl" [color=lightgrey shape=box style=filled]
	1505 -> "3014 | O=C(O)CCl" [label=""]
	"3015 | Nc1nc(C(=O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" [color=lightgrey shape=box style=filled]
	1505 -> "3015 | Nc1nc(C(=O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" [label=""]
	"3016 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)C(Cl)C(=O)Br)cs1" [color=lightgrey shape=box style=filled]
	1506 -> "3016 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)C(Cl)C(=O)Br)cs1" [label=""]
	"3017 | O=C(O)CCl" [color=lightgrey shape=box style=filled]
	1506 -> "3017 | O=C(O)CCl" [label=""]
	"3018 | Nc1nc(C(O)C(=O)Cl)cs1" [color=lightgrey shape=box style=filled]
	1507 -> "3018 | Nc1nc(C(O)C(=O)Cl)cs1" [label=""]
	"3019 | NC1C(=O)N[C@@H]1S(=O)C(=O)C(C(=O)Br)=C(Cl)C(=O)O" [color=lightgrey shape=box style=filled]
	1507 -> "3019 | NC1C(=O)N[C@@H]1S(=O)C(=O)C(C(=O)Br)=C(Cl)C(=O)O" [label=""]
	"3020 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1508 -> "3020 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"3021 | NC1C(=O)N[C@@H]1S(=O)C(=O)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1508 -> "3021 | NC1C(=O)N[C@@H]1S(=O)C(=O)CC(=O)Br" [label=""]
	"3022 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1509 -> "3022 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [label=""]
	"3023 | O=CCC(=O)Br" [color=lightgrey shape=box style=filled]
	1509 -> "3023 | O=CCC(=O)Br" [label=""]
	"3024 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=O)cs1" [color=lightgrey shape=box style=filled]
	1510 -> "3024 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=O)cs1" [label=""]
	"3025 | O=C(O)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1510 -> "3025 | O=C(O)CC(=O)Br" [label=""]
	"3026 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1511 -> "3026 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [label=""]
	"3027 | O=C(O)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1511 -> "3027 | O=C(O)CC(=O)Br" [label=""]
	"3028 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1512 -> "3028 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [label=""]
	"3029 | O=C(O)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1512 -> "3029 | O=C(O)CC(=O)Br" [label=""]
	"3030 | CC(=O)C(C)(C=O)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	1513 -> "3030 | CC(=O)C(C)(C=O)OC(=O)Cl" [label=""]
	"3031 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" [color=lightgrey shape=box style=filled]
	1513 -> "3031 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)C(=O)CC(=O)Br)cs1" [label=""]
	"3032 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=O)cs1" [color=lightgrey shape=box style=filled]
	1514 -> "3032 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=O)cs1" [label=""]
	"3033 | O=C(Cl)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1514 -> "3033 | O=C(Cl)CC(=O)Br" [label=""]
	"3034 | O=CCC(=O)Br" [color=lightgrey shape=box style=filled]
	1515 -> "3034 | O=CCC(=O)Br" [label=""]
	"3035 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)Cl)cs1" [color=lightgrey shape=box style=filled]
	1515 -> "3035 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)Cl)cs1" [label=""]
	"3036 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1516 -> "3036 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [label=""]
	"3037 | O=C(Cl)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1516 -> "3037 | O=C(Cl)CC(=O)Br" [label=""]
	"3038 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)CC(=O)Br)cs1" [color=lightgrey shape=box style=filled]
	1517 -> "3038 | CC(=O)C(C)(C=O)OC(=O)Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)CC(=O)Br)cs1" [label=""]
	"3039 | O=C(OO)c1cccc(Cl)c1" [color=lightyellow shape=box style=filled]
	1517 -> "3039 | O=C(OO)c1cccc(Cl)c1" [label=""]
	"3040 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1518 -> "3040 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"3041 | NC1C(=O)N[C@@H]1S(=O)C(=O)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1518 -> "3041 | NC1C(=O)N[C@@H]1S(=O)C(=O)CC(=O)Br" [label=""]
	"3042 | O=CCC(=O)Br" [color=lightgrey shape=box style=filled]
	1519 -> "3042 | O=CCC(=O)Br" [label=""]
	"3043 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1519 -> "3043 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [label=""]
	"3044 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=O)cs1" [color=lightgrey shape=box style=filled]
	1520 -> "3044 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=O)cs1" [label=""]
	"3045 | O=C(Cl)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1520 -> "3045 | O=C(Cl)CC(=O)Br" [label=""]
	"3046 | O=C(O[O+])c1cccc(Cl)c1" [color=lightgrey shape=box style=filled]
	1521 -> "3046 | O=C(O[O+])c1cccc(Cl)c1" [label=""]
	"3047 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)CC(=O)Br)cs1" [color=lightgrey shape=box style=filled]
	1521 -> "3047 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)CC(=O)Br)cs1" [label=""]
	"3048 | O=C(Cl)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1522 -> "3048 | O=C(Cl)CC(=O)Br" [label=""]
	"3049 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1522 -> "3049 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [label=""]
	"3050 | O=C(Cl)Br" [color=lightgrey shape=box style=filled]
	1523 -> "3050 | O=C(Cl)Br" [label=""]
	"3051 | CC(=O)S(=O)[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1" [color=lightgrey shape=box style=filled]
	1523 -> "3051 | CC(=O)S(=O)[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1" [label=""]
	"3052 | O=CCC(=O)Br" [color=lightgrey shape=box style=filled]
	1524 -> "3052 | O=CCC(=O)Br" [label=""]
	"3053 | CCOS(=O)[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1" [color=lightgrey shape=box style=filled]
	1524 -> "3053 | CCOS(=O)[C@H]1NC(=O)C1NC(=O)C(O)c1csc(N)n1" [label=""]
	"3054 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=O)cs1" [color=lightgrey shape=box style=filled]
	1525 -> "3054 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=O)cs1" [label=""]
	"3055 | O=C(O)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1525 -> "3055 | O=C(O)CC(=O)Br" [label=""]
	"3056 | O=C(O)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1526 -> "3056 | O=C(O)CC(=O)Br" [label=""]
	"3057 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1526 -> "3057 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [label=""]
