digraph G {
	rankdir=LR
	node [shape=box]
	"1 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(OCCOc3c(Cl)cc(C)cc3Cl)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [color=lightblue shape=box style=filled]
	1 [color=lightblue shape=rarrow style=filled]
	"1 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(OCCOc3c(Cl)cc(C)cc3Cl)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 1 [label=0.000]
	2 [color=aquamarine shape=rarrow style=filled]
	"1 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(OCCOc3c(Cl)cc(C)cc3Cl)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 2 [label=0.000]
	3 [color=aquamarine shape=rarrow style=filled]
	"1 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(OCCOc3c(Cl)cc(C)cc3Cl)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 3 [label=0.000]
	4 [color=aquamarine shape=rarrow style=filled]
	"1 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(OCCOc3c(Cl)cc(C)cc3Cl)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 4 [label=0.000]
	5 [color=aquamarine shape=rarrow style=filled]
	"1 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(OCCOc3c(Cl)cc(C)cc3Cl)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 5 [label=0.000]
	6 [color=aquamarine shape=rarrow style=filled]
	"1 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(OCCOc3c(Cl)cc(C)cc3Cl)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 6 [label=0.000]
	7 [color=aquamarine shape=rarrow style=filled]
	"1 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(OCCOc3c(Cl)cc(C)cc3Cl)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 7 [label=0.000]
	8 [color=aquamarine shape=rarrow style=filled]
	"1 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(OCCOc3c(Cl)cc(C)cc3Cl)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 8 [label=0.000]
	9 [color=aquamarine shape=rarrow style=filled]
	"1 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(OCCOc3c(Cl)cc(C)cc3Cl)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 9 [label=0.000]
	10 [color=aquamarine shape=rarrow style=filled]
	"1 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(OCCOc3c(Cl)cc(C)cc3Cl)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 10 [label=0.000]
	"2 | COCCCc1cc(CNC2CC2)cc(OCCC(C)(C)C(=O)O)c1" [color=lightblue shape=box style=filled]
	1 -> "2 | COCCCc1cc(CNC2CC2)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"3 | Cc1cc(Cl)c(OCCOc2ccc([C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C(=O)O)cc2)c(Cl)c1" [color=lightblue shape=box style=filled]
	1 -> "3 | Cc1cc(Cl)c(OCCOc2ccc([C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C(=O)O)cc2)c(Cl)c1" [label=""]
	"4 | COCCCc1cc(O)cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(OCCOc3c(Cl)cc(C)cc3Cl)cc2)C2CC2)c1" [color=aquamarine shape=box style=filled]
	2 -> "4 | COCCCc1cc(O)cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(OCCOc3c(Cl)cc(C)cc3Cl)cc2)C2CC2)c1" [label=""]
	"5 | CC(C)(CCCl)C(=O)O" [color=lightyellow shape=box style=filled]
	2 -> "5 | CC(C)(CCCl)C(=O)O" [label=""]
	"6 | COCCCc1cc(CCl)cc(OCCC(C)(C)C(=O)O)c1" [color=lightblue shape=box style=filled]
	3 -> "6 | COCCCc1cc(CCl)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"7 | Cc1cc(Cl)c(OCCOc2ccc([C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C(=O)NC3CC3)cc2)c(Cl)c1" [color=aquamarine shape=box style=filled]
	3 -> "7 | Cc1cc(Cl)c(OCCOc2ccc([C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C(=O)NC3CC3)cc2)c(Cl)c1" [label=""]
	"8 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [color=aquamarine shape=box style=filled]
	4 -> "8 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"9 | Cc1cc(Cl)c(OCCBr)c(Cl)c1" [color=lightblue shape=box style=filled]
	4 -> "9 | Cc1cc(Cl)c(OCCBr)c(Cl)c1" [label=""]
	"10 | Cc1cc(Cl)c(OCCOc2ccc([C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C(=O)NC3CC3)cc2)c(Cl)c1" [color=aquamarine shape=box style=filled]
	5 -> "10 | Cc1cc(Cl)c(OCCOc2ccc([C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C(=O)NC3CC3)cc2)c(Cl)c1" [label=""]
	"11 | COCCCc1cc(CBr)cc(OCCC(C)(C)C(=O)O)c1" [color=aquamarine shape=box style=filled]
	5 -> "11 | COCCCc1cc(CBr)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"12 | COCCCc1cc(C=O)cc(OCCC(C)(C)C(=O)O)c1" [color=aquamarine shape=box style=filled]
	6 -> "12 | COCCCc1cc(C=O)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"13 | Cc1cc(Cl)c(OCCOc2ccc([C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C(=O)NC3CC3)cc2)c(Cl)c1" [color=aquamarine shape=box style=filled]
	6 -> "13 | Cc1cc(Cl)c(OCCOc2ccc([C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C(=O)NC3CC3)cc2)c(Cl)c1" [label=""]
	"14 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [color=aquamarine shape=box style=filled]
	7 -> "14 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"15 | Cc1cc(Cl)c(OCCCl)c(Cl)c1" [color=lightblue shape=box style=filled]
	7 -> "15 | Cc1cc(Cl)c(OCCCl)c(Cl)c1" [label=""]
	"16 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [color=aquamarine shape=box style=filled]
	8 -> "16 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"17 | Cc1cc(Cl)c(OCC=O)c(Cl)c1" [color=lightblue shape=box style=filled]
	8 -> "17 | Cc1cc(Cl)c(OCC=O)c(Cl)c1" [label=""]
	"18 | CCOc1c(Cl)cc(C)cc1Cl" [color=lightyellow shape=box style=filled]
	9 -> "18 | CCOc1c(Cl)cc(C)cc1Cl" [label=""]
	"19 | COCCC(Br)c1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [color=aquamarine shape=box style=filled]
	9 -> "19 | COCCC(Br)c1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"20 | Cc1cc(Cl)c(OCCO)c(Cl)c1" [color=lightblue shape=box style=filled]
	10 -> "20 | Cc1cc(Cl)c(OCCO)c(Cl)c1" [label=""]
	"21 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [color=aquamarine shape=box style=filled]
	10 -> "21 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	11 [color=lightblue shape=rarrow style=filled]
	"2 | COCCCc1cc(CNC2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 11 [label=0.000]
	12 [color=aquamarine shape=rarrow style=filled]
	"2 | COCCCc1cc(CNC2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 12 [label=0.000]
	13 [color=aquamarine shape=rarrow style=filled]
	"2 | COCCCc1cc(CNC2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 13 [label=0.000]
	14 [color=lightblue shape=rarrow style=filled]
	"2 | COCCCc1cc(CNC2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 14 [label=0.000]
