digraph G {
	rankdir=LR
	node [shape=box]
	"1 | CCc1[nH]c(C(=O)N[C@H]2CCN(c3cccc(C(=O)OC(C)(C)C)c3)C[C@H]2OC)nc1C(F)(F)F" [color=lightblue shape=box style=filled]
	1 [color=aquamarine shape=rarrow style=filled]
	"1 | CCc1[nH]c(C(=O)N[C@H]2CCN(c3cccc(C(=O)OC(C)(C)C)c3)C[C@H]2OC)nc1C(F)(F)F" -> 1 [label=0.000]
	2 [color=aquamarine shape=rarrow style=filled]
	"1 | CCc1[nH]c(C(=O)N[C@H]2CCN(c3cccc(C(=O)OC(C)(C)C)c3)C[C@H]2OC)nc1C(F)(F)F" -> 2 [label=0.000]
	3 [color=aquamarine shape=rarrow style=filled]
	"1 | CCc1[nH]c(C(=O)N[C@H]2CCN(c3cccc(C(=O)OC(C)(C)C)c3)C[C@H]2OC)nc1C(F)(F)F" -> 3 [label=0.000]
	4 [color=aquamarine shape=rarrow style=filled]
	"1 | CCc1[nH]c(C(=O)N[C@H]2CCN(c3cccc(C(=O)OC(C)(C)C)c3)C[C@H]2OC)nc1C(F)(F)F" -> 4 [label=0.000]
	5 [color=lightblue shape=rarrow style=filled]
	"1 | CCc1[nH]c(C(=O)N[C@H]2CCN(c3cccc(C(=O)OC(C)(C)C)c3)C[C@H]2OC)nc1C(F)(F)F" -> 5 [label=0.000]
	6 [color=aquamarine shape=rarrow style=filled]
	"1 | CCc1[nH]c(C(=O)N[C@H]2CCN(c3cccc(C(=O)OC(C)(C)C)c3)C[C@H]2OC)nc1C(F)(F)F" -> 6 [label=0.000]
	7 [color=aquamarine shape=rarrow style=filled]
	"1 | CCc1[nH]c(C(=O)N[C@H]2CCN(c3cccc(C(=O)OC(C)(C)C)c3)C[C@H]2OC)nc1C(F)(F)F" -> 7 [label=0.000]
	8 [color=aquamarine shape=rarrow style=filled]
	"1 | CCc1[nH]c(C(=O)N[C@H]2CCN(c3cccc(C(=O)OC(C)(C)C)c3)C[C@H]2OC)nc1C(F)(F)F" -> 8 [label=0.000]
	9 [color=aquamarine shape=rarrow style=filled]
	"1 | CCc1[nH]c(C(=O)N[C@H]2CCN(c3cccc(C(=O)OC(C)(C)C)c3)C[C@H]2OC)nc1C(F)(F)F" -> 9 [label=0.000]
	10 [color=aquamarine shape=rarrow style=filled]
	"1 | CCc1[nH]c(C(=O)N[C@H]2CCN(c3cccc(C(=O)OC(C)(C)C)c3)C[C@H]2OC)nc1C(F)(F)F" -> 10 [label=0.000]
	"2 | CCc1[nH]c(C(=O)O)nc1C(F)(F)F" [color=lightblue shape=box style=filled]
	1 -> "2 | CCc1[nH]c(C(=O)O)nc1C(F)(F)F" [label=""]
	"3 | CO[C@@H]1CN(c2cccc(C(=O)OC(C)(C)C)c2)CC[C@@H]1N" [color=aquamarine shape=box style=filled]
	1 -> "3 | CO[C@@H]1CN(c2cccc(C(=O)OC(C)(C)C)c2)CC[C@@H]1N" [label=""]
	"4 | CC(C)(C)OC(=O)c1cccc(Br)c1" [color=lightyellow shape=box style=filled]
	2 -> "4 | CC(C)(C)OC(=O)c1cccc(Br)c1" [label=""]
	"5 | CCc1[nH]c(C(=O)N[C@H]2CCNC[C@H]2OC)nc1C(F)(F)F" [color=aquamarine shape=box style=filled]
	2 -> "5 | CCc1[nH]c(C(=O)N[C@H]2CCNC[C@H]2OC)nc1C(F)(F)F" [label=""]
	"6 | CC(C)(C)OC(=O)c1cccc(B(O)O)c1" [color=lightyellow shape=box style=filled]