	"3058 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)Cl)cs1" [color=lightgrey shape=box style=filled]
	1527 -> "3058 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)Cl)cs1" [label=""]
	"3059 | O=CCC(=O)Br" [color=lightgrey shape=box style=filled]
	1527 -> "3059 | O=CCC(=O)Br" [label=""]
	"3060 | CCl" [color=lightyellow shape=box style=filled]
	1528 -> "3060 | CCl" [label=""]
	"3061 | O=C=O" [color=lightyellow shape=box style=filled]
	1528 -> "3061 | O=C=O" [label=""]
	"3062 | CC(=O)O" [color=lightyellow shape=box style=filled]
	1529 -> "3062 | CC(=O)O" [label=""]
	"3063 | O=C1CCC(=O)N1Cl" [color=lightyellow shape=box style=filled]
	1529 -> "3063 | O=C1CCC(=O)N1Cl" [label=""]
	"3064 | CC(=O)O" [color=lightyellow shape=box style=filled]
	1530 -> "3064 | CC(=O)O" [label=""]
	"3065 | ClC(Cl)(Cl)Cl" [color=lightyellow shape=box style=filled]
	1530 -> "3065 | ClC(Cl)(Cl)Cl" [label=""]
	"3066 | CCl" [color=lightyellow shape=box style=filled]
	1531 -> "3066 | CCl" [label=""]
	"3067 | O=C(O)O" [color=lightyellow shape=box style=filled]
	1531 -> "3067 | O=C(O)O" [label=""]
	"3068 | O=CO" [color=lightyellow shape=box style=filled]
	1532 -> "3068 | O=CO" [label=""]
	"3069 | ClCCl" [color=lightyellow shape=box style=filled]
	1532 -> "3069 | ClCCl" [label=""]
	"3070 | CCl" [color=lightyellow shape=box style=filled]
	1533 -> "3070 | CCl" [label=""]
	"3071 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	1533 -> "3071 | O=C(O)Cl" [label=""]
	"3072 | CC(=O)O" [color=lightyellow shape=box style=filled]
	1534 -> "3072 | CC(=O)O" [label=""]
	"3073 | ClCl" [color=lightyellow shape=box style=filled]
	1534 -> "3073 | ClCl" [label=""]
	"3074 | ClCCl" [color=lightyellow shape=box style=filled]
	1535 -> "3074 | ClCCl" [label=""]
	"3075 | O=C(O)O" [color=lightyellow shape=box style=filled]
	1535 -> "3075 | O=C(O)O" [label=""]
	"3076 | ClCCl" [color=lightyellow shape=box style=filled]
	1536 -> "3076 | ClCCl" [label=""]
	"3077 | CCOC(=O)O" [color=lightgrey shape=box style=filled]
	1536 -> "3077 | CCOC(=O)O" [label=""]
	"3078 | ClCl" [color=lightyellow shape=box style=filled]
	1537 -> "3078 | ClCl" [label=""]
	"3079 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	1537 -> "3079 | O=CC(=O)O" [label=""]
	"3080 | O=C(O)O" [color=lightyellow shape=box style=filled]
	1538 -> "3080 | O=C(O)O" [label=""]
	"3081 | CC(=O)C(C)C=O" [color=lightyellow shape=box style=filled]
	1538 -> "3081 | CC(=O)C(C)C=O" [label=""]
	"3082 | O=CO" [color=lightyellow shape=box style=filled]
	1539 -> "3082 | O=CO" [label=""]
	"3083 | CC(=O)C(C)(Br)C=O" [color=lightgrey shape=box style=filled]
	1539 -> "3083 | CC(=O)C(C)(Br)C=O" [label=""]
	"3084 | C=C(C=O)C(C)=O" [color=lightgrey shape=box style=filled]
	1540 -> "3084 | C=C(C=O)C(C)=O" [label=""]
	"3085 | O=CO" [color=lightyellow shape=box style=filled]
	1540 -> "3085 | O=CO" [label=""]
	"3086 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	1541 -> "3086 | O=C(O)Cl" [label=""]
	"3087 | CC(=O)C(C)C=O" [color=lightyellow shape=box style=filled]
	1541 -> "3087 | CC(=O)C(C)C=O" [label=""]
	"3088 | O=CO" [color=lightyellow shape=box style=filled]
	1542 -> "3088 | O=CO" [label=""]
	"3089 | CN(C)C=O" [color=lightyellow shape=box style=filled]
	1542 -> "3089 | CN(C)C=O" [label=""]
	"3090 | CCC(C)=O" [color=lightyellow shape=box style=filled]
	1542 -> "3090 | CCC(C)=O" [label=""]
	"3091 | [O][C]=O" [color=lightgrey shape=box style=filled]
	1543 -> "3091 | [O][C]=O" [label=""]
	"3092 | C[C]C(C)=O" [color=lightgrey shape=box style=filled]
	1543 -> "3092 | C[C]C(C)=O" [label=""]
	"3093 | [CH]=O" [color=lightgrey shape=box style=filled]
	1543 -> "3093 | [CH]=O" [label=""]
	"3094 | CC(=O)C(C)OC=O" [color=lightgrey shape=box style=filled]
	1544 -> "3094 | CC(=O)C(C)OC=O" [label=""]
	"3095 | CN(C)C=O" [color=lightyellow shape=box style=filled]
	1544 -> "3095 | CN(C)C=O" [label=""]
	"3096 | C=O" [color=lightyellow shape=box style=filled]
	1545 -> "3096 | C=O" [label=""]
	"3097 | O=C(O)O" [color=lightyellow shape=box style=filled]
	1545 -> "3097 | O=C(O)O" [label=""]
	"3098 | CCC(C)=O" [color=lightyellow shape=box style=filled]
	1545 -> "3098 | CCC(C)=O" [label=""]
	"3099 | O=CO" [color=lightyellow shape=box style=filled]
	1546 -> "3099 | O=CO" [label=""]
	"3100 | CC(=O)C(C)(O)C=O" [color=lightyellow shape=box style=filled]
	1546 -> "3100 | CC(=O)C(C)(O)C=O" [label=""]
	"3101 | O=CO" [color=lightyellow shape=box style=filled]
	1547 -> "3101 | O=CO" [label=""]
	"3102 | O=COC(=O)c1cccc(Cl)c1" [color=lightgrey shape=box style=filled]
	1547 -> "3102 | O=COC(=O)c1cccc(Cl)c1" [label=""]
	"3103 | CCC(C)=O" [color=lightyellow shape=box style=filled]
	1547 -> "3103 | CCC(C)=O" [label=""]
	"3104 | CC(=O)O" [color=lightyellow shape=box style=filled]
	1548 -> "3104 | CC(=O)O" [label=""]
	"3105 | ClC(Cl)(Cl)Cl" [color=lightyellow shape=box style=filled]
	1548 -> "3105 | ClC(Cl)(Cl)Cl" [label=""]
	"3106 | O=C(O)CBr" [color=lightyellow shape=box style=filled]
	1549 -> "3106 | O=C(O)CBr" [label=""]
	"3107 | Cl" [color=lightyellow shape=box style=filled]
	1549 -> "3107 | Cl" [label=""]
	"3108 | O=CO" [color=lightyellow shape=box style=filled]
	1550 -> "3108 | O=CO" [label=""]
	"3109 | ClCCl" [color=lightyellow shape=box style=filled]
	1550 -> "3109 | ClCCl" [label=""]
	"3110 | CCl" [color=lightyellow shape=box style=filled]
	1551 -> "3110 | CCl" [label=""]
	"3111 | O=C=O" [color=lightyellow shape=box style=filled]
	1551 -> "3111 | O=C=O" [label=""]
	"3112 | CC(=O)O" [color=lightyellow shape=box style=filled]
	1552 -> "3112 | CC(=O)O" [label=""]
	"3113 | ClCl" [color=lightyellow shape=box style=filled]
	1552 -> "3113 | ClCl" [label=""]
	"3114 | CC(=O)O" [color=lightyellow shape=box style=filled]
	1553 -> "3114 | CC(=O)O" [label=""]
	"3115 | OCl" [color=lightyellow shape=box style=filled]
	1553 -> "3115 | OCl" [label=""]
	"3116 | O=C(Cl)CCl" [color=lightgrey shape=box style=filled]
	1554 -> "3116 | O=C(Cl)CCl" [label=""]
	"3117 | O" [color=lightyellow shape=box style=filled]
	1554 -> "3117 | O" [label=""]
	"3118 | CCl" [color=lightyellow shape=box style=filled]
	1555 -> "3118 | CCl" [label=""]
	"3119 | O=C(O)O" [color=lightyellow shape=box style=filled]
	1555 -> "3119 | O=C(O)O" [label=""]
	"3120 | CCl" [color=lightyellow shape=box style=filled]
	1556 -> "3120 | CCl" [label=""]
	"3121 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	1556 -> "3121 | O=C(O)Cl" [label=""]