	15 [color=lightblue shape=rarrow style=filled]
	"2 | COCCCc1cc(CNC2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 15 [label=0.000]
	16 [color=lightblue shape=rarrow style=filled]
	"2 | COCCCc1cc(CNC2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 16 [label=0.000]
	17 [color=lightblue shape=rarrow style=filled]
	"2 | COCCCc1cc(CNC2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 17 [label=0.000]
	18 [color=lightblue shape=rarrow style=filled]
	"2 | COCCCc1cc(CNC2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 18 [label=0.000]
	19 [color=aquamarine shape=rarrow style=filled]
	"2 | COCCCc1cc(CNC2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 19 [label=0.000]
	20 [color=aquamarine shape=rarrow style=filled]
	"2 | COCCCc1cc(CNC2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 20 [label=0.000]
	21 [color=lightblue shape=rarrow style=filled]
	"3 | Cc1cc(Cl)c(OCCOc2ccc([C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C(=O)O)cc2)c(Cl)c1" -> 21 [label=0.000]
	22 [color=aquamarine shape=rarrow style=filled]
	"3 | Cc1cc(Cl)c(OCCOc2ccc([C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C(=O)O)cc2)c(Cl)c1" -> 22 [label=0.000]
	23 [color=aquamarine shape=rarrow style=filled]
	"3 | Cc1cc(Cl)c(OCCOc2ccc([C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C(=O)O)cc2)c(Cl)c1" -> 23 [label=0.000]
	24 [color=aquamarine shape=rarrow style=filled]
	"3 | Cc1cc(Cl)c(OCCOc2ccc([C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C(=O)O)cc2)c(Cl)c1" -> 24 [label=0.000]
	25 [color=aquamarine shape=rarrow style=filled]
	"3 | Cc1cc(Cl)c(OCCOc2ccc([C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C(=O)O)cc2)c(Cl)c1" -> 25 [label=0.000]
	26 [color=aquamarine shape=rarrow style=filled]
	"3 | Cc1cc(Cl)c(OCCOc2ccc([C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C(=O)O)cc2)c(Cl)c1" -> 26 [label=0.000]
	27 [color=aquamarine shape=rarrow style=filled]
	"3 | Cc1cc(Cl)c(OCCOc2ccc([C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C(=O)O)cc2)c(Cl)c1" -> 27 [label=0.000]
	28 [color=aquamarine shape=rarrow style=filled]
	"4 | COCCCc1cc(O)cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(OCCOc3c(Cl)cc(C)cc3Cl)cc2)C2CC2)c1" -> 28 [label=0.000]
	29 [color=aquamarine shape=rarrow style=filled]
	"4 | COCCCc1cc(O)cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(OCCOc3c(Cl)cc(C)cc3Cl)cc2)C2CC2)c1" -> 29 [label=0.000]
	30 [color=aquamarine shape=rarrow style=filled]
	"4 | COCCCc1cc(O)cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(OCCOc3c(Cl)cc(C)cc3Cl)cc2)C2CC2)c1" -> 30 [label=0.000]
	31 [color=aquamarine shape=rarrow style=filled]
	"4 | COCCCc1cc(O)cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(OCCOc3c(Cl)cc(C)cc3Cl)cc2)C2CC2)c1" -> 31 [label=0.000]
	32 [color=aquamarine shape=rarrow style=filled]
	"4 | COCCCc1cc(O)cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(OCCOc3c(Cl)cc(C)cc3Cl)cc2)C2CC2)c1" -> 32 [label=0.000]
	33 [color=aquamarine shape=rarrow style=filled]
	"4 | COCCCc1cc(O)cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(OCCOc3c(Cl)cc(C)cc3Cl)cc2)C2CC2)c1" -> 33 [label=0.000]
	34 [color=aquamarine shape=rarrow style=filled]
	"4 | COCCCc1cc(O)cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(OCCOc3c(Cl)cc(C)cc3Cl)cc2)C2CC2)c1" -> 34 [label=0.000]
	35 [color=aquamarine shape=rarrow style=filled]
	"4 | COCCCc1cc(O)cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(OCCOc3c(Cl)cc(C)cc3Cl)cc2)C2CC2)c1" -> 35 [label=0.000]
	36 [color=aquamarine shape=rarrow style=filled]
	"4 | COCCCc1cc(O)cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(OCCOc3c(Cl)cc(C)cc3Cl)cc2)C2CC2)c1" -> 36 [label=0.000]
	37 [color=aquamarine shape=rarrow style=filled]
	"4 | COCCCc1cc(O)cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(OCCOc3c(Cl)cc(C)cc3Cl)cc2)C2CC2)c1" -> 37 [label=0.000]
	38 [color=aquamarine shape=rarrow style=filled]
	"6 | COCCCc1cc(CCl)cc(OCCC(C)(C)C(=O)O)c1" -> 38 [label=0.000]
	39 [color=aquamarine shape=rarrow style=filled]
	"6 | COCCCc1cc(CCl)cc(OCCC(C)(C)C(=O)O)c1" -> 39 [label=0.000]
	40 [color=lightblue shape=rarrow style=filled]
	"6 | COCCCc1cc(CCl)cc(OCCC(C)(C)C(=O)O)c1" -> 40 [label=0.000]
	41 [color=aquamarine shape=rarrow style=filled]
	"6 | COCCCc1cc(CCl)cc(OCCC(C)(C)C(=O)O)c1" -> 41 [label=0.000]
	42 [color=lightblue shape=rarrow style=filled]
	"6 | COCCCc1cc(CCl)cc(OCCC(C)(C)C(=O)O)c1" -> 42 [label=0.000]
	43 [color=aquamarine shape=rarrow style=filled]
	"7 | Cc1cc(Cl)c(OCCOc2ccc([C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C(=O)NC3CC3)cc2)c(Cl)c1" -> 43 [label=0.000]
	44 [color=aquamarine shape=rarrow style=filled]
	"8 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 44 [label=0.000]
	45 [color=aquamarine shape=rarrow style=filled]
	"8 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 45 [label=0.000]
	46 [color=aquamarine shape=rarrow style=filled]
	"8 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 46 [label=0.000]
	47 [color=aquamarine shape=rarrow style=filled]
	"8 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 47 [label=0.000]
	48 [color=aquamarine shape=rarrow style=filled]
	"8 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 48 [label=0.000]
	49 [color=aquamarine shape=rarrow style=filled]
	"8 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 49 [label=0.000]
	50 [color=aquamarine shape=rarrow style=filled]
	"8 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 50 [label=0.000]
	51 [color=aquamarine shape=rarrow style=filled]
	"8 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 51 [label=0.000]
	52 [color=aquamarine shape=rarrow style=filled]
	"8 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 52 [label=0.000]
	53 [color=aquamarine shape=rarrow style=filled]
	"8 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 53 [label=0.000]
	54 [color=lightblue shape=rarrow style=filled]
	"9 | Cc1cc(Cl)c(OCCBr)c(Cl)c1" -> 54 [label=0.000]
	55 [color=lightblue shape=rarrow style=filled]
	"9 | Cc1cc(Cl)c(OCCBr)c(Cl)c1" -> 55 [label=0.000]
	56 [color=lightblue shape=rarrow style=filled]
	"9 | Cc1cc(Cl)c(OCCBr)c(Cl)c1" -> 56 [label=0.000]
	57 [color=lightblue shape=rarrow style=filled]
	"9 | Cc1cc(Cl)c(OCCBr)c(Cl)c1" -> 57 [label=0.000]
	58 [color=aquamarine shape=rarrow style=filled]
	"9 | Cc1cc(Cl)c(OCCBr)c(Cl)c1" -> 58 [label=0.000]
	59 [color=aquamarine shape=rarrow style=filled]