	3 -> "6 | CC(C)(C)OC(=O)c1cccc(B(O)O)c1" [label=""]
	"7 | CCc1[nH]c(C(=O)N[C@H]2CCNC[C@H]2OC)nc1C(F)(F)F" [color=aquamarine shape=box style=filled]
	3 -> "7 | CCc1[nH]c(C(=O)N[C@H]2CCNC[C@H]2OC)nc1C(F)(F)F" [label=""]
	"8 | CC(C)(C)OC(=O)c1cccc(I)c1" [color=lightyellow shape=box style=filled]
	4 -> "8 | CC(C)(C)OC(=O)c1cccc(I)c1" [label=""]
	"9 | CCc1[nH]c(C(=O)N[C@H]2CCNC[C@H]2OC)nc1C(F)(F)F" [color=aquamarine shape=box style=filled]
	4 -> "9 | CCc1[nH]c(C(=O)N[C@H]2CCNC[C@H]2OC)nc1C(F)(F)F" [label=""]
	"10 | CC(C)(C)OC(=O)c1ccccc1" [color=lightyellow shape=box style=filled]
	5 -> "10 | CC(C)(C)OC(=O)c1ccccc1" [label=""]
	"11 | CCc1[nH]c(C(=O)O)nc1C(F)(F)F" [color=lightblue shape=box style=filled]
	5 -> "11 | CCc1[nH]c(C(=O)O)nc1C(F)(F)F" [label=""]
	"12 | CO[C@@H]1CNCC[C@@H]1N" [color=lightblue shape=box style=filled]
	5 -> "12 | CO[C@@H]1CNCC[C@@H]1N" [label=""]
	"13 | CC(C)(C)OC(=O)c1cccc(Br)c1" [color=lightyellow shape=box style=filled]
	6 -> "13 | CC(C)(C)OC(=O)c1cccc(Br)c1" [label=""]
	"14 | CCc1[nH]c(C(=O)N[C@H]2CC(=O)NC[C@H]2OC)nc1C(F)(F)F" [color=lightgrey shape=box style=filled]
	6 -> "14 | CCc1[nH]c(C(=O)N[C@H]2CC(=O)NC[C@H]2OC)nc1C(F)(F)F" [label=""]
	"15 | CCc1[nH]c(C(=O)N[C@H]2CC[N+](=O)C[C@H]2OC)nc1C(F)(F)F" [color=lightgrey shape=box style=filled]
	7 -> "15 | CCc1[nH]c(C(=O)N[C@H]2CC[N+](=O)C[C@H]2OC)nc1C(F)(F)F" [label=""]
	"16 | CC(C)(C)OC(=O)c1cccc(Br)c1" [color=lightyellow shape=box style=filled]
	7 -> "16 | CC(C)(C)OC(=O)c1cccc(Br)c1" [label=""]
	"17 | CCc1[nH]c(C(=O)O)nc1C(F)(F)F" [color=lightgrey shape=box style=filled]
	8 -> "17 | CCc1[nH]c(C(=O)O)nc1C(F)(F)F" [label=""]
	"18 | CO[C@@H]1CNCC[C@@H]1N" [color=lightgrey shape=box style=filled]
	8 -> "18 | CO[C@@H]1CNCC[C@@H]1N" [label=""]
	"19 | CC(C)(C)OC(=O)c1cccc(Br)c1" [color=lightyellow shape=box style=filled]
	8 -> "19 | CC(C)(C)OC(=O)c1cccc(Br)c1" [label=""]
	"20 | CC(C)(C)OC(=O)c1cccc(B(O)O)c1" [color=lightyellow shape=box style=filled]
	9 -> "20 | CC(C)(C)OC(=O)c1cccc(B(O)O)c1" [label=""]
	"21 | CCc1[nH]c(C(=O)N[C@H]2CC(=O)NC[C@H]2OC)nc1C(F)(F)F" [color=lightgrey shape=box style=filled]
	9 -> "21 | CCc1[nH]c(C(=O)N[C@H]2CC(=O)NC[C@H]2OC)nc1C(F)(F)F" [label=""]
	"22 | CCc1[nH]c(C(=O)N[C@H]2CC[N+](=O)C[C@H]2OC)nc1C(F)(F)F" [color=lightgrey shape=box style=filled]