	"3122 | CC(C)(C)OC(=O)OC(=O)OO" [color=lightgrey shape=box style=filled]
	1557 -> "3122 | CC(C)(C)OC(=O)OC(=O)OO" [label=""]
	"3123 | CC(=O)C(C)C=O" [color=lightyellow shape=box style=filled]
	1557 -> "3123 | CC(=O)C(C)C=O" [label=""]
	"3124 | C=C(C=O)C(C)=O" [color=lightgrey shape=box style=filled]
	1558 -> "3124 | C=C(C=O)C(C)=O" [label=""]
	"3125 | CC(C)(C)OC(=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	1558 -> "3125 | CC(C)(C)OC(=O)OC(=O)O" [label=""]
	"3126 | CC(C)(C)OC(=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	1559 -> "3126 | CC(C)(C)OC(=O)OC(=O)O" [label=""]
	"3127 | CN(C)C=O" [color=lightyellow shape=box style=filled]
	1559 -> "3127 | CN(C)C=O" [label=""]
	"3128 | CCC(C)=O" [color=lightyellow shape=box style=filled]
	1559 -> "3128 | CCC(C)=O" [label=""]
	"3129 | CC(C)(C)OC(=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	1560 -> "3129 | CC(C)(C)OC(=O)OC(=O)O" [label=""]
	"3130 | CC(=O)C(C)(Br)C=O" [color=lightgrey shape=box style=filled]
	1560 -> "3130 | CC(=O)C(C)(Br)C=O" [label=""]
	"3131 | CC(C)(C)OC(=O)OC([O])=O" [color=lightgrey shape=box style=filled]
	1561 -> "3131 | CC(C)(C)OC(=O)OC([O])=O" [label=""]
	"3132 | C[C]C(C)=O" [color=lightgrey shape=box style=filled]
	1561 -> "3132 | C[C]C(C)=O" [label=""]
	"3133 | [CH]=O" [color=lightgrey shape=box style=filled]
	1561 -> "3133 | [CH]=O" [label=""]
	"3134 | CC(C)(C)OC(=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	1562 -> "3134 | CC(C)(C)OC(=O)OC(=O)O" [label=""]
	"3135 | CC(=O)C(C)(O)C=O" [color=lightyellow shape=box style=filled]
	1562 -> "3135 | CC(=O)C(C)(O)C=O" [label=""]
	"3136 | CC(C)(C)OC(=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	1563 -> "3136 | CC(C)(C)OC(=O)OC(=O)O" [label=""]
	"3137 | CI" [color=lightyellow shape=box style=filled]
	1563 -> "3137 | CI" [label=""]
	"3138 | CC(=O)CC=O" [color=lightyellow shape=box style=filled]
	1563 -> "3138 | CC(=O)CC=O" [label=""]
	"3139 | CC(C)(C)OC(=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	1564 -> "3139 | CC(C)(C)OC(=O)OC(=O)O" [label=""]
	"3140 | CO" [color=lightyellow shape=box style=filled]
	1564 -> "3140 | CO" [label=""]
	"3141 | CC(=O)CC=O" [color=lightyellow shape=box style=filled]
	1564 -> "3141 | CC(=O)CC=O" [label=""]
	"3142 | CC(C)(C)OC(=O)OC(=O)O" [color=lightgrey shape=box style=filled]
	1565 -> "3142 | CC(C)(C)OC(=O)OC(=O)O" [label=""]
	"3143 | C=O" [color=lightyellow shape=box style=filled]
	1565 -> "3143 | C=O" [label=""]
	"3144 | CC(=O)C(C)=O" [color=lightyellow shape=box style=filled]
	1565 -> "3144 | CC(=O)C(C)=O" [label=""]
	"3145 | CC(C)(C)OC(=O)OC([O])=O" [color=lightgrey shape=box style=filled]
	1566 -> "3145 | CC(C)(C)OC(=O)OC([O])=O" [label=""]
	"3146 | CC(=O)[C]C=O" [color=lightgrey shape=box style=filled]
	1566 -> "3146 | CC(=O)[C]C=O" [label=""]
	"3147 | [CH3]" [color=lightyellow shape=box style=filled]
	1566 -> "3147 | [CH3]" [label=""]
	"3148 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1567 -> "3148 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"3149 | NC1C(=O)N[C@@H]1S(=O)C(=O)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1567 -> "3149 | NC1C(=O)N[C@@H]1S(=O)C(=O)CC(=O)Br" [label=""]
	"3150 | O=CCC(=O)Br" [color=lightgrey shape=box style=filled]
	1568 -> "3150 | O=CCC(=O)Br" [label=""]
	"3151 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1568 -> "3151 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [label=""]
	"3152 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=O)cs1" [color=lightgrey shape=box style=filled]
	1569 -> "3152 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=O)cs1" [label=""]
	"3153 | O=C(O)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1569 -> "3153 | O=C(O)CC(=O)Br" [label=""]
	"3154 | O=C(O)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1570 -> "3154 | O=C(O)CC(=O)Br" [label=""]
	"3155 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1570 -> "3155 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [label=""]
	"3156 | O=C(O)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1571 -> "3156 | O=C(O)CC(=O)Br" [label=""]
	"3157 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1571 -> "3157 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [label=""]
	"3158 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=O)cs1" [color=lightgrey shape=box style=filled]
	1572 -> "3158 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=O)cs1" [label=""]
	"3159 | O=C(Cl)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1572 -> "3159 | O=C(Cl)CC(=O)Br" [label=""]
	"3160 | O=C(OO)c1cccc(Cl)c1" [color=lightyellow shape=box style=filled]
	1573 -> "3160 | O=C(OO)c1cccc(Cl)c1" [label=""]
	"3161 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)CC(=O)Br)cs1" [color=lightgrey shape=box style=filled]
	1573 -> "3161 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)CC(=O)Br)cs1" [label=""]
	"3162 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)Cl)cs1" [color=lightgrey shape=box style=filled]
	1574 -> "3162 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)Cl)cs1" [label=""]
	"3163 | O=CCC(=O)Br" [color=lightgrey shape=box style=filled]
	1574 -> "3163 | O=CCC(=O)Br" [label=""]
	"3164 | O=C(Cl)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1575 -> "3164 | O=C(Cl)CC(=O)Br" [label=""]
	"3165 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1575 -> "3165 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [label=""]
	"3166 | CCOC(=O)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1576 -> "3166 | CCOC(=O)CC(=O)Br" [label=""]
	"3167 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1576 -> "3167 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [label=""]
	"3168 | CC(=O)O" [color=lightyellow shape=box style=filled]
	1577 -> "3168 | CC(=O)O" [label=""]
	"3169 | ClC(Cl)(Cl)Cl" [color=lightyellow shape=box style=filled]
	1577 -> "3169 | ClC(Cl)(Cl)Cl" [label=""]
	"3170 | O=C(O)CBr" [color=lightyellow shape=box style=filled]
	1578 -> "3170 | O=C(O)CBr" [label=""]
	"3171 | Cl" [color=lightyellow shape=box style=filled]
	1578 -> "3171 | Cl" [label=""]
	"3172 | O=CO" [color=lightyellow shape=box style=filled]
	1579 -> "3172 | O=CO" [label=""]
	"3173 | ClCCl" [color=lightyellow shape=box style=filled]
	1579 -> "3173 | ClCCl" [label=""]
	"3174 | CCl" [color=lightyellow shape=box style=filled]
	1580 -> "3174 | CCl" [label=""]