	"9 | Cc1cc(Cl)c(OCCBr)c(Cl)c1" -> 59 [label=0.000]
	60 [color=aquamarine shape=rarrow style=filled]
	"9 | Cc1cc(Cl)c(OCCBr)c(Cl)c1" -> 60 [label=0.000]
	61 [color=lightblue shape=rarrow style=filled]
	"9 | Cc1cc(Cl)c(OCCBr)c(Cl)c1" -> 61 [label=0.000]
	62 [color=aquamarine shape=rarrow style=filled]
	"10 | Cc1cc(Cl)c(OCCOc2ccc([C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C(=O)NC3CC3)cc2)c(Cl)c1" -> 62 [label=0.000]
	63 [color=aquamarine shape=rarrow style=filled]
	"11 | COCCCc1cc(CBr)cc(OCCC(C)(C)C(=O)O)c1" -> 63 [label=0.000]
	64 [color=aquamarine shape=rarrow style=filled]
	"11 | COCCCc1cc(CBr)cc(OCCC(C)(C)C(=O)O)c1" -> 64 [label=0.000]
	65 [color=aquamarine shape=rarrow style=filled]
	"11 | COCCCc1cc(CBr)cc(OCCC(C)(C)C(=O)O)c1" -> 65 [label=0.000]
	66 [color=aquamarine shape=rarrow style=filled]
	"11 | COCCCc1cc(CBr)cc(OCCC(C)(C)C(=O)O)c1" -> 66 [label=0.000]
	67 [color=aquamarine shape=rarrow style=filled]
	"12 | COCCCc1cc(C=O)cc(OCCC(C)(C)C(=O)O)c1" -> 67 [label=0.000]
	68 [color=aquamarine shape=rarrow style=filled]
	"12 | COCCCc1cc(C=O)cc(OCCC(C)(C)C(=O)O)c1" -> 68 [label=0.000]
	69 [color=aquamarine shape=rarrow style=filled]
	"12 | COCCCc1cc(C=O)cc(OCCC(C)(C)C(=O)O)c1" -> 69 [label=0.000]
	70 [color=aquamarine shape=rarrow style=filled]
	"13 | Cc1cc(Cl)c(OCCOc2ccc([C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C(=O)NC3CC3)cc2)c(Cl)c1" -> 70 [label=0.000]
	71 [color=aquamarine shape=rarrow style=filled]
	"14 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 71 [label=0.000]
	72 [color=aquamarine shape=rarrow style=filled]
	"14 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 72 [label=0.000]
	73 [color=aquamarine shape=rarrow style=filled]
	"14 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 73 [label=0.000]
	74 [color=aquamarine shape=rarrow style=filled]
	"14 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 74 [label=0.000]
	75 [color=aquamarine shape=rarrow style=filled]
	"14 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 75 [label=0.000]
	76 [color=aquamarine shape=rarrow style=filled]
	"14 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 76 [label=0.000]
	77 [color=aquamarine shape=rarrow style=filled]
	"14 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 77 [label=0.000]
	78 [color=aquamarine shape=rarrow style=filled]
	"14 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 78 [label=0.000]
	79 [color=aquamarine shape=rarrow style=filled]
	"14 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 79 [label=0.000]
	80 [color=aquamarine shape=rarrow style=filled]
	"14 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 80 [label=0.000]
	81 [color=lightblue shape=rarrow style=filled]
	"15 | Cc1cc(Cl)c(OCCCl)c(Cl)c1" -> 81 [label=0.000]
	82 [color=aquamarine shape=rarrow style=filled]
	"15 | Cc1cc(Cl)c(OCCCl)c(Cl)c1" -> 82 [label=0.000]
	83 [color=lightblue shape=rarrow style=filled]
	"15 | Cc1cc(Cl)c(OCCCl)c(Cl)c1" -> 83 [label=0.000]
	84 [color=aquamarine shape=rarrow style=filled]
	"15 | Cc1cc(Cl)c(OCCCl)c(Cl)c1" -> 84 [label=0.000]
	85 [color=aquamarine shape=rarrow style=filled]
	"15 | Cc1cc(Cl)c(OCCCl)c(Cl)c1" -> 85 [label=0.000]
	86 [color=lightblue shape=rarrow style=filled]
	"15 | Cc1cc(Cl)c(OCCCl)c(Cl)c1" -> 86 [label=0.000]
	87 [color=lightblue shape=rarrow style=filled]
	"15 | Cc1cc(Cl)c(OCCCl)c(Cl)c1" -> 87 [label=0.000]
	88 [color=lightblue shape=rarrow style=filled]
	"15 | Cc1cc(Cl)c(OCCCl)c(Cl)c1" -> 88 [label=0.000]
	89 [color=aquamarine shape=rarrow style=filled]
	"15 | Cc1cc(Cl)c(OCCCl)c(Cl)c1" -> 89 [label=0.000]
	90 [color=aquamarine shape=rarrow style=filled]
	"15 | Cc1cc(Cl)c(OCCCl)c(Cl)c1" -> 90 [label=0.000]
	91 [color=aquamarine shape=rarrow style=filled]
	"16 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 91 [label=0.000]
	92 [color=aquamarine shape=rarrow style=filled]
	"16 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 92 [label=0.000]
	93 [color=aquamarine shape=rarrow style=filled]
	"16 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 93 [label=0.000]
	94 [color=aquamarine shape=rarrow style=filled]
	"16 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 94 [label=0.000]
	95 [color=aquamarine shape=rarrow style=filled]
	"16 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 95 [label=0.000]
	96 [color=aquamarine shape=rarrow style=filled]
	"16 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 96 [label=0.000]
	97 [color=aquamarine shape=rarrow style=filled]
	"16 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 97 [label=0.000]
	98 [color=aquamarine shape=rarrow style=filled]
	"16 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 98 [label=0.000]
	99 [color=aquamarine shape=rarrow style=filled]
	"16 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 99 [label=0.000]
	100 [color=aquamarine shape=rarrow style=filled]
	"16 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 100 [label=0.000]
	101 [color=lightblue shape=rarrow style=filled]
	"17 | Cc1cc(Cl)c(OCC=O)c(Cl)c1" -> 101 [label=0.000]
	102 [color=lightblue shape=rarrow style=filled]
	"17 | Cc1cc(Cl)c(OCC=O)c(Cl)c1" -> 102 [label=0.000]
	103 [color=lightblue shape=rarrow style=filled]
	"17 | Cc1cc(Cl)c(OCC=O)c(Cl)c1" -> 103 [label=0.000]
	104 [color=aquamarine shape=rarrow style=filled]
	"17 | Cc1cc(Cl)c(OCC=O)c(Cl)c1" -> 104 [label=0.000]
	105 [color=lightblue shape=rarrow style=filled]
	"17 | Cc1cc(Cl)c(OCC=O)c(Cl)c1" -> 105 [label=0.000]
	106 [color=lightblue shape=rarrow style=filled]
	"17 | Cc1cc(Cl)c(OCC=O)c(Cl)c1" -> 106 [label=0.000]
	107 [color=aquamarine shape=rarrow style=filled]
	"17 | Cc1cc(Cl)c(OCC=O)c(Cl)c1" -> 107 [label=0.000]
	108 [color=aquamarine shape=rarrow style=filled]
	"17 | Cc1cc(Cl)c(OCC=O)c(Cl)c1" -> 108 [label=0.000]
	109 [color=aquamarine shape=rarrow style=filled]
	"17 | Cc1cc(Cl)c(OCC=O)c(Cl)c1" -> 109 [label=0.000]
	110 [color=aquamarine shape=rarrow style=filled]
	"19 | COCCC(Br)c1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 110 [label=0.000]
	111 [color=aquamarine shape=rarrow style=filled]
	"19 | COCCC(Br)c1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 111 [label=0.000]
	112 [color=aquamarine shape=rarrow style=filled]
	"19 | COCCC(Br)c1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 112 [label=0.000]
	113 [color=aquamarine shape=rarrow style=filled]