	10 -> "22 | CCc1[nH]c(C(=O)N[C@H]2CC[N+](=O)C[C@H]2OC)nc1C(F)(F)F" [label=""]
	"23 | CC(C)(C)OC(=O)c1cccc(B(O)O)c1" [color=lightyellow shape=box style=filled]
	10 -> "23 | CC(C)(C)OC(=O)c1cccc(B(O)O)c1" [label=""]
	11 [color=lightblue shape=rarrow style=filled]
	"2 | CCc1[nH]c(C(=O)O)nc1C(F)(F)F" -> 11 [label=0.000]
	12 [color=aquamarine shape=rarrow style=filled]
	"2 | CCc1[nH]c(C(=O)O)nc1C(F)(F)F" -> 12 [label=0.000]
	13 [color=aquamarine shape=rarrow style=filled]
	"2 | CCc1[nH]c(C(=O)O)nc1C(F)(F)F" -> 13 [label=0.000]
	14 [color=aquamarine shape=rarrow style=filled]
	"2 | CCc1[nH]c(C(=O)O)nc1C(F)(F)F" -> 14 [label=0.000]
	15 [color=aquamarine shape=rarrow style=filled]
	"2 | CCc1[nH]c(C(=O)O)nc1C(F)(F)F" -> 15 [label=0.000]
	16 [color=aquamarine shape=rarrow style=filled]
	"2 | CCc1[nH]c(C(=O)O)nc1C(F)(F)F" -> 16 [label=0.000]
	17 [color=aquamarine shape=rarrow style=filled]
	"2 | CCc1[nH]c(C(=O)O)nc1C(F)(F)F" -> 17 [label=0.000]
	18 [color=aquamarine shape=rarrow style=filled]
	"2 | CCc1[nH]c(C(=O)O)nc1C(F)(F)F" -> 18 [label=0.000]
	19 [color=aquamarine shape=rarrow style=filled]
	"2 | CCc1[nH]c(C(=O)O)nc1C(F)(F)F" -> 19 [label=0.000]
	20 [color=aquamarine shape=rarrow style=filled]
	"3 | CO[C@@H]1CN(c2cccc(C(=O)OC(C)(C)C)c2)CC[C@@H]1N" -> 20 [label=0.000]
	21 [color=aquamarine shape=rarrow style=filled]
	"3 | CO[C@@H]1CN(c2cccc(C(=O)OC(C)(C)C)c2)CC[C@@H]1N" -> 21 [label=0.000]
	22 [color=aquamarine shape=rarrow style=filled]
	"3 | CO[C@@H]1CN(c2cccc(C(=O)OC(C)(C)C)c2)CC[C@@H]1N" -> 22 [label=0.000]
	23 [color=aquamarine shape=rarrow style=filled]
	"3 | CO[C@@H]1CN(c2cccc(C(=O)OC(C)(C)C)c2)CC[C@@H]1N" -> 23 [label=0.000]
	24 [color=aquamarine shape=rarrow style=filled]
	"3 | CO[C@@H]1CN(c2cccc(C(=O)OC(C)(C)C)c2)CC[C@@H]1N" -> 24 [label=0.000]
	25 [color=aquamarine shape=rarrow style=filled]
	"3 | CO[C@@H]1CN(c2cccc(C(=O)OC(C)(C)C)c2)CC[C@@H]1N" -> 25 [label=0.000]
	26 [color=aquamarine shape=rarrow style=filled]
	"3 | CO[C@@H]1CN(c2cccc(C(=O)OC(C)(C)C)c2)CC[C@@H]1N" -> 26 [label=0.000]
	27 [color=aquamarine shape=rarrow style=filled]
	"3 | CO[C@@H]1CN(c2cccc(C(=O)OC(C)(C)C)c2)CC[C@@H]1N" -> 27 [label=0.000]
	28 [color=aquamarine shape=rarrow style=filled]
	"5 | CCc1[nH]c(C(=O)N[C@H]2CCNC[C@H]2OC)nc1C(F)(F)F" -> 28 [label=0.000]
	29 [color=aquamarine shape=rarrow style=filled]