	"3175 | O=C=O" [color=lightyellow shape=box style=filled]
	1580 -> "3175 | O=C=O" [label=""]
	"3176 | CC(=O)O" [color=lightyellow shape=box style=filled]
	1581 -> "3176 | CC(=O)O" [label=""]
	"3177 | ClCl" [color=lightyellow shape=box style=filled]
	1581 -> "3177 | ClCl" [label=""]
	"3178 | CC(=O)O" [color=lightyellow shape=box style=filled]
	1582 -> "3178 | CC(=O)O" [label=""]
	"3179 | OCl" [color=lightyellow shape=box style=filled]
	1582 -> "3179 | OCl" [label=""]
	"3180 | O=C(Cl)CCl" [color=lightgrey shape=box style=filled]
	1583 -> "3180 | O=C(Cl)CCl" [label=""]
	"3181 | O" [color=lightyellow shape=box style=filled]
	1583 -> "3181 | O" [label=""]
	"3182 | CCl" [color=lightyellow shape=box style=filled]
	1584 -> "3182 | CCl" [label=""]
	"3183 | O=C(O)O" [color=lightyellow shape=box style=filled]
	1584 -> "3183 | O=C(O)O" [label=""]
	"3184 | CCl" [color=lightyellow shape=box style=filled]
	1585 -> "3184 | CCl" [label=""]
	"3185 | O=C(O)Cl" [color=lightgrey shape=box style=filled]
	1585 -> "3185 | O=C(O)Cl" [label=""]
	"3186 | CN(C)C=O" [color=lightyellow shape=box style=filled]
	1586 -> "3186 | CN(C)C=O" [label=""]
	"3187 | O=C(O)O" [color=lightyellow shape=box style=filled]
	1586 -> "3187 | O=C(O)O" [label=""]
	"3188 | CCC(C)=O" [color=lightyellow shape=box style=filled]
	1586 -> "3188 | CCC(C)=O" [label=""]
	"3189 | [O]C(=O)O" [color=lightgrey shape=box style=filled]
	1587 -> "3189 | [O]C(=O)O" [label=""]
	"3190 | C[C]C(C)=O" [color=lightgrey shape=box style=filled]
	1587 -> "3190 | C[C]C(C)=O" [label=""]
	"3191 | [CH]=O" [color=lightgrey shape=box style=filled]
	1587 -> "3191 | [CH]=O" [label=""]
	"3192 | CN(C)C=O" [color=lightyellow shape=box style=filled]
	1588 -> "3192 | CN(C)C=O" [label=""]
	"3193 | CC(=O)C(C)OC(=O)O" [color=lightgrey shape=box style=filled]
	1588 -> "3193 | CC(=O)C(C)OC(=O)O" [label=""]
	"3194 | O=COC(=O)c1cccc(Cl)c1" [color=lightgrey shape=box style=filled]
	1589 -> "3194 | O=COC(=O)c1cccc(Cl)c1" [label=""]
	"3195 | O=C(O)O" [color=lightyellow shape=box style=filled]
	1589 -> "3195 | O=C(O)O" [label=""]
	"3196 | CCC(C)=O" [color=lightyellow shape=box style=filled]
	1589 -> "3196 | CCC(C)=O" [label=""]
	"3197 | O=C(O)O" [color=lightyellow shape=box style=filled]
	1590 -> "3197 | O=C(O)O" [label=""]
	"3198 | C=O" [color=lightyellow shape=box style=filled]
	1590 -> "3198 | C=O" [label=""]
	"3199 | CC(=O)C(C)=O" [color=lightyellow shape=box style=filled]
	1590 -> "3199 | CC(=O)C(C)=O" [label=""]
	"3200 | O=CO" [color=lightyellow shape=box style=filled]
	1591 -> "3200 | O=CO" [label=""]
	"3201 | O=C(O)O" [color=lightyellow shape=box style=filled]
	1591 -> "3201 | O=C(O)O" [label=""]
	"3202 | CCC(C)=O" [color=lightyellow shape=box style=filled]
	1591 -> "3202 | CCC(C)=O" [label=""]
	"3203 | [O]C(=O)O" [color=lightgrey shape=box style=filled]
	1592 -> "3203 | [O]C(=O)O" [label=""]
	"3204 | CC(=O)[C]C=O" [color=lightgrey shape=box style=filled]
	1592 -> "3204 | CC(=O)[C]C=O" [label=""]
	"3205 | [CH3]" [color=lightyellow shape=box style=filled]
	1592 -> "3205 | [CH3]" [label=""]
	"3206 | CC(=O)C(C)(Br)C=O" [color=lightgrey shape=box style=filled]
	1593 -> "3206 | CC(=O)C(C)(Br)C=O" [label=""]
	"3207 | O=C(O)O" [color=lightyellow shape=box style=filled]
	1593 -> "3207 | O=C(O)O" [label=""]
	"3208 | C=C(C=O)C(C)=O" [color=lightgrey shape=box style=filled]
	1594 -> "3208 | C=C(C=O)C(C)=O" [label=""]
	"3209 | O=C(O)O" [color=lightyellow shape=box style=filled]
	1594 -> "3209 | O=C(O)O" [label=""]
	"3210 | CC(=O)Cl" [color=lightyellow shape=box style=filled]
	1595 -> "3210 | CC(=O)Cl" [label=""]
	"3211 | CCC=O" [color=lightyellow shape=box style=filled]
	1595 -> "3211 | CCC=O" [label=""]
	"3212 | O=C(O)O" [color=lightyellow shape=box style=filled]
	1595 -> "3212 | O=C(O)O" [label=""]
	"3213 | Nc1nc(C(O)C(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1596 -> "3213 | Nc1nc(C(O)C(=O)O)cs1" [label=""]
	"3214 | NC1C(=O)N[C@@H]1S(=O)C(=O)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1596 -> "3214 | NC1C(=O)N[C@@H]1S(=O)C(=O)CC(=O)Br" [label=""]
	"3215 | O=CCC(=O)Br" [color=lightgrey shape=box style=filled]
	1597 -> "3215 | O=CCC(=O)Br" [label=""]
	"3216 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1597 -> "3216 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [label=""]
	"3217 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=O)cs1" [color=lightgrey shape=box style=filled]
	1598 -> "3217 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=O)cs1" [label=""]
	"3218 | O=C(O)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1598 -> "3218 | O=C(O)CC(=O)Br" [label=""]
	"3219 | O=C(O)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1599 -> "3219 | O=C(O)CC(=O)Br" [label=""]
	"3220 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1599 -> "3220 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [label=""]
	"3221 | O=C(O)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1600 -> "3221 | O=C(O)CC(=O)Br" [label=""]
	"3222 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1600 -> "3222 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [label=""]
	"3223 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=O)cs1" [color=lightgrey shape=box style=filled]
	1601 -> "3223 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2[S]=O)cs1" [label=""]
	"3224 | O=C(Cl)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1601 -> "3224 | O=C(Cl)CC(=O)Br" [label=""]
	"3225 | O=C(OO)c1cccc(Cl)c1" [color=lightyellow shape=box style=filled]
	1602 -> "3225 | O=C(OO)c1cccc(Cl)c1" [label=""]
	"3226 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)CC(=O)Br)cs1" [color=lightgrey shape=box style=filled]
	1602 -> "3226 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2SC(=O)CC(=O)Br)cs1" [label=""]
	"3227 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)Cl)cs1" [color=lightgrey shape=box style=filled]
	1603 -> "3227 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)Cl)cs1" [label=""]
	"3228 | O=CCC(=O)Br" [color=lightgrey shape=box style=filled]
	1603 -> "3228 | O=CCC(=O)Br" [label=""]
	"3229 | O=C(Cl)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1604 -> "3229 | O=C(Cl)CC(=O)Br" [label=""]
	"3230 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1604 -> "3230 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [label=""]
	"3231 | CCOC(=O)CC(=O)Br" [color=lightgrey shape=box style=filled]