	"19 | COCCC(Br)c1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 113 [label=0.000]
	114 [color=aquamarine shape=rarrow style=filled]
	"19 | COCCC(Br)c1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 114 [label=0.000]
	115 [color=aquamarine shape=rarrow style=filled]
	"19 | COCCC(Br)c1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 115 [label=0.000]
	116 [color=aquamarine shape=rarrow style=filled]
	"19 | COCCC(Br)c1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 116 [label=0.000]
	117 [color=aquamarine shape=rarrow style=filled]
	"19 | COCCC(Br)c1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 117 [label=0.000]
	118 [color=aquamarine shape=rarrow style=filled]
	"19 | COCCC(Br)c1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 118 [label=0.000]
	119 [color=aquamarine shape=rarrow style=filled]
	"19 | COCCC(Br)c1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 119 [label=0.000]
	120 [color=lightblue shape=rarrow style=filled]
	"20 | Cc1cc(Cl)c(OCCO)c(Cl)c1" -> 120 [label=0.000]
	121 [color=lightblue shape=rarrow style=filled]
	"20 | Cc1cc(Cl)c(OCCO)c(Cl)c1" -> 121 [label=0.000]
	122 [color=lightblue shape=rarrow style=filled]
	"20 | Cc1cc(Cl)c(OCCO)c(Cl)c1" -> 122 [label=0.000]
	123 [color=lightblue shape=rarrow style=filled]
	"20 | Cc1cc(Cl)c(OCCO)c(Cl)c1" -> 123 [label=0.000]
	124 [color=aquamarine shape=rarrow style=filled]
	"20 | Cc1cc(Cl)c(OCCO)c(Cl)c1" -> 124 [label=0.000]
	125 [color=lightblue shape=rarrow style=filled]
	"20 | Cc1cc(Cl)c(OCCO)c(Cl)c1" -> 125 [label=0.000]
	126 [color=aquamarine shape=rarrow style=filled]
	"20 | Cc1cc(Cl)c(OCCO)c(Cl)c1" -> 126 [label=0.000]
	127 [color=aquamarine shape=rarrow style=filled]
	"20 | Cc1cc(Cl)c(OCCO)c(Cl)c1" -> 127 [label=0.000]
	128 [color=aquamarine shape=rarrow style=filled]
	"20 | Cc1cc(Cl)c(OCCO)c(Cl)c1" -> 128 [label=0.000]
	129 [color=aquamarine shape=rarrow style=filled]
	"20 | Cc1cc(Cl)c(OCCO)c(Cl)c1" -> 129 [label=0.000]
	130 [color=aquamarine shape=rarrow style=filled]
	"21 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 130 [label=0.000]
	131 [color=aquamarine shape=rarrow style=filled]
	"21 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 131 [label=0.000]
	132 [color=aquamarine shape=rarrow style=filled]
	"21 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 132 [label=0.000]
	133 [color=aquamarine shape=rarrow style=filled]
	"21 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 133 [label=0.000]
	134 [color=aquamarine shape=rarrow style=filled]
	"21 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 134 [label=0.000]
	135 [color=aquamarine shape=rarrow style=filled]
	"21 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 135 [label=0.000]
	136 [color=aquamarine shape=rarrow style=filled]
	"21 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 136 [label=0.000]
	137 [color=aquamarine shape=rarrow style=filled]
	"21 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 137 [label=0.000]
	138 [color=aquamarine shape=rarrow style=filled]
	"21 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 138 [label=0.000]
	139 [color=aquamarine shape=rarrow style=filled]
	"21 | COCCCc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" -> 139 [label=0.000]
	"22 | COCCCc1cc(O)cc(CNC2CC2)c1" [color=lightblue shape=box style=filled]
	11 -> "22 | COCCCc1cc(O)cc(CNC2CC2)c1" [label=""]
	"23 | CC(C)(CCCl)C(=O)O" [color=lightyellow shape=box style=filled]
	11 -> "23 | CC(C)(CCCl)C(=O)O" [label=""]
	"24 | NC1CC1" [color=lightyellow shape=box style=filled]
	12 -> "24 | NC1CC1" [label=""]
	"25 | COCCCc1cc(C=O)cc(OCCC(C)(C)C(=O)O)c1" [color=aquamarine shape=box style=filled]
	12 -> "25 | COCCCc1cc(C=O)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"26 | CNC1CC1" [color=lightyellow shape=box style=filled]
	13 -> "26 | CNC1CC1" [label=""]
	"27 | COCCCc1cc(Br)cc(OCCC(C)(C)C(=O)O)c1" [color=aquamarine shape=box style=filled]
	13 -> "27 | COCCCc1cc(Br)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"28 | NC1CC1" [color=lightyellow shape=box style=filled]
	14 -> "28 | NC1CC1" [label=""]
	"29 | COCCCc1cc(CCl)cc(OCCC(C)(C)C(=O)O)c1" [color=lightblue shape=box style=filled]
	14 -> "29 | COCCCc1cc(CCl)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"30 | CNC1CC1" [color=lightyellow shape=box style=filled]
	15 -> "30 | CNC1CC1" [label=""]
	"31 | COCCCc1cc(Cl)cc(OCCC(C)(C)C(=O)O)c1" [color=lightblue shape=box style=filled]
	15 -> "31 | COCCCc1cc(Cl)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"32 | O=CNC1CC1" [color=lightyellow shape=box style=filled]
	16 -> "32 | O=CNC1CC1" [label=""]
	"33 | COCCCc1cccc(OCCC(C)(C)C(=O)O)c1" [color=lightblue shape=box style=filled]
	16 -> "33 | COCCCc1cccc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"34 | COCCCc1cccc(OCCC(C)(C)C(=O)O)c1" [color=lightblue shape=box style=filled]
	17 -> "34 | COCCCc1cccc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"35 | CC(C)(C)OC(=O)CNC1CC1" [color=lightyellow shape=box style=filled]
	17 -> "35 | CC(C)(C)OC(=O)CNC1CC1" [label=""]
	"36 | CNC1CC1" [color=lightyellow shape=box style=filled]
	18 -> "36 | CNC1CC1" [label=""]
	"37 | COCCCc1cc(OCCC(C)(C)C(=O)O)cc(B2OC(C)(C)C(C)(C)O2)c1" [color=lightblue shape=box style=filled]
	18 -> "37 | COCCCc1cc(OCCC(C)(C)C(=O)O)cc(B2OC(C)(C)C(C)(C)O2)c1" [label=""]
	"38 | CNC1CC1" [color=lightyellow shape=box style=filled]
	19 -> "38 | CNC1CC1" [label=""]
	"39 | CC(C)(CCOc1cc(Br)cc(CCCOC=O)c1)C(=O)O" [color=aquamarine shape=box style=filled]
	19 -> "39 | CC(C)(CCOc1cc(Br)cc(CCCOC=O)c1)C(=O)O" [label=""]
	"40 | O=CNC1CC1" [color=lightyellow shape=box style=filled]
	20 -> "40 | O=CNC1CC1" [label=""]
	"41 | COCCCc1cc(Br)cc(OCCC(C)(C)C(=O)O)c1" [color=aquamarine shape=box style=filled]
	20 -> "41 | COCCCc1cc(Br)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"42 | Cc1cc(Cl)c(OCCOc2ccc(C3CCN(C(=O)OC(C)(C)C)CC3)cc2)c(Cl)c1" [color=lightblue shape=box style=filled]
	21 -> "42 | Cc1cc(Cl)c(OCCOc2ccc(C3CCN(C(=O)OC(C)(C)C)CC3)cc2)c(Cl)c1" [label=""]
	"43 | O=C=O" [color=lightyellow shape=box style=filled]
	21 -> "43 | O=C=O" [label=""]
	"44 | Cc1cc(Cl)c(OCCOc2ccc(Br)cc2)c(Cl)c1" [color=lightgrey shape=box style=filled]
	22 -> "44 | Cc1cc(Cl)c(OCCOc2ccc(Br)cc2)c(Cl)c1" [label=""]
	"45 | CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)O)C1" [color=lightyellow shape=box style=filled]