	"5 | CCc1[nH]c(C(=O)N[C@H]2CCNC[C@H]2OC)nc1C(F)(F)F" -> 29 [label=0.000]
	30 [color=aquamarine shape=rarrow style=filled]
	"7 | CCc1[nH]c(C(=O)N[C@H]2CCNC[C@H]2OC)nc1C(F)(F)F" -> 30 [label=0.000]
	31 [color=aquamarine shape=rarrow style=filled]
	"7 | CCc1[nH]c(C(=O)N[C@H]2CCNC[C@H]2OC)nc1C(F)(F)F" -> 31 [label=0.000]
	32 [color=aquamarine shape=rarrow style=filled]
	"9 | CCc1[nH]c(C(=O)N[C@H]2CCNC[C@H]2OC)nc1C(F)(F)F" -> 32 [label=0.000]
	33 [color=aquamarine shape=rarrow style=filled]
	"9 | CCc1[nH]c(C(=O)N[C@H]2CCNC[C@H]2OC)nc1C(F)(F)F" -> 33 [label=0.000]
	34 [color=lightblue shape=rarrow style=filled]
	"11 | CCc1[nH]c(C(=O)O)nc1C(F)(F)F" -> 34 [label=0.000]
	35 [color=aquamarine shape=rarrow style=filled]
	"11 | CCc1[nH]c(C(=O)O)nc1C(F)(F)F" -> 35 [label=0.000]
	36 [color=aquamarine shape=rarrow style=filled]
	"11 | CCc1[nH]c(C(=O)O)nc1C(F)(F)F" -> 36 [label=0.000]
	37 [color=aquamarine shape=rarrow style=filled]
	"11 | CCc1[nH]c(C(=O)O)nc1C(F)(F)F" -> 37 [label=0.000]
	38 [color=aquamarine shape=rarrow style=filled]
	"11 | CCc1[nH]c(C(=O)O)nc1C(F)(F)F" -> 38 [label=0.000]
	39 [color=aquamarine shape=rarrow style=filled]
	"11 | CCc1[nH]c(C(=O)O)nc1C(F)(F)F" -> 39 [label=0.000]
	40 [color=aquamarine shape=rarrow style=filled]
	"11 | CCc1[nH]c(C(=O)O)nc1C(F)(F)F" -> 40 [label=0.000]
	41 [color=aquamarine shape=rarrow style=filled]
	"11 | CCc1[nH]c(C(=O)O)nc1C(F)(F)F" -> 41 [label=0.000]
	42 [color=aquamarine shape=rarrow style=filled]
	"11 | CCc1[nH]c(C(=O)O)nc1C(F)(F)F" -> 42 [label=0.000]
	43 [color=lightblue shape=rarrow style=filled]
	"12 | CO[C@@H]1CNCC[C@@H]1N" -> 43 [label=0.000]
	44 [color=aquamarine shape=rarrow style=filled]
	"12 | CO[C@@H]1CNCC[C@@H]1N" -> 44 [label=0.000]
	45 [color=lightblue shape=rarrow style=filled]
	"12 | CO[C@@H]1CNCC[C@@H]1N" -> 45 [label=0.000]
	46 [color=aquamarine shape=rarrow style=filled]
	"12 | CO[C@@H]1CNCC[C@@H]1N" -> 46 [label=0.000]
	47 [color=aquamarine shape=rarrow style=filled]
	"12 | CO[C@@H]1CNCC[C@@H]1N" -> 47 [label=0.000]
	48 [color=lightblue shape=rarrow style=filled]
	"12 | CO[C@@H]1CNCC[C@@H]1N" -> 48 [label=0.000]
	49 [color=lightblue shape=rarrow style=filled]
	"12 | CO[C@@H]1CNCC[C@@H]1N" -> 49 [label=0.000]
	50 [color=lightblue shape=rarrow style=filled]
	"12 | CO[C@@H]1CNCC[C@@H]1N" -> 50 [label=0.000]