	1605 -> "3231 | CCOC(=O)CC(=O)Br" [label=""]
	"3232 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [color=lightgrey shape=box style=filled]
	1605 -> "3232 | Nc1nc(C(O)C(=O)NC2C(=O)N[C@@H]2S(=O)O)cs1" [label=""]
	"3233 | CC1=C(C(=O)O)N[C@@H](C(N)C(=O)O)SC1" [color=lightgrey shape=box style=filled]
	1606 -> "3233 | CC1=C(C(=O)O)N[C@@H](C(N)C(=O)O)SC1" [label=""]
	"3234 | O=C=O" [color=lightyellow shape=box style=filled]
	1607 -> "3234 | O=C=O" [label=""]
	"3235 | CC1=CN2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1607 -> "3235 | CC1=CN2C(=O)C(N)[C@H]2SC1" [label=""]
	"3236 | CC(CS[C@H]1NC(=O)C1N)CC(=O)O" [color=lightgrey shape=box style=filled]
	1608 -> "3236 | CC(CS[C@H]1NC(=O)C1N)CC(=O)O" [label=""]
	"3237 | CC(CS[C@H]1NC(=O)C1N)C(=O)C(=O)O" [color=lightgrey shape=box style=filled]
	1609 -> "3237 | CC(CS[C@H]1NC(=O)C1N)C(=O)C(=O)O" [label=""]
	"3238 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)OC(C)(C)C)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1610 -> "3238 | CC1=C(C(=O)O)N2C(=O)C(NC(=O)OC(C)(C)C)[C@H]2SC1" [label=""]
	"3239 | CCCS[C@H]1NC(=O)C1N" [color=lightgrey shape=box style=filled]
	1611 -> "3239 | CCCS[C@H]1NC(=O)C1N" [label=""]
	"3240 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	1611 -> "3240 | O=CC(=O)O" [label=""]
	"3241 | C[C]CS[C@H]1[N]C(=O)C1N" [color=lightgrey shape=box style=filled]
	1612 -> "3241 | C[C]CS[C@H]1[N]C(=O)C1N" [label=""]
	"3242 | [C]C(=O)O" [color=lightgrey shape=box style=filled]
	1612 -> "3242 | [C]C(=O)O" [label=""]
	"3243 | CCCS[C@H]1NC(=O)C1N" [color=lightgrey shape=box style=filled]
	1613 -> "3243 | CCCS[C@H]1NC(=O)C1N" [label=""]
	"3244 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	1613 -> "3244 | O=C(O)CO" [label=""]
	"3245 | CCCS[C@@H]1C(NC(=O)OC(C)(C)C)C(=O)N1CC(=O)O" [color=lightgrey shape=box style=filled]
	1614 -> "3245 | CCCS[C@@H]1C(NC(=O)OC(C)(C)C)C(=O)N1CC(=O)O" [label=""]
	"3246 | CCCS[C@@H]1C(N)C(=O)N1C(O)C(=O)O" [color=lightgrey shape=box style=filled]
	1615 -> "3246 | CCCS[C@@H]1C(N)C(=O)N1C(O)C(=O)O" [label=""]
	"3247 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	1616 -> "3247 | O=C1CCC(=O)N1Br" [label=""]
	"3248 | CC1=CN2C(=O)C(N)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1616 -> "3248 | CC1=CN2C(=O)C(N)[C@H]2SC1" [label=""]
	"3249 | NC1C(=O)N2C=CCS[C@H]12" [color=lightgrey shape=box style=filled]
	1617 -> "3249 | NC1C(=O)N2C=CCS[C@H]12" [label=""]
	"3250 | BrCBr" [color=lightyellow shape=box style=filled]
	1617 -> "3250 | BrCBr" [label=""]
	"3251 | NC(C(=O)O)[C@@H]1NC=C(CBr)CS1" [color=lightgrey shape=box style=filled]
	1618 -> "3251 | NC(C(=O)O)[C@@H]1NC=C(CBr)CS1" [label=""]
	"3252 | [CH]=C([CH2])CBr" [color=lightgrey shape=box style=filled]
	1619 -> "3252 | [CH]=C([CH2])CBr" [label=""]
	"3253 | NC1C(=O)[N][C@@H]1[S]" [color=lightgrey shape=box style=filled]
	1619 -> "3253 | NC1C(=O)[N][C@@H]1[S]" [label=""]
	"3254 | NC1C(=O)N[C@@H]1SCCCBr" [color=lightgrey shape=box style=filled]
	1620 -> "3254 | NC1C(=O)N[C@@H]1SCCCBr" [label=""]
	"3255 | C[P+](c1ccccc1)(c1ccccc1)c1ccccc1" [color=lightyellow shape=box style=filled]
	1620 -> "3255 | C[P+](c1ccccc1)(c1ccccc1)c1ccccc1" [label=""]
	"3256 | [CH]=[C]CBr" [color=lightgrey shape=box style=filled]
	1621 -> "3256 | [CH]=[C]CBr" [label=""]
	"3257 | [CH2]S[C@H]1[N]C(=O)C1N" [color=lightgrey shape=box style=filled]
	1621 -> "3257 | [CH2]S[C@H]1[N]C(=O)C1N" [label=""]
	"3258 | CCCBr" [color=lightyellow shape=box style=filled]
	1622 -> "3258 | CCCBr" [label=""]
	"3259 | CS[C@H]1NC(=O)C1N" [color=lightgrey shape=box style=filled]
	1622 -> "3259 | CS[C@H]1NC(=O)C1N" [label=""]
	"3260 | NC1C(=O)N[C@@H]1SCCCBr" [color=lightgrey shape=box style=filled]
	1623 -> "3260 | NC1C(=O)N[C@@H]1SCCCBr" [label=""]
	"3261 | C=O" [color=lightyellow shape=box style=filled]
	1623 -> "3261 | C=O" [label=""]
	"3262 | NC1C(=O)N[C@@H]1SCC(=CBr)CBr" [color=lightgrey shape=box style=filled]
	1624 -> "3262 | NC1C(=O)N[C@@H]1SCC(=CBr)CBr" [label=""]
	"3263 | C=C(CBr)CBr" [color=lightyellow shape=box style=filled]
	1625 -> "3263 | C=C(CBr)CBr" [label=""]
	"3264 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	1625 -> "3264 | NC1C(=O)N[C@@H]1S" [label=""]
	"3265 | BrC(Br)Br" [color=lightyellow shape=box style=filled]
	1626 -> "3265 | BrC(Br)Br" [label=""]
	"3266 | NC1C(=O)N[C@@H]1SCC=CC(=O)O" [color=lightgrey shape=box style=filled]
	1626 -> "3266 | NC1C(=O)N[C@@H]1SCC=CC(=O)O" [label=""]
	"3267 | O=C(O)C=C(CBr)C(Br)Br" [color=lightgrey shape=box style=filled]
	1627 -> "3267 | O=C(O)C=C(CBr)C(Br)Br" [label=""]
	"3268 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	1627 -> "3268 | NC1C(=O)N[C@@H]1S" [label=""]
	"3269 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	1628 -> "3269 | NC1C(=O)N[C@@H]1S" [label=""]
	"3270 | O=CC(=CC(=O)O)C(Br)Br" [color=lightgrey shape=box style=filled]
	1628 -> "3270 | O=CC(=CC(=O)O)C(Br)Br" [label=""]
	"3271 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	1629 -> "3271 | NC1C(=O)N[C@@H]1S" [label=""]
	"3272 | O=C(O)C=C(CCl)C(Br)Br" [color=lightgrey shape=box style=filled]
	1629 -> "3272 | O=C(O)C=C(CCl)C(Br)Br" [label=""]
	"3273 | BrCBr" [color=lightyellow shape=box style=filled]
	1630 -> "3273 | BrCBr" [label=""]
	"3274 | NC1C(=O)N[C@@H]1SCCCC(=O)O" [color=lightgrey shape=box style=filled]
	1630 -> "3274 | NC1C(=O)N[C@@H]1SCCCC(=O)O" [label=""]
	"3275 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	1631 -> "3275 | NC1C(=O)N[C@@H]1S" [label=""]
	"3276 | O=C(O)C=C(CO)C(Br)Br" [color=lightgrey shape=box style=filled]
	1631 -> "3276 | O=C(O)C=C(CO)C(Br)Br" [label=""]
	"3277 | O=C(O)C=CC(Br)Br" [color=lightgrey shape=box style=filled]
	1632 -> "3277 | O=C(O)C=CC(Br)Br" [label=""]
	"3278 | NC1C(=O)N[C@@H]1SCBr" [color=lightgrey shape=box style=filled]
	1632 -> "3278 | NC1C(=O)N[C@@H]1SCBr" [label=""]
	"3279 | NC1C(=O)NC1=O" [color=lightgrey shape=box style=filled]
	1633 -> "3279 | NC1C(=O)NC1=O" [label=""]
	"3280 | O=C(O)C=C(CS)C(Br)Br" [color=lightgrey shape=box style=filled]
	1633 -> "3280 | O=C(O)C=C(CS)C(Br)Br" [label=""]
	"3281 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	1634 -> "3281 | NC1C(=O)N[C@@H]1S" [label=""]
	"3282 | CC(CC(=O)O)C(Br)Br" [color=lightgrey shape=box style=filled]
	1634 -> "3282 | CC(CC(=O)O)C(Br)Br" [label=""]
	"3283 | CS[C@H]1NC(=O)C1N" [color=lightgrey shape=box style=filled]