	22 -> "45 | CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)O)C1" [label=""]
	"46 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)O)C1" [color=lightgrey shape=box style=filled]
	23 -> "46 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)O)C1" [label=""]
	"47 | Cc1cc(Cl)c(OCCBr)c(Cl)c1" [color=lightgrey shape=box style=filled]
	23 -> "47 | Cc1cc(Cl)c(OCCBr)c(Cl)c1" [label=""]
	"48 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)O)C1" [color=lightgrey shape=box style=filled]
	24 -> "48 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)O)C1" [label=""]
	"49 | Cc1cc(Cl)c(OCCCl)c(Cl)c1" [color=lightgrey shape=box style=filled]
	24 -> "49 | Cc1cc(Cl)c(OCCCl)c(Cl)c1" [label=""]
	"50 | Cc1cc(Cl)c(OCCOc2ccc(B(O)O)cc2)c(Cl)c1" [color=lightgrey shape=box style=filled]
	25 -> "50 | Cc1cc(Cl)c(OCCOc2ccc(B(O)O)cc2)c(Cl)c1" [label=""]
	"51 | CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)O)C1" [color=lightyellow shape=box style=filled]
	25 -> "51 | CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)O)C1" [label=""]
	"52 | Cc1cc(Cl)c(OCCOc2ccc(CCCN(CC(=O)C(=O)O)C(=O)OC(C)(C)C)cc2)c(Cl)c1" [color=lightgrey shape=box style=filled]
	26 -> "52 | Cc1cc(Cl)c(OCCOc2ccc(CCCN(CC(=O)C(=O)O)C(=O)OC(C)(C)C)cc2)c(Cl)c1" [label=""]
	"53 | Cc1cc(Cl)c(OCCOc2ccc(C(=O)CCN(CCC(=O)O)C(=O)OC(C)(C)C)cc2)c(Cl)c1" [color=lightgrey shape=box style=filled]
	27 -> "53 | Cc1cc(Cl)c(OCCOc2ccc(C(=O)CCN(CCC(=O)O)C(=O)OC(C)(C)C)cc2)c(Cl)c1" [label=""]
	"54 | COCCCc1cc(O)cc(CNC2CC2)c1" [color=lightgrey shape=box style=filled]
	28 -> "54 | COCCCc1cc(O)cc(CNC2CC2)c1" [label=""]
	"55 | Cc1cc(Cl)c(OCCOc2ccc([C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C(=O)O)cc2)c(Cl)c1" [color=lightgrey shape=box style=filled]
	28 -> "55 | Cc1cc(Cl)c(OCCOc2ccc([C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C(=O)O)cc2)c(Cl)c1" [label=""]
	"56 | COCCCc1cc(O)cc(CBr)c1" [color=lightgrey shape=box style=filled]
	29 -> "56 | COCCCc1cc(O)cc(CBr)c1" [label=""]
	"57 | Cc1cc(Cl)c(OCCOc2ccc([C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C(=O)NC3CC3)cc2)c(Cl)c1" [color=lightgrey shape=box style=filled]
	29 -> "57 | Cc1cc(Cl)c(OCCOc2ccc([C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C(=O)NC3CC3)cc2)c(Cl)c1" [label=""]
	"58 | Cc1cc(Cl)c(OCCOc2ccc([C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C(=O)NC3CC3)cc2)c(Cl)c1" [color=lightgrey shape=box style=filled]
	30 -> "58 | Cc1cc(Cl)c(OCCOc2ccc([C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C(=O)NC3CC3)cc2)c(Cl)c1" [label=""]
	"59 | COCCCc1cc(O)cc(C=O)c1" [color=lightgrey shape=box style=filled]
	30 -> "59 | COCCCc1cc(O)cc(C=O)c1" [label=""]
	"60 | COCCCc1cc(O)cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)c1" [color=lightgrey shape=box style=filled]
	31 -> "60 | COCCCc1cc(O)cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)c1" [label=""]
	"61 | Cc1cc(Cl)c(OCCBr)c(Cl)c1" [color=lightgrey shape=box style=filled]
	31 -> "61 | Cc1cc(Cl)c(OCCBr)c(Cl)c1" [label=""]
	"62 | COCCCc1cc(O)cc(CCl)c1" [color=lightgrey shape=box style=filled]
	32 -> "62 | COCCCc1cc(O)cc(CCl)c1" [label=""]
	"63 | Cc1cc(Cl)c(OCCOc2ccc([C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C(=O)NC3CC3)cc2)c(Cl)c1" [color=lightgrey shape=box style=filled]
	32 -> "63 | Cc1cc(Cl)c(OCCOc2ccc([C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C(=O)NC3CC3)cc2)c(Cl)c1" [label=""]
	"64 | COCCCc1cc(O)cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)c1" [color=lightgrey shape=box style=filled]
	33 -> "64 | COCCCc1cc(O)cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)c1" [label=""]
	"65 | Cc1cc(Cl)c(OCCCl)c(Cl)c1" [color=lightgrey shape=box style=filled]
	33 -> "65 | Cc1cc(Cl)c(OCCCl)c(Cl)c1" [label=""]
	"66 | COCCCBr" [color=lightyellow shape=box style=filled]
	34 -> "66 | COCCCBr" [label=""]
	"67 | Cc1cc(Cl)c(OCCOc2ccc([C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C(=O)NC3CC3)cc2)c(Cl)c1" [color=lightgrey shape=box style=filled]
	34 -> "67 | Cc1cc(Cl)c(OCCOc2ccc([C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C(=O)NC3CC3)cc2)c(Cl)c1" [label=""]
	"68 | Cc1cccc(O)c1" [color=lightyellow shape=box style=filled]
	34 -> "68 | Cc1cccc(O)c1" [label=""]
	"69 | Cc1cc(Cl)c(OCCOc2ccc([C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C(=O)NC3CC3)cc2)c(Cl)c1" [color=lightgrey shape=box style=filled]
	35 -> "69 | Cc1cc(Cl)c(OCCOc2ccc([C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C(=O)NC3CC3)cc2)c(Cl)c1" [label=""]
	"70 | COCCCc1cc(O)cc(CO)c1" [color=lightgrey shape=box style=filled]
	35 -> "70 | COCCCc1cc(O)cc(CO)c1" [label=""]
	"71 | COCCCc1cc(O)cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)c1" [color=lightgrey shape=box style=filled]
	36 -> "71 | COCCCc1cc(O)cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)c1" [label=""]
	"72 | Cc1cc(Cl)c(OCC=O)c(Cl)c1" [color=lightgrey shape=box style=filled]
	36 -> "72 | Cc1cc(Cl)c(OCC=O)c(Cl)c1" [label=""]
	"73 | Cc1cc(Cl)c(OCCO)c(Cl)c1" [color=lightgrey shape=box style=filled]
	37 -> "73 | Cc1cc(Cl)c(OCCO)c(Cl)c1" [label=""]
	"74 | COCCCc1cc(O)cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)c1" [color=lightgrey shape=box style=filled]
	37 -> "74 | COCCCc1cc(O)cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)c1" [label=""]
	"75 | COCCCc1cc(O)cc(CCl)c1" [color=lightgrey shape=box style=filled]
	38 -> "75 | COCCCc1cc(O)cc(CCl)c1" [label=""]
	"76 | CC(C)(CCCl)C(=O)O" [color=lightyellow shape=box style=filled]
	38 -> "76 | CC(C)(CCCl)C(=O)O" [label=""]
	"77 | CC(C)(CCOc1cccc(CCl)c1)C(=O)O" [color=lightgrey shape=box style=filled]
	39 -> "77 | CC(C)(CCOc1cccc(CCl)c1)C(=O)O" [label=""]
	"78 | COCCCBr" [color=lightyellow shape=box style=filled]
	39 -> "78 | COCCCBr" [label=""]
	"79 | COCCCBr" [color=lightyellow shape=box style=filled]
	40 -> "79 | COCCCBr" [label=""]
	"80 | Oc1cccc(CCl)c1" [color=lightyellow shape=box style=filled]
	40 -> "80 | Oc1cccc(CCl)c1" [label=""]
	"81 | CCC(C)(C)C(=O)O" [color=lightyellow shape=box style=filled]
	40 -> "81 | CCC(C)(C)C(=O)O" [label=""]
	"82 | [CH2]CCOC" [color=lightgrey shape=box style=filled]
	41 -> "82 | [CH2]CCOC" [label=""]
	"83 | [O]c1c[c]cc(CCl)c1" [color=lightgrey shape=box style=filled]
	41 -> "83 | [O]c1c[c]cc(CCl)c1" [label=""]
	"84 | [CH2]CC(C)(C)C(=O)O" [color=lightgrey shape=box style=filled]
	41 -> "84 | [CH2]CC(C)(C)C(=O)O" [label=""]