	51 [color=lightblue shape=rarrow style=filled]
	"12 | CO[C@@H]1CNCC[C@@H]1N" -> 51 [label=0.000]
	52 [color=aquamarine shape=rarrow style=filled]
	"12 | CO[C@@H]1CNCC[C@@H]1N" -> 52 [label=0.000]
	"24 | O=C(O)c1nc(C(F)(F)F)c[nH]1" [color=lightyellow shape=box style=filled]
	11 -> "24 | O=C(O)c1nc(C(F)(F)F)c[nH]1" [label=""]
	"25 | CCI" [color=lightyellow shape=box style=filled]
	11 -> "25 | CCI" [label=""]
	"26 | CCc1[nH]cnc1C(F)(F)F" [color=lightgrey shape=box style=filled]
	12 -> "26 | CCc1[nH]cnc1C(F)(F)F" [label=""]
	"27 | O=C=O" [color=lightyellow shape=box style=filled]
	12 -> "27 | O=C=O" [label=""]
	"28 | CCC=C(N)C(F)(F)F" [color=lightgrey shape=box style=filled]
	13 -> "28 | CCC=C(N)C(F)(F)F" [label=""]
	"29 | NC(=O)C(=O)O" [color=lightyellow shape=box style=filled]
	13 -> "29 | NC(=O)C(=O)O" [label=""]
	"30 | NC(=NCC(F)(F)F)C(=O)O" [color=lightgrey shape=box style=filled]
	14 -> "30 | NC(=NCC(F)(F)F)C(=O)O" [label=""]
	"31 | CCC(=O)O" [color=lightyellow shape=box style=filled]
	14 -> "31 | CCC(=O)O" [label=""]
	"32 | NC(=NCC(F)(F)F)C(=O)O" [color=lightgrey shape=box style=filled]
	15 -> "32 | NC(=NCC(F)(F)F)C(=O)O" [label=""]
	"33 | CCC=O" [color=lightyellow shape=box style=filled]
	15 -> "33 | CCC=O" [label=""]
	"34 | NC(=NC(=O)C(F)(F)F)C(=O)O" [color=lightgrey shape=box style=filled]
	16 -> "34 | NC(=NC(=O)C(F)(F)F)C(=O)O" [label=""]
	"35 | CCC=O" [color=lightyellow shape=box style=filled]
	16 -> "35 | CCC=O" [label=""]
	"36 | CCC" [color=lightyellow shape=box style=filled]
	17 -> "36 | CCC" [label=""]
	"37 | NC(=NC(=O)C(F)(F)F)C(=O)O" [color=lightgrey shape=box style=filled]
	17 -> "37 | NC(=NC(=O)C(F)(F)F)C(=O)O" [label=""]
	"38 | O=C=O" [color=lightyellow shape=box style=filled]
	18 -> "38 | O=C=O" [label=""]
	"39 | CCc1[nH]c(Cl)nc1C(F)(F)F" [color=lightgrey shape=box style=filled]
	18 -> "39 | CCc1[nH]c(Cl)nc1C(F)(F)F" [label=""]
	"40 | CCC=C(N)C(F)(F)F" [color=lightgrey shape=box style=filled]
	19 -> "40 | CCC=C(N)C(F)(F)F" [label=""]
	"41 | NC(O)C(=O)O" [color=lightgrey shape=box style=filled]
	19 -> "41 | NC(O)C(=O)O" [label=""]
	"42 | CO[C@@H]1CNCC[C@@H]1N" [color=lightgrey shape=box style=filled]
	20 -> "42 | CO[C@@H]1CNCC[C@@H]1N" [label=""]
	"43 | CC(C)(C)OC(=O)c1cccc(Br)c1" [color=lightyellow shape=box style=filled]