	1635 -> "3283 | CS[C@H]1NC(=O)C1N" [label=""]
	"3284 | O=C(O)CCC(Br)Br" [color=lightgrey shape=box style=filled]
	1635 -> "3284 | O=C(O)CCC(Br)Br" [label=""]
	"3285 | CC1=C(C(=O)O)N[C@@H](C(N)C(=O)O)SC1" [color=lightgrey shape=box style=filled]
	1636 -> "3285 | CC1=C(C(=O)O)N[C@@H](C(N)C(=O)O)SC1" [label=""]
	"3286 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	1636 -> "3286 | O=C1CCC(=O)N1Br" [label=""]
	"3287 | NC(C(=O)O)[C@@H]1NC=C(CBr)CS1" [color=lightgrey shape=box style=filled]
	1637 -> "3287 | NC(C(=O)O)[C@@H]1NC=C(CBr)CS1" [label=""]
	"3288 | O=C=O" [color=lightyellow shape=box style=filled]
	1637 -> "3288 | O=C=O" [label=""]
	"3289 | NC(=O)C(=O)O" [color=lightyellow shape=box style=filled]
	1638 -> "3289 | NC(=O)C(=O)O" [label=""]
	"3290 | O=C(O)C1=C(CBr)CSCN1" [color=lightgrey shape=box style=filled]
	1638 -> "3290 | O=C(O)C1=C(CBr)CSCN1" [label=""]
	"3291 | NCC(=O)O" [color=lightyellow shape=box style=filled]
	1639 -> "3291 | NCC(=O)O" [label=""]
	"3292 | O=C(O)C1=C(CBr)CS[C@H](Br)N1" [color=lightgrey shape=box style=filled]
	1639 -> "3292 | O=C(O)C1=C(CBr)CS[C@H](Br)N1" [label=""]
	"3293 | O=C(O)C[C@@H]1NC(C(=O)O)=C(CBr)CS1" [color=lightgrey shape=box style=filled]
	1640 -> "3293 | O=C(O)C[C@@H]1NC(C(=O)O)=C(CBr)CS1" [label=""]
	"3294 | CC(C)(C)OC(N)=O" [color=lightyellow shape=box style=filled]
	1640 -> "3294 | CC(C)(C)OC(N)=O" [label=""]
	"3295 | N" [color=lightyellow shape=box style=filled]
	1641 -> "3295 | N" [label=""]
	"3296 | O=C(O)C(=O)[C@@H]1NC(C(=O)O)=C(CBr)CS1" [color=lightgrey shape=box style=filled]
	1641 -> "3296 | O=C(O)C(=O)[C@@H]1NC(C(=O)O)=C(CBr)CS1" [label=""]
	"3297 | O=C(O)C1=C(CBr)CSCN1" [color=lightgrey shape=box style=filled]
	1642 -> "3297 | O=C(O)C1=C(CBr)CSCN1" [label=""]
	"3298 | NC(Br)C(=O)O" [color=lightgrey shape=box style=filled]
	1642 -> "3298 | NC(Br)C(=O)O" [label=""]
	"3299 | NC(O)C(=O)O" [color=lightgrey shape=box style=filled]
	1643 -> "3299 | NC(O)C(=O)O" [label=""]
	"3300 | O=C(O)C1=C(CBr)CSCN1" [color=lightgrey shape=box style=filled]
	1643 -> "3300 | O=C(O)C1=C(CBr)CSCN1" [label=""]
	"3301 | CC(C)(C)OC(=O)NCC(=O)O" [color=lightyellow shape=box style=filled]
	1644 -> "3301 | CC(C)(C)OC(=O)NCC(=O)O" [label=""]
	"3302 | O=C(O)C1=C(CBr)CSCN1" [color=lightgrey shape=box style=filled]
	1644 -> "3302 | O=C(O)C1=C(CBr)CSCN1" [label=""]
	"3303 | O=C(O)C(O)=C(CCl)CBr" [color=lightgrey shape=box style=filled]
	1645 -> "3303 | O=C(O)C(O)=C(CCl)CBr" [label=""]
	"3304 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	1645 -> "3304 | NC1C(=O)N[C@@H]1S" [label=""]
	"3305 | O=C(O)C(O)=C(CBr)CBr" [color=lightgrey shape=box style=filled]
	1646 -> "3305 | O=C(O)C(O)=C(CBr)CBr" [label=""]
	"3306 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	1646 -> "3306 | NC1C(=O)N[C@@H]1S" [label=""]
	"3307 | O=CC(CBr)=C(O)C(=O)O" [color=lightgrey shape=box style=filled]
	1647 -> "3307 | O=CC(CBr)=C(O)C(=O)O" [label=""]
	"3308 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	1647 -> "3308 | NC1C(=O)N[C@@H]1S" [label=""]
	"3309 | O=C(O)C(=O)O" [color=lightyellow shape=box style=filled]
	1648 -> "3309 | O=C(O)C(=O)O" [label=""]
	"3310 | NC1C(=O)N[C@@H]1SCCCBr" [color=lightgrey shape=box style=filled]
	1648 -> "3310 | NC1C(=O)N[C@@H]1SCCCBr" [label=""]
	"3311 | [CH2]C(CBr)=C(O)C(=O)O" [color=lightgrey shape=box style=filled]
	1649 -> "3311 | [CH2]C(CBr)=C(O)C(=O)O" [label=""]
	"3312 | O=C1[CH][C@@H]([S])N1" [color=lightgrey shape=box style=filled]
	1649 -> "3312 | O=C1[CH][C@@H]([S])N1" [label=""]
	"3313 | [NH2]" [color=lightyellow shape=box style=filled]
	1649 -> "3313 | [NH2]" [label=""]
	"3314 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	1650 -> "3314 | O=C1CCC(=O)N1Br" [label=""]
	"3315 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	1650 -> "3315 | NC1C(=O)N[C@@H]1S" [label=""]
	"3316 | CC(CBr)=C(O)C(=O)O" [color=lightgrey shape=box style=filled]
	1650 -> "3316 | CC(CBr)=C(O)C(=O)O" [label=""]
	"3317 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	1651 -> "3317 | NC1C(=O)N[C@@H]1S" [label=""]
	"3318 | CC(C)(C)OC(=O)CC(CBr)=C(O)C(=O)O" [color=lightgrey shape=box style=filled]
	1651 -> "3318 | CC(C)(C)OC(=O)CC(CBr)=C(O)C(=O)O" [label=""]
	"3319 | NC1C(=O)N[C@@H]1SCC(=O)CBr" [color=lightgrey shape=box style=filled]
	1652 -> "3319 | NC1C(=O)N[C@@H]1SCC(=O)CBr" [label=""]
	"3320 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	1652 -> "3320 | O=C(O)CO" [label=""]
	"3321 | CC(CBr)=C(O)C(=O)O" [color=lightgrey shape=box style=filled]
	1653 -> "3321 | CC(CBr)=C(O)C(=O)O" [label=""]
	"3322 | O=C1C[C@@H](S)N1" [color=lightgrey shape=box style=filled]
	1653 -> "3322 | O=C1C[C@@H](S)N1" [label=""]
	"3323 | CC(C)(C)OC(N)=O" [color=lightyellow shape=box style=filled]
	1653 -> "3323 | CC(C)(C)OC(N)=O" [label=""]
	"3324 | NC1C(=O)N[C@@H]1SCCCBr" [color=lightgrey shape=box style=filled]
	1654 -> "3324 | NC1C(=O)N[C@@H]1SCCCBr" [label=""]
	"3325 | O=CC(=O)O" [color=lightyellow shape=box style=filled]
	1654 -> "3325 | O=CC(=O)O" [label=""]
	"3326 | NC1C(=O)N[C@@H]1SCC(=O)CBr" [color=lightgrey shape=box style=filled]
	1655 -> "3326 | NC1C(=O)N[C@@H]1SCC(=O)CBr" [label=""]
	"3327 | O=C(O)CCl" [color=lightgrey shape=box style=filled]
	1655 -> "3327 | O=C(O)CCl" [label=""]
	"3328 | NC1C(=O)N[C@@H]1SCCCBr" [color=lightgrey shape=box style=filled]
	1656 -> "3328 | NC1C(=O)N[C@@H]1SCCCBr" [label=""]
	"3329 | O=C(O)C(Cl)Cl" [color=lightyellow shape=box style=filled]
	1656 -> "3329 | O=C(O)C(Cl)Cl" [label=""]
	"3330 | CC(CBr)=C(Cl)C(=O)[O+]=O" [color=lightgrey shape=box style=filled]
	1657 -> "3330 | CC(CBr)=C(Cl)C(=O)[O+]=O" [label=""]
	"3331 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	1657 -> "3331 | NC1C(=O)N[C@@H]1S" [label=""]
	"3332 | CC(C)(C)OC(=O)NC1C(=O)N[C@@H]1SCCCBr" [color=lightgrey shape=box style=filled]
	1658 -> "3332 | CC(C)(C)OC(=O)NC1C(=O)N[C@@H]1SCCCBr" [label=""]
	"3333 | O=C(O)CCl" [color=lightgrey shape=box style=filled]
	1658 -> "3333 | O=C(O)CCl" [label=""]
	"3334 | CC(CBr)=C(Cl)C(=O)O" [color=lightgrey shape=box style=filled]
	1659 -> "3334 | CC(CBr)=C(Cl)C(=O)O" [label=""]
	"3335 | CC(C)(C)OC(=O)NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	1659 -> "3335 | CC(C)(C)OC(=O)NC1C(=O)N[C@@H]1S" [label=""]
	"3336 | O=C(O)C(Cl)=C(CCl)CBr" [color=lightgrey shape=box style=filled]
	1660 -> "3336 | O=C(O)C(Cl)=C(CCl)CBr" [label=""]