	"85 | Oc1cccc(CCl)c1" [color=lightyellow shape=box style=filled]
	42 -> "85 | Oc1cccc(CCl)c1" [label=""]
	"86 | CCC(C)(C)C(=O)O" [color=lightyellow shape=box style=filled]
	42 -> "86 | CCC(C)(C)C(=O)O" [label=""]
	"87 | COCCC=O" [color=lightyellow shape=box style=filled]
	42 -> "87 | COCCC=O" [label=""]
	"88 | NC1CC1" [color=lightyellow shape=box style=filled]
	43 -> "88 | NC1CC1" [label=""]
	"89 | Cc1cc(Cl)c(OCCOc2ccc([C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C(=O)O)cc2)c(Cl)c1" [color=lightgrey shape=box style=filled]
	43 -> "89 | Cc1cc(Cl)c(OCCOc2ccc([C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C(=O)O)cc2)c(Cl)c1" [label=""]
	"90 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)O)C1" [color=lightgrey shape=box style=filled]
	44 -> "90 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)O)C1" [label=""]
	"91 | COCCCc1cc(CNC2CC2)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	44 -> "91 | COCCCc1cc(CNC2CC2)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"92 | COCCCc1cc(O)cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)c1" [color=lightgrey shape=box style=filled]
	45 -> "92 | COCCCc1cc(O)cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)c1" [label=""]
	"93 | CC(C)(CCCl)C(=O)O" [color=lightyellow shape=box style=filled]
	45 -> "93 | CC(C)(CCCl)C(=O)O" [label=""]
	"94 | Oc1ccc(Br)cc1" [color=lightyellow shape=box style=filled]
	46 -> "94 | Oc1ccc(Br)cc1" [label=""]
	"95 | COCCCc1cc(CN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	46 -> "95 | COCCCc1cc(CN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"96 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [color=lightgrey shape=box style=filled]
	47 -> "96 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [label=""]
	"97 | COCCCc1cc(CCl)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	47 -> "97 | COCCCc1cc(CCl)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"98 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [color=lightgrey shape=box style=filled]
	48 -> "98 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [label=""]
	"99 | COCCCc1cc(CBr)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	48 -> "99 | COCCCc1cc(CBr)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"100 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [color=lightgrey shape=box style=filled]
	49 -> "100 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [label=""]
	"101 | COCCCc1cc(C=O)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	49 -> "101 | COCCCc1cc(C=O)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"102 | COCCCc1cc(CN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	50 -> "102 | COCCCc1cc(CN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"103 | OB(O)c1ccc(O)cc1" [color=lightyellow shape=box style=filled]
	50 -> "103 | OB(O)c1ccc(O)cc1" [label=""]
	"104 | COCCCc1cc(CN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	51 -> "104 | COCCCc1cc(CN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"105 | Oc1ccc(Cl)cc1" [color=lightyellow shape=box style=filled]
	51 -> "105 | Oc1ccc(Cl)cc1" [label=""]
	"106 | COCCCc1cc(CN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	52 -> "106 | COCCCc1cc(CN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"107 | CC1(C)OB(c2ccc(O)cc2)OC1(C)C" [color=lightyellow shape=box style=filled]
	52 -> "107 | CC1(C)OB(c2ccc(O)cc2)OC1(C)C" [label=""]
	"108 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [color=lightgrey shape=box style=filled]
	53 -> "108 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [label=""]
	"109 | COCCCc1cccc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	53 -> "109 | COCCCc1cccc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"110 | CI" [color=lightyellow shape=box style=filled]
	53 -> "110 | CI" [label=""]
	"111 | ClCCBr" [color=lightyellow shape=box style=filled]
	54 -> "111 | ClCCBr" [label=""]
	"112 | Cc1cc(Cl)c(O)c(Cl)c1" [color=lightyellow shape=box style=filled]
	54 -> "112 | Cc1cc(Cl)c(O)c(Cl)c1" [label=""]
	"113 | OCCBr" [color=lightyellow shape=box style=filled]
	55 -> "113 | OCCBr" [label=""]
	"114 | Cc1cc(Cl)c(Cl)c(Cl)c1" [color=lightyellow shape=box style=filled]
	55 -> "114 | Cc1cc(Cl)c(Cl)c(Cl)c1" [label=""]
	"115 | OCCBr" [color=lightyellow shape=box style=filled]
	56 -> "115 | OCCBr" [label=""]
	"116 | Cc1cc(Cl)c(Br)c(Cl)c1" [color=lightyellow shape=box style=filled]
	56 -> "116 | Cc1cc(Cl)c(Br)c(Cl)c1" [label=""]
	"117 | O=C1CCC(=O)N1Cl" [color=lightyellow shape=box style=filled]
	57 -> "117 | O=C1CCC(=O)N1Cl" [label=""]
	"118 | Cc1ccc(OCCBr)c(Cl)c1" [color=lightyellow shape=box style=filled]
	57 -> "118 | Cc1ccc(OCCBr)c(Cl)c1" [label=""]
	"119 | Cc1cc(Cl)c(O)c(Cl)c1" [color=lightyellow shape=box style=filled]
	58 -> "119 | Cc1cc(Cl)c(O)c(Cl)c1" [label=""]
	"120 | BrCCBr" [color=lightgrey shape=box style=filled]
	58 -> "120 | BrCCBr" [label=""]
	"121 | Cc1cc(Cl)cc(Cl)c1" [color=lightyellow shape=box style=filled]
	59 -> "121 | Cc1cc(Cl)cc(Cl)c1" [label=""]
	"122 | OC(Cl)CBr" [color=lightgrey shape=box style=filled]
	59 -> "122 | OC(Cl)CBr" [label=""]
	"123 | Cc1cc(Cl)cc(Cl)c1" [color=lightyellow shape=box style=filled]
	60 -> "123 | Cc1cc(Cl)cc(Cl)c1" [label=""]
	"124 | OC(Br)CBr" [color=lightgrey shape=box style=filled]
	60 -> "124 | OC(Br)CBr" [label=""]
	"125 | ClC(Cl)(Cl)Cl" [color=lightyellow shape=box style=filled]
	61 -> "125 | ClC(Cl)(Cl)Cl" [label=""]
	"126 | Cc1ccc(OCCBr)c(Cl)c1" [color=lightyellow shape=box style=filled]
	61 -> "126 | Cc1ccc(OCCBr)c(Cl)c1" [label=""]
	"127 | NC1CC1" [color=lightyellow shape=box style=filled]
	62 -> "127 | NC1CC1" [label=""]
	"128 | Cc1cc(Cl)c(OCCOc2ccc([C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C(=O)O)cc2)c(Cl)c1" [color=lightgrey shape=box style=filled]
	62 -> "128 | Cc1cc(Cl)c(OCCOc2ccc([C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C(=O)O)cc2)c(Cl)c1" [label=""]
	"129 | COCCCc1cc(O)cc(CBr)c1" [color=lightgrey shape=box style=filled]
	63 -> "129 | COCCCc1cc(O)cc(CBr)c1" [label=""]
	"130 | CC(C)(CCCl)C(=O)O" [color=lightyellow shape=box style=filled]
	63 -> "130 | CC(C)(CCCl)C(=O)O" [label=""]
	"131 | CC(C)(CCOc1cccc(CBr)c1)C(=O)O" [color=lightgrey shape=box style=filled]
	64 -> "131 | CC(C)(CCOc1cccc(CBr)c1)C(=O)O" [label=""]
	"132 | COCCCBr" [color=lightyellow shape=box style=filled]
	64 -> "132 | COCCCBr" [label=""]