	20 -> "43 | CC(C)(C)OC(=O)c1cccc(Br)c1" [label=""]
	"44 | CO[C@@H]1CNC(=O)C[C@@H]1N" [color=lightgrey shape=box style=filled]
	21 -> "44 | CO[C@@H]1CNC(=O)C[C@@H]1N" [label=""]
	"45 | CC(C)(C)OC(=O)c1cccc(Br)c1" [color=lightyellow shape=box style=filled]
	21 -> "45 | CC(C)(C)OC(=O)c1cccc(Br)c1" [label=""]
	"46 | CC(C)(C)OC(=O)c1cccc(B(O)O)c1" [color=lightyellow shape=box style=filled]
	22 -> "46 | CC(C)(C)OC(=O)c1cccc(B(O)O)c1" [label=""]
	"47 | CO[C@@H]1CNCC[C@@H]1N" [color=lightgrey shape=box style=filled]
	22 -> "47 | CO[C@@H]1CNCC[C@@H]1N" [label=""]
	"48 | CO[C@@H]1CNC(=O)C[C@@H]1N" [color=lightgrey shape=box style=filled]
	23 -> "48 | CO[C@@H]1CNC(=O)C[C@@H]1N" [label=""]
	"49 | CC(C)(C)OC(=O)c1cccc(B(O)O)c1" [color=lightyellow shape=box style=filled]
	23 -> "49 | CC(C)(C)OC(=O)c1cccc(B(O)O)c1" [label=""]
	"50 | CC(C)(C=O)OC(=O)c1cccc(B(O)O)c1" [color=lightgrey shape=box style=filled]
	24 -> "50 | CC(C)(C=O)OC(=O)c1cccc(B(O)O)c1" [label=""]
	"51 | CO[C@@H]1CNCC[C@@H]1N" [color=lightgrey shape=box style=filled]
	24 -> "51 | CO[C@@H]1CNCC[C@@H]1N" [label=""]
	"52 | CC(C)(C=O)OC(=O)c1cccc(B(O)O)c1" [color=lightgrey shape=box style=filled]
	25 -> "52 | CC(C)(C=O)OC(=O)c1cccc(B(O)O)c1" [label=""]
	"53 | CO[C@@H]1CNCC[C@@H]1N" [color=lightgrey shape=box style=filled]
	25 -> "53 | CO[C@@H]1CNCC[C@@H]1N" [label=""]
	"54 | CC(C)(C=O)OC(=O)c1cccc(B(O)O)c1" [color=lightgrey shape=box style=filled]
	26 -> "54 | CC(C)(C=O)OC(=O)c1cccc(B(O)O)c1" [label=""]
	"55 | CO[C@@H]1CNCC[C@@H]1N" [color=lightgrey shape=box style=filled]
	26 -> "55 | CO[C@@H]1CNCC[C@@H]1N" [label=""]
	"56 | CO[C@@H]1C(=O)[N+](=O)CC[C@@H]1NC(=O)O" [color=lightgrey shape=box style=filled]
	27 -> "56 | CO[C@@H]1C(=O)[N+](=O)CC[C@@H]1NC(=O)O" [label=""]
	"57 | O=C(Cl)c1ccccc1" [color=lightyellow shape=box style=filled]
	27 -> "57 | O=C(Cl)c1ccccc1" [label=""]
	"58 | CC(C)(C)OC(=O)c1cccc(Br)c1" [color=lightyellow shape=box style=filled]
	27 -> "58 | CC(C)(C)OC(=O)c1cccc(Br)c1" [label=""]
	"59 | CCc1[nH]c(C(=O)O)nc1C(F)(F)F" [color=lightgrey shape=box style=filled]
	28 -> "59 | CCc1[nH]c(C(=O)O)nc1C(F)(F)F" [label=""]
	"60 | CO[C@@H]1CNCC[C@@H]1N" [color=lightgrey shape=box style=filled]
	28 -> "60 | CO[C@@H]1CNCC[C@@H]1N" [label=""]
	"61 | CCc1[nH]c(C(=O)N[C@@H](CC=O)[C@@H](C[N+](=O)C(=O)OC(C)(C=O)C(=O)Cl)OC=[Br+])nc1C(F)(F)F" [color=lightgrey shape=box style=filled]