	"3337 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	1660 -> "3337 | NC1C(=O)N[C@@H]1S" [label=""]
	"3338 | O=C(O)C(Cl)=C(CBr)CBr" [color=lightgrey shape=box style=filled]
	1661 -> "3338 | O=C(O)C(Cl)=C(CBr)CBr" [label=""]
	"3339 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	1661 -> "3339 | NC1C(=O)N[C@@H]1S" [label=""]
	"3340 | O=CC(CBr)=C(Cl)C(=O)O" [color=lightgrey shape=box style=filled]
	1662 -> "3340 | O=CC(CBr)=C(Cl)C(=O)O" [label=""]
	"3341 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	1662 -> "3341 | NC1C(=O)N[C@@H]1S" [label=""]
	"3342 | NC1C(=O)N[C@@H]1SCC(O)CBr" [color=lightgrey shape=box style=filled]
	1663 -> "3342 | NC1C(=O)N[C@@H]1SCC(O)CBr" [label=""]
	"3343 | O=C(O)CCl" [color=lightgrey shape=box style=filled]
	1663 -> "3343 | O=C(O)CCl" [label=""]
	"3344 | O=C(O)C(Cl)=C(CS)CBr" [color=lightgrey shape=box style=filled]
	1664 -> "3344 | O=C(O)C(Cl)=C(CS)CBr" [label=""]
	"3345 | NC1CNC1=O" [color=lightyellow shape=box style=filled]
	1664 -> "3345 | NC1CNC1=O" [label=""]
	"3346 | O=C(O)C(=O)C(CBr)CBr" [color=lightgrey shape=box style=filled]
	1665 -> "3346 | O=C(O)C(=O)C(CBr)CBr" [label=""]
	"3347 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	1665 -> "3347 | NC1C(=O)N[C@@H]1S" [label=""]
	"3348 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	1666 -> "3348 | NC1C(=O)N[C@@H]1S" [label=""]
	"3349 | O=C(O)C(=O)C(CO)CBr" [color=lightgrey shape=box style=filled]
	1666 -> "3349 | O=C(O)C(=O)C(CO)CBr" [label=""]
	"3350 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	1667 -> "3350 | NC1C(=O)N[C@@H]1S" [label=""]
	"3351 | O=CC(CBr)C(=O)C(=O)O" [color=lightgrey shape=box style=filled]
	1667 -> "3351 | O=CC(CBr)C(=O)C(=O)O" [label=""]
	"3352 | O=C(O)C(=O)C(CCl)CBr" [color=lightgrey shape=box style=filled]
	1668 -> "3352 | O=C(O)C(=O)C(CCl)CBr" [label=""]
	"3353 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	1668 -> "3353 | NC1C(=O)N[C@@H]1S" [label=""]
	"3354 | CC(=O)[Br+]CS[C@H]1NC(=O)C1NC(=O)OC(CBr)(CBr)C(=O)Cl" [color=lightgrey shape=box style=filled]
	1669 -> "3354 | CC(=O)[Br+]CS[C@H]1NC(=O)C1NC(=O)OC(CBr)(CBr)C(=O)Cl" [label=""]
	"3355 | O=C(O)C(=O)C(=O)CBr" [color=lightgrey shape=box style=filled]
	1669 -> "3355 | O=C(O)C(=O)C(=O)CBr" [label=""]
	"3356 | O=C(O)CC(CBr)CBr" [color=lightgrey shape=box style=filled]
	1670 -> "3356 | O=C(O)CC(CBr)CBr" [label=""]
	"3357 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	1670 -> "3357 | NC1C(=O)N[C@@H]1S" [label=""]
	"3358 | O=C(O)CC(CCl)CBr" [color=lightgrey shape=box style=filled]
	1671 -> "3358 | O=C(O)CC(CCl)CBr" [label=""]
	"3359 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	1671 -> "3359 | NC1C(=O)N[C@@H]1S" [label=""]
	"3360 | O=CC(CBr)CC(=O)O" [color=lightgrey shape=box style=filled]
	1672 -> "3360 | O=CC(CBr)CC(=O)O" [label=""]
	"3361 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	1672 -> "3361 | NC1C(=O)N[C@@H]1S" [label=""]
	"3362 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	1673 -> "3362 | NC1C(=O)N[C@@H]1S" [label=""]
	"3363 | BrCCCBr" [color=lightyellow shape=box style=filled]
	1673 -> "3363 | BrCCCBr" [label=""]
	"3364 | NC1C(=O)N[C@@H]1S" [color=lightgrey shape=box style=filled]
	1674 -> "3364 | NC1C(=O)N[C@@H]1S" [label=""]
	"3365 | O=CCCBr" [color=lightyellow shape=box style=filled]
	1674 -> "3365 | O=CCCBr" [label=""]
	"3366 | [Br]" [color=lightyellow shape=box style=filled]
	1675 -> "3366 | [Br]" [label=""]
	"3367 | CCOC(=O)C(N)[C@H](N)SCC[CH][Br+]C(=O)c1ccc(Br)cc1" [color=lightgrey shape=box style=filled]
	1675 -> "3367 | CCOC(=O)C(N)[C@H](N)SCC[CH][Br+]C(=O)c1ccc(Br)cc1" [label=""]
	"3368 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	1676 -> "3368 | O=C1CCC(=O)N1Br" [label=""]
	"3369 | SBr" [color=lightgrey shape=box style=filled]
	1676 -> "3369 | SBr" [label=""]
	"3370 | CI" [color=lightyellow shape=box style=filled]
	1677 -> "3370 | CI" [label=""]
	"3371 | c1nncs1" [color=lightyellow shape=box style=filled]
	1677 -> "3371 | c1nncs1" [label=""]
	"3372 | CC(S)=NN" [color=lightgrey shape=box style=filled]
	1678 -> "3372 | CC(S)=NN" [label=""]
	"3373 | C=O" [color=lightyellow shape=box style=filled]
	1678 -> "3373 | C=O" [label=""]
	"3374 | CC(=N)S" [color=lightgrey shape=box style=filled]
	1679 -> "3374 | CC(=N)S" [label=""]
	"3375 | NC=O" [color=lightyellow shape=box style=filled]
	1679 -> "3375 | NC=O" [label=""]
	"3376 | CC(=N)SCN" [color=lightgrey shape=box style=filled]
	1680 -> "3376 | CC(=N)SCN" [label=""]
	"3377 | CC(=N)S" [color=lightgrey shape=box style=filled]
	1681 -> "3377 | CC(=N)S" [label=""]
	"3378 | NC=O" [color=lightyellow shape=box style=filled]
	1681 -> "3378 | NC=O" [label=""]
	"3379 | N" [color=lightyellow shape=box style=filled]
	1682 -> "3379 | N" [label=""]
	"3380 | CSC(C)N" [color=lightgrey shape=box style=filled]
	1682 -> "3380 | CSC(C)N" [label=""]
	"3381 | N=CS" [color=lightgrey shape=box style=filled]
	1683 -> "3381 | N=CS" [label=""]
	"3382 | CC(N)=O" [color=lightyellow shape=box style=filled]
	1683 -> "3382 | CC(N)=O" [label=""]
	"3383 | CC(=N)SC=N" [color=lightgrey shape=box style=filled]
	1684 -> "3383 | CC(=N)SC=N" [label=""]
	"3384 | CC(O)S" [color=lightgrey shape=box style=filled]
	1685 -> "3384 | CC(O)S" [label=""]
	"3385 | C=NN" [color=lightgrey shape=box style=filled]
	1685 -> "3385 | C=NN" [label=""]
	"3386 | [SH]" [color=lightgrey shape=box style=filled]
	1686 -> "3386 | [SH]" [label=""]
	"3387 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	1686 -> "3387 | O=C1CCC(=O)N1Br" [label=""]
	"3388 | O=C=[S]Br" [color=lightgrey shape=box style=filled]
	1687 -> "3388 | O=C=[S]Br" [label=""]
	"3389 | NN" [color=lightyellow shape=box style=filled]
	1687 -> "3389 | NN" [label=""]
	"3390 | C=NNC(=O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	1688 -> "3390 | C=NNC(=O)OC(C)(C)C" [label=""]
	"3391 | SBr" [color=lightgrey shape=box style=filled]
	1688 -> "3391 | SBr" [label=""]
	"3392 | [N]N" [color=lightgrey shape=box style=filled]
	1689 -> "3392 | [N]N" [label=""]
	"3393 | [C]=[S]Br" [color=lightgrey shape=box style=filled]
	1689 -> "3393 | [C]=[S]Br" [label=""]
	"3394 | NN" [color=lightyellow shape=box style=filled]
	1690 -> "3394 | NN" [label=""]
	"3395 | BrC=[S]Br" [color=lightgrey shape=box style=filled]
	1690 -> "3395 | BrC=[S]Br" [label=""]
	"3396 | BrSBr" [color=lightgrey shape=box style=filled]
	1691 -> "3396 | BrSBr" [label=""]
	"3397 | C=NN" [color=lightgrey shape=box style=filled]