	"133 | CC(C)(CCOc1cc(Br)cc(CBr)c1)C(=O)O" [color=lightgrey shape=box style=filled]
	65 -> "133 | CC(C)(CCOc1cc(Br)cc(CBr)c1)C(=O)O" [label=""]
	"134 | COCCCBr" [color=lightyellow shape=box style=filled]
	65 -> "134 | COCCCBr" [label=""]
	"135 | CC(C)(C)C(=O)O[P](=O)O" [color=lightgrey shape=box style=filled]
	66 -> "135 | CC(C)(C)C(=O)O[P](=O)O" [label=""]
	"136 | COCCCc1cc(CBr)cc(OC)c1" [color=lightgrey shape=box style=filled]
	66 -> "136 | COCCCc1cc(CBr)cc(OC)c1" [label=""]
	"137 | OCCCl" [color=lightgrey shape=box style=filled]
	66 -> "137 | OCCCl" [label=""]
	"138 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	66 -> "138 | O=C1CCC(=O)N1Br" [label=""]
	"139 | CCO" [color=lightyellow shape=box style=filled]
	66 -> "139 | CCO" [label=""]
	"140 | CC(C)(CCCl)C(=O)O" [color=lightyellow shape=box style=filled]
	67 -> "140 | CC(C)(CCCl)C(=O)O" [label=""]
	"141 | COCCCc1cc(O)cc(C=O)c1" [color=lightgrey shape=box style=filled]
	67 -> "141 | COCCCc1cc(O)cc(C=O)c1" [label=""]
	"142 | COCCCBr" [color=lightyellow shape=box style=filled]
	68 -> "142 | COCCCBr" [label=""]
	"143 | CC(C)(CCOc1cccc(C=O)c1)C(=O)O" [color=lightgrey shape=box style=filled]
	68 -> "143 | CC(C)(CCOc1cccc(C=O)c1)C(=O)O" [label=""]
	"144 | CCC(C)(C)C(=O)O" [color=lightyellow shape=box style=filled]
	69 -> "144 | CCC(C)(C)C(=O)O" [label=""]
	"145 | COCCCc1cc(O)cc(C(=O)O)c1" [color=lightgrey shape=box style=filled]
	69 -> "145 | COCCCc1cc(O)cc(C(=O)O)c1" [label=""]
	"146 | NC1CC1" [color=lightyellow shape=box style=filled]
	70 -> "146 | NC1CC1" [label=""]
	"147 | Cc1cc(Cl)c(OCCOc2ccc([C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C(=O)O)cc2)c(Cl)c1" [color=lightgrey shape=box style=filled]
	70 -> "147 | Cc1cc(Cl)c(OCCOc2ccc([C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C(=O)O)cc2)c(Cl)c1" [label=""]
	"148 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)O)C1" [color=lightgrey shape=box style=filled]
	71 -> "148 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)O)C1" [label=""]
	"149 | COCCCc1cc(CNC2CC2)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	71 -> "149 | COCCCc1cc(CNC2CC2)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"150 | COCCCc1cc(O)cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)c1" [color=lightgrey shape=box style=filled]
	72 -> "150 | COCCCc1cc(O)cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)c1" [label=""]
	"151 | CC(C)(CCCl)C(=O)O" [color=lightyellow shape=box style=filled]
	72 -> "151 | CC(C)(CCCl)C(=O)O" [label=""]
	"152 | Oc1ccc(Br)cc1" [color=lightyellow shape=box style=filled]
	73 -> "152 | Oc1ccc(Br)cc1" [label=""]
	"153 | COCCCc1cc(CN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	73 -> "153 | COCCCc1cc(CN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"154 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [color=lightgrey shape=box style=filled]
	74 -> "154 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [label=""]
	"155 | COCCCc1cc(CCl)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	74 -> "155 | COCCCc1cc(CCl)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"156 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [color=lightgrey shape=box style=filled]
	75 -> "156 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [label=""]
	"157 | COCCCc1cc(CBr)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	75 -> "157 | COCCCc1cc(CBr)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"158 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [color=lightgrey shape=box style=filled]
	76 -> "158 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [label=""]
	"159 | COCCCc1cc(C=O)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	76 -> "159 | COCCCc1cc(C=O)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"160 | COCCCc1cc(CN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	77 -> "160 | COCCCc1cc(CN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"161 | OB(O)c1ccc(O)cc1" [color=lightyellow shape=box style=filled]
	77 -> "161 | OB(O)c1ccc(O)cc1" [label=""]
	"162 | COCCCc1cc(CN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	78 -> "162 | COCCCc1cc(CN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"163 | Oc1ccc(Cl)cc1" [color=lightyellow shape=box style=filled]
	78 -> "163 | Oc1ccc(Cl)cc1" [label=""]
	"164 | COCCCc1cc(CN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	79 -> "164 | COCCCc1cc(CN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"165 | CC1(C)OB(c2ccc(O)cc2)OC1(C)C" [color=lightyellow shape=box style=filled]
	79 -> "165 | CC1(C)OB(c2ccc(O)cc2)OC1(C)C" [label=""]
	"166 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [color=lightgrey shape=box style=filled]
	80 -> "166 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [label=""]
	"167 | COCCCc1cccc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	80 -> "167 | COCCCc1cccc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"168 | CI" [color=lightyellow shape=box style=filled]
	80 -> "168 | CI" [label=""]
	"169 | ClCCBr" [color=lightyellow shape=box style=filled]
	81 -> "169 | ClCCBr" [label=""]
	"170 | Cc1cc(Cl)c(O)c(Cl)c1" [color=lightyellow shape=box style=filled]
	81 -> "170 | Cc1cc(Cl)c(O)c(Cl)c1" [label=""]
	"171 | Cc1cc(Cl)c(Cl)c(Cl)c1" [color=lightyellow shape=box style=filled]
	82 -> "171 | Cc1cc(Cl)c(Cl)c(Cl)c1" [label=""]
	"172 | OCCCl" [color=lightgrey shape=box style=filled]
	82 -> "172 | OCCCl" [label=""]
	"173 | Cc1ccc(OCCCl)c(Cl)c1" [color=lightyellow shape=box style=filled]
	83 -> "173 | Cc1ccc(OCCCl)c(Cl)c1" [label=""]
	"174 | O=C1CCC(=O)N1Cl" [color=lightyellow shape=box style=filled]
	83 -> "174 | O=C1CCC(=O)N1Cl" [label=""]
	"175 | Cc1cc(Cl)c(Br)c(Cl)c1" [color=lightyellow shape=box style=filled]
	84 -> "175 | Cc1cc(Cl)c(Br)c(Cl)c1" [label=""]
	"176 | OCCCl" [color=lightgrey shape=box style=filled]
	84 -> "176 | OCCCl" [label=""]
	"177 | Cc1cc(Cl)cc(Cl)c1" [color=lightyellow shape=box style=filled]
	85 -> "177 | Cc1cc(Cl)cc(Cl)c1" [label=""]
	"178 | OC(Cl)CCl" [color=lightgrey shape=box style=filled]
	85 -> "178 | OC(Cl)CCl" [label=""]
	"179 | CCOc1c(Cl)cc(C)cc1Cl" [color=lightyellow shape=box style=filled]
	86 -> "179 | CCOc1c(Cl)cc(C)cc1Cl" [label=""]
	"180 | ClC(Cl)(Cl)Cl" [color=lightyellow shape=box style=filled]
	86 -> "180 | ClC(Cl)(Cl)Cl" [label=""]
	"181 | CI" [color=lightyellow shape=box style=filled]
	87 -> "181 | CI" [label=""]