	29 -> "61 | CCc1[nH]c(C(=O)N[C@@H](CC=O)[C@@H](C[N+](=O)C(=O)OC(C)(C=O)C(=O)Cl)OC=[Br+])nc1C(F)(F)F" [label=""]
	"62 | CCc1[nH]c(C(=O)O)nc1C(F)(F)F" [color=lightgrey shape=box style=filled]
	30 -> "62 | CCc1[nH]c(C(=O)O)nc1C(F)(F)F" [label=""]
	"63 | CO[C@@H]1CNCC[C@@H]1N" [color=lightgrey shape=box style=filled]
	30 -> "63 | CO[C@@H]1CNCC[C@@H]1N" [label=""]
	"64 | CCc1[nH]c(C(=O)N[C@@H](CC=O)[C@@H](C[N+](=O)C(=O)OC(C)(C=O)C(=O)Cl)OC=[Br+])nc1C(F)(F)F" [color=lightgrey shape=box style=filled]
	31 -> "64 | CCc1[nH]c(C(=O)N[C@@H](CC=O)[C@@H](C[N+](=O)C(=O)OC(C)(C=O)C(=O)Cl)OC=[Br+])nc1C(F)(F)F" [label=""]
	"65 | CCc1[nH]c(C(=O)O)nc1C(F)(F)F" [color=lightgrey shape=box style=filled]
	32 -> "65 | CCc1[nH]c(C(=O)O)nc1C(F)(F)F" [label=""]
	"66 | CO[C@@H]1CNCC[C@@H]1N" [color=lightgrey shape=box style=filled]
	32 -> "66 | CO[C@@H]1CNCC[C@@H]1N" [label=""]
	"67 | CCc1[nH]c(C(=O)N[C@@H](CC=O)[C@@H](C[N+](=O)C(=O)OC(C)(C=O)C(=O)Cl)OC=[Br+])nc1C(F)(F)F" [color=lightgrey shape=box style=filled]
	33 -> "67 | CCc1[nH]c(C(=O)N[C@@H](CC=O)[C@@H](C[N+](=O)C(=O)OC(C)(C=O)C(=O)Cl)OC=[Br+])nc1C(F)(F)F" [label=""]
	"68 | O=C(O)c1nc(C(F)(F)F)c[nH]1" [color=lightyellow shape=box style=filled]
	34 -> "68 | O=C(O)c1nc(C(F)(F)F)c[nH]1" [label=""]
	"69 | CCI" [color=lightyellow shape=box style=filled]
	34 -> "69 | CCI" [label=""]
	"70 | CCc1[nH]cnc1C(F)(F)F" [color=lightgrey shape=box style=filled]
	35 -> "70 | CCc1[nH]cnc1C(F)(F)F" [label=""]
	"71 | O=C=O" [color=lightyellow shape=box style=filled]
	35 -> "71 | O=C=O" [label=""]
	"72 | CCC=C(N)C(F)(F)F" [color=lightgrey shape=box style=filled]
	36 -> "72 | CCC=C(N)C(F)(F)F" [label=""]
	"73 | NC(=O)C(=O)O" [color=lightyellow shape=box style=filled]
	36 -> "73 | NC(=O)C(=O)O" [label=""]
	"74 | NC(=NCC(F)(F)F)C(=O)O" [color=lightgrey shape=box style=filled]
	37 -> "74 | NC(=NCC(F)(F)F)C(=O)O" [label=""]
	"75 | CCC(=O)O" [color=lightyellow shape=box style=filled]
	37 -> "75 | CCC(=O)O" [label=""]
	"76 | NC(=NCC(F)(F)F)C(=O)O" [color=lightgrey shape=box style=filled]
	38 -> "76 | NC(=NCC(F)(F)F)C(=O)O" [label=""]
	"77 | CCC=O" [color=lightyellow shape=box style=filled]
	38 -> "77 | CCC=O" [label=""]
	"78 | NC(=NC(=O)C(F)(F)F)C(=O)O" [color=lightgrey shape=box style=filled]