	1691 -> "3397 | C=NN" [label=""]
	"3398 | CCOP(=O)(C=[S]Br)OCC" [color=lightgrey shape=box style=filled]
	1692 -> "3398 | CCOP(=O)(C=[S]Br)OCC" [label=""]
	"3399 | NN" [color=lightyellow shape=box style=filled]
	1692 -> "3399 | NN" [label=""]
	"3400 | ClC=[S]Br" [color=lightgrey shape=box style=filled]
	1693 -> "3400 | ClC=[S]Br" [label=""]
	"3401 | NN" [color=lightyellow shape=box style=filled]
	1693 -> "3401 | NN" [label=""]
	"3402 | SBr" [color=lightgrey shape=box style=filled]
	1694 -> "3402 | SBr" [label=""]
	"3403 | NN=CCl" [color=lightgrey shape=box style=filled]
	1694 -> "3403 | NN=CCl" [label=""]
	"3404 | [C]=NN" [color=lightgrey shape=box style=filled]
	1695 -> "3404 | [C]=NN" [label=""]
	"3405 | [S]Br" [color=lightgrey shape=box style=filled]
	1695 -> "3405 | [S]Br" [label=""]
	"3406 | SBr" [color=lightgrey shape=box style=filled]
	1696 -> "3406 | SBr" [label=""]
	"3407 | CNN" [color=lightgrey shape=box style=filled]
	1696 -> "3407 | CNN" [label=""]
	"3408 | O=[SH](=O)Cl" [color=lightgrey shape=box style=filled]
	1697 -> "3408 | O=[SH](=O)Cl" [label=""]
	"3409 | CCI" [color=lightyellow shape=box style=filled]
	1697 -> "3409 | CCI" [label=""]
	"3410 | O=S=O" [color=lightyellow shape=box style=filled]
	1698 -> "3410 | O=S=O" [label=""]
	"3411 | CCI" [color=lightyellow shape=box style=filled]
	1698 -> "3411 | CCI" [label=""]
	"3412 | CC" [color=lightyellow shape=box style=filled]
	1699 -> "3412 | CC" [label=""]
	"3413 | O=[SH](=O)O" [color=lightyellow shape=box style=filled]
	1699 -> "3413 | O=[SH](=O)O" [label=""]
	"3414 | O=[SH](=O)O" [color=lightyellow shape=box style=filled]
	1700 -> "3414 | O=[SH](=O)O" [label=""]
	"3415 | CCI" [color=lightyellow shape=box style=filled]
	1700 -> "3415 | CCI" [label=""]
	"3416 | CC" [color=lightyellow shape=box style=filled]
	1701 -> "3416 | CC" [label=""]
	"3417 | O=[SH](=O)Cl" [color=lightgrey shape=box style=filled]
	1701 -> "3417 | O=[SH](=O)Cl" [label=""]
	"3418 | O=C(OO)c1cccc(Cl)c1" [color=lightyellow shape=box style=filled]
	1702 -> "3418 | O=C(OO)c1cccc(Cl)c1" [label=""]
	"3419 | CC[SH]=O" [color=lightgrey shape=box style=filled]
	1702 -> "3419 | CC[SH]=O" [label=""]
	"3420 | O=C(OO)c1cccc(Cl)c1" [color=lightyellow shape=box style=filled]
	1703 -> "3420 | O=C(OO)c1cccc(Cl)c1" [label=""]
	"3421 | CC[SH]=O" [color=lightgrey shape=box style=filled]
	1703 -> "3421 | CC[SH]=O" [label=""]
	"3422 | O=[S](=O)O" [color=lightgrey shape=box style=filled]
	1704 -> "3422 | O=[S](=O)O" [label=""]
	"3423 | CCI" [color=lightyellow shape=box style=filled]
	1704 -> "3423 | CCI" [label=""]
	"3424 | O=[SH](=O)Cl" [color=lightgrey shape=box style=filled]
	1705 -> "3424 | O=[SH](=O)Cl" [label=""]
	"3425 | CCO" [color=lightyellow shape=box style=filled]
	1705 -> "3425 | CCO" [label=""]
	"3426 | CCBr" [color=lightyellow shape=box style=filled]
	1706 -> "3426 | CCBr" [label=""]
	"3427 | O=S=O" [color=lightyellow shape=box style=filled]
	1706 -> "3427 | O=S=O" [label=""]
	"3428 | CCCS[C@@H](NCC(=O)O)C(NC(=O)OC(C)(C)C)C(=O)O" [color=lightgrey shape=box style=filled]
	1707 -> "3428 | CCCS[C@@H](NCC(=O)O)C(NC(=O)OC(C)(C)C)C(=O)O" [label=""]
	"3429 | CCCS[C@@H](NCC(=O)O)C(N)C(=O)O" [color=lightgrey shape=box style=filled]
	1708 -> "3429 | CCCS[C@@H](NCC(=O)O)C(N)C(=O)O" [label=""]
	"3430 | CC(O)CS[C@@H](NCC(=O)O)C(N)C(=O)O" [color=lightgrey shape=box style=filled]
	1709 -> "3430 | CC(O)CS[C@@H](NCC(=O)O)C(N)C(=O)O" [label=""]
	"3431 | CC(Cl)CS[C@@H](NCC(=O)O)C(N)C(=O)O" [color=lightgrey shape=box style=filled]
	1710 -> "3431 | CC(Cl)CS[C@@H](NCC(=O)O)C(N)C(=O)O" [label=""]
	"3432 | CC(Br)CS[C@@H](NCC(=O)O)C(N)C(=O)O" [color=lightgrey shape=box style=filled]
	1711 -> "3432 | CC(Br)CS[C@@H](NCC(=O)O)C(N)C(=O)O" [label=""]
	"3433 | CC1=C(C(=O)O)N[C@@H](CC(=O)O)SC1" [color=lightgrey shape=box style=filled]
	1712 -> "3433 | CC1=C(C(=O)O)N[C@@H](CC(=O)O)SC1" [label=""]
	"3434 | CC(C)(C)OC(N)=O" [color=lightyellow shape=box style=filled]
	1712 -> "3434 | CC(C)(C)OC(N)=O" [label=""]
	"3435 | CC1=C(C(=O)O)N[C@@H](C(NC(=O)OC(C)(C)C)C(=O)O)SC1" [color=lightgrey shape=box style=filled]
	1713 -> "3435 | CC1=C(C(=O)O)N[C@@H](C(NC(=O)OC(C)(C)C)C(=O)O)SC1" [label=""]
	"3436 | CC1=C(C(=O)O)N[C@@H](C(N[O-])C(=O)O)SC1" [color=lightgrey shape=box style=filled]
	1714 -> "3436 | CC1=C(C(=O)O)N[C@@H](C(N[O-])C(=O)O)SC1" [label=""]
	"3437 | CC(=O)CS[C@@H](NCC(=O)O)C(N)C(=O)O" [color=lightgrey shape=box style=filled]
	1715 -> "3437 | CC(=O)CS[C@@H](NCC(=O)O)C(N)C(=O)O" [label=""]
	"3438 | CC1=C(C(=O)O)N[C@@H](C(NC(=O)Cl)C(=O)O)SC1" [color=lightgrey shape=box style=filled]
	1716 -> "3438 | CC1=C(C(=O)O)N[C@@H](C(NC(=O)Cl)C(=O)O)SC1" [label=""]
	"3439 | OCc1ccccc1" [color=lightyellow shape=box style=filled]
	1716 -> "3439 | OCc1ccccc1" [label=""]
	"3440 | CC1=CN[C@@H](C(N)C(=O)O)SC1" [color=lightgrey shape=box style=filled]
	1717 -> "3440 | CC1=CN[C@@H](C(N)C(=O)O)SC1" [label=""]
	"3441 | CC(C=O)CS[C@H]1NC(=O)C1N" [color=lightgrey shape=box style=filled]
	1718 -> "3441 | CC(C=O)CS[C@H]1NC(=O)C1N" [label=""]
	"3442 | CC(C)CS[C@H]1NC(=O)C1N" [color=lightgrey shape=box style=filled]
	1719 -> "3442 | CC(C)CS[C@H]1NC(=O)C1N" [label=""]
	"3443 | CC1=CN2C(=O)C[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1720 -> "3443 | CC1=CN2C(=O)C[C@H]2SC1" [label=""]
	"3444 | CC(C)(C)OC(N)=O" [color=lightyellow shape=box style=filled]
	1720 -> "3444 | CC(C)(C)OC(N)=O" [label=""]
	"3445 | [CH]=C(C)C[S]" [color=lightgrey shape=box style=filled]
	1721 -> "3445 | [CH]=C(C)C[S]" [label=""]
	"3446 | NC1[CH][N]C1=O" [color=lightgrey shape=box style=filled]
	1721 -> "3446 | NC1[CH][N]C1=O" [label=""]
	"3447 | CC(=C=O)CS[C@H]1NC(=O)C1N" [color=lightgrey shape=box style=filled]
	1722 -> "3447 | CC(=C=O)CS[C@H]1NC(=O)C1N" [label=""]
	"3448 | CC(=CCl)CS[C@H]1NC(=O)C1N" [color=lightgrey shape=box style=filled]
	1723 -> "3448 | CC(=CCl)CS[C@H]1NC(=O)C1N" [label=""]
	"3449 | CC(=CBr)CS[C@H]1NC(=O)C1N" [color=lightgrey shape=box style=filled]
	1724 -> "3449 | CC(=CBr)CS[C@H]1NC(=O)C1N" [label=""]
	"3450 | CC1=CN2C(=O)C(NC(=O)OC(C)(C)C)[C@H]2SC1" [color=lightgrey shape=box style=filled]
	1725 -> "3450 | CC1=CN2C(=O)C(NC(=O)OC(C)(C)C)[C@H]2SC1" [label=""]
	"3451 | CC(C)CS" [color=lightyellow shape=box style=filled]
	1726 -> "3451 | CC(C)CS" [label=""]
	"3452 | NC1CNC1=O" [color=lightyellow shape=box style=filled]
	1726 -> "3452 | NC1CNC1=O" [label=""]
}