	39 -> "78 | NC(=NC(=O)C(F)(F)F)C(=O)O" [label=""]
	"79 | CCC=O" [color=lightyellow shape=box style=filled]
	39 -> "79 | CCC=O" [label=""]
	"80 | CCC" [color=lightyellow shape=box style=filled]
	40 -> "80 | CCC" [label=""]
	"81 | NC(=NC(=O)C(F)(F)F)C(=O)O" [color=lightgrey shape=box style=filled]
	40 -> "81 | NC(=NC(=O)C(F)(F)F)C(=O)O" [label=""]
	"82 | O=C=O" [color=lightyellow shape=box style=filled]
	41 -> "82 | O=C=O" [label=""]
	"83 | CCc1[nH]c(Cl)nc1C(F)(F)F" [color=lightgrey shape=box style=filled]
	41 -> "83 | CCc1[nH]c(Cl)nc1C(F)(F)F" [label=""]
	"84 | CCC=C(N)C(F)(F)F" [color=lightgrey shape=box style=filled]
	42 -> "84 | CCC=C(N)C(F)(F)F" [label=""]
	"85 | NC(O)C(=O)O" [color=lightgrey shape=box style=filled]
	42 -> "85 | NC(O)C(=O)O" [label=""]
	"86 | N[C@H]1CCNC[C@H]1O" [color=lightyellow shape=box style=filled]
	43 -> "86 | N[C@H]1CCNC[C@H]1O" [label=""]
	"87 | CO" [color=lightyellow shape=box style=filled]
	43 -> "87 | CO" [label=""]
	"88 | CO[C@@H]1CNCC[C@@H]1NC(=O)OCc1ccccc1" [color=lightgrey shape=box style=filled]
	44 -> "88 | CO[C@@H]1CNCC[C@@H]1NC(=O)OCc1ccccc1" [label=""]
	"89 | COCCNCCCNC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	45 -> "89 | COCCNCCCNC(=O)OC(C)(C)C" [label=""]
	"90 | CO" [color=lightyellow shape=box style=filled]
	46 -> "90 | CO" [label=""]
	"91 | N[C@H]1CCNCC1=O" [color=lightgrey shape=box style=filled]
	46 -> "91 | N[C@H]1CCNCC1=O" [label=""]
	"92 | CO[C@@H]1CNCC[C@@H]1N[O-]" [color=lightgrey shape=box style=filled]
	47 -> "92 | CO[C@@H]1CNCC[C@@H]1N[O-]" [label=""]
	"93 | CO[C@H]1CCCNC1" [color=lightyellow shape=box style=filled]
	48 -> "93 | CO[C@H]1CCCNC1" [label=""]
	"94 | CC(C)(C)OC(N)=O" [color=lightyellow shape=box style=filled]
	48 -> "94 | CC(C)(C)OC(N)=O" [label=""]
	"95 | COCCNCCC(N)=O" [color=lightyellow shape=box style=filled]
	49 -> "95 | COCCNCCC(N)=O" [label=""]
	"96 | CO[C@@H]1CNCC[C@@H]1NC(=O)OC(C)(C)C" [color=lightyellow shape=box style=filled]
	50 -> "96 | CO[C@@H]1CNCC[C@@H]1NC(=O)OC(C)(C)C" [label=""]
	"97 | COCCN" [color=lightyellow shape=box style=filled]
	51 -> "97 | COCCN" [label=""]
	"98 | NCCCBr" [color=lightyellow shape=box style=filled]
	51 -> "98 | NCCCBr" [label=""]
	"99 | CO[C@@H]1CNCC[C@@H]1N=O" [color=lightgrey shape=box style=filled]
	52 -> "99 | CO[C@@H]1CNCC[C@@H]1N=O" [label=""]
}