	"182 | ClCCOc1c(Cl)cccc1Cl" [color=lightyellow shape=box style=filled]
	87 -> "182 | ClCCOc1c(Cl)cccc1Cl" [label=""]
	"183 | CCOc1c(Cl)cc(C)cc1Cl" [color=lightyellow shape=box style=filled]
	88 -> "183 | CCOc1c(Cl)cc(C)cc1Cl" [label=""]
	"184 | O=C1CCC(=O)N1Cl" [color=lightyellow shape=box style=filled]
	88 -> "184 | O=C1CCC(=O)N1Cl" [label=""]
	"185 | Cc1cc(Cl)cc(Cl)c1" [color=lightyellow shape=box style=filled]
	89 -> "185 | Cc1cc(Cl)cc(Cl)c1" [label=""]
	"186 | OC(Br)CCl" [color=lightgrey shape=box style=filled]
	89 -> "186 | OC(Br)CCl" [label=""]
	"187 | Cc1cc(Cl)c(Cl)c(Cl)c1" [color=lightyellow shape=box style=filled]
	90 -> "187 | Cc1cc(Cl)c(Cl)c(Cl)c1" [label=""]
	"188 | O=C(O)CCl" [color=lightgrey shape=box style=filled]
	90 -> "188 | O=C(O)CCl" [label=""]
	"189 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)O)C1" [color=lightgrey shape=box style=filled]
	91 -> "189 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)O)C1" [label=""]
	"190 | COCCCc1cc(CNC2CC2)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	91 -> "190 | COCCCc1cc(CNC2CC2)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"191 | COCCCc1cc(O)cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)c1" [color=lightgrey shape=box style=filled]
	92 -> "191 | COCCCc1cc(O)cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)c1" [label=""]
	"192 | CC(C)(CCCl)C(=O)O" [color=lightyellow shape=box style=filled]
	92 -> "192 | CC(C)(CCCl)C(=O)O" [label=""]
	"193 | Oc1ccc(Br)cc1" [color=lightyellow shape=box style=filled]
	93 -> "193 | Oc1ccc(Br)cc1" [label=""]
	"194 | COCCCc1cc(CN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	93 -> "194 | COCCCc1cc(CN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"195 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [color=lightgrey shape=box style=filled]
	94 -> "195 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [label=""]
	"196 | COCCCc1cc(CCl)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	94 -> "196 | COCCCc1cc(CCl)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"197 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [color=lightgrey shape=box style=filled]
	95 -> "197 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [label=""]
	"198 | COCCCc1cc(CBr)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	95 -> "198 | COCCCc1cc(CBr)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"199 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [color=lightgrey shape=box style=filled]
	96 -> "199 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [label=""]
	"200 | COCCCc1cc(C=O)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	96 -> "200 | COCCCc1cc(C=O)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"201 | COCCCc1cc(CN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	97 -> "201 | COCCCc1cc(CN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"202 | OB(O)c1ccc(O)cc1" [color=lightyellow shape=box style=filled]
	97 -> "202 | OB(O)c1ccc(O)cc1" [label=""]
	"203 | COCCCc1cc(CN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	98 -> "203 | COCCCc1cc(CN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"204 | Oc1ccc(Cl)cc1" [color=lightyellow shape=box style=filled]
	98 -> "204 | Oc1ccc(Cl)cc1" [label=""]
	"205 | COCCCc1cc(CN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	99 -> "205 | COCCCc1cc(CN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"206 | CC1(C)OB(c2ccc(O)cc2)OC1(C)C" [color=lightyellow shape=box style=filled]
	99 -> "206 | CC1(C)OB(c2ccc(O)cc2)OC1(C)C" [label=""]
	"207 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [color=lightgrey shape=box style=filled]
	100 -> "207 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [label=""]
	"208 | COCCCc1cccc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	100 -> "208 | COCCCc1cccc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"209 | CI" [color=lightyellow shape=box style=filled]
	100 -> "209 | CI" [label=""]
	"210 | O=CCBr" [color=lightyellow shape=box style=filled]
	101 -> "210 | O=CCBr" [label=""]
	"211 | Cc1cc(Cl)c(O)c(Cl)c1" [color=lightyellow shape=box style=filled]
	101 -> "211 | Cc1cc(Cl)c(O)c(Cl)c1" [label=""]
	"212 | Cc1ccc(OCC=O)c(Cl)c1" [color=lightyellow shape=box style=filled]
	102 -> "212 | Cc1ccc(OCC=O)c(Cl)c1" [label=""]
	"213 | O=C1CCC(=O)N1Cl" [color=lightyellow shape=box style=filled]
	102 -> "213 | O=C1CCC(=O)N1Cl" [label=""]
	"214 | CN(C)C=O" [color=lightyellow shape=box style=filled]
	103 -> "214 | CN(C)C=O" [label=""]
	"215 | COc1c(Cl)cc(C)cc1Cl" [color=lightyellow shape=box style=filled]
	103 -> "215 | COc1c(Cl)cc(C)cc1Cl" [label=""]
	"216 | O=CCO" [color=lightgrey shape=box style=filled]
	104 -> "216 | O=CCO" [label=""]
	"217 | Cc1cc(Cl)c(Br)c(Cl)c1" [color=lightyellow shape=box style=filled]
	104 -> "217 | Cc1cc(Cl)c(Br)c(Cl)c1" [label=""]
	"218 | Cc1cc(Cl)cc(Cl)c1" [color=lightyellow shape=box style=filled]
	105 -> "218 | Cc1cc(Cl)cc(Cl)c1" [label=""]
	"219 | O=C(O)CO" [color=lightyellow shape=box style=filled]
	105 -> "219 | O=C(O)CO" [label=""]
	"220 | Cc1cc(Cl)c(O)c(Cl)c1" [color=lightyellow shape=box style=filled]
	106 -> "220 | Cc1cc(Cl)c(O)c(Cl)c1" [label=""]
	"221 | O=CCCl" [color=lightyellow shape=box style=filled]
	106 -> "221 | O=CCCl" [label=""]
	"222 | O=C(Cl)CO" [color=lightgrey shape=box style=filled]
	107 -> "222 | O=C(Cl)CO" [label=""]
	"223 | Cc1cc(Cl)cc(Cl)c1" [color=lightyellow shape=box style=filled]
	107 -> "223 | Cc1cc(Cl)cc(Cl)c1" [label=""]
	"224 | Cc1cc(Cl)c(Cl)c(Cl)c1" [color=lightyellow shape=box style=filled]
	108 -> "224 | Cc1cc(Cl)c(Cl)c(Cl)c1" [label=""]
	"225 | O=CCO" [color=lightgrey shape=box style=filled]
	108 -> "225 | O=CCO" [label=""]
	"226 | Cc1cc(Cl)cc(Cl)c1" [color=lightyellow shape=box style=filled]
	109 -> "226 | Cc1cc(Cl)cc(Cl)c1" [label=""]
	"227 | O=CC(O)Br" [color=lightgrey shape=box style=filled]
	109 -> "227 | O=CC(O)Br" [label=""]
	"228 | COCCC(Br)c1cc(CNC2CC2)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	110 -> "228 | COCCC(Br)c1cc(CNC2CC2)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"229 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)O)C1" [color=lightgrey shape=box style=filled]
	110 -> "229 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)O)C1" [label=""]
	"230 | COCCC(Br)c1cc(O)cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)c1" [color=lightgrey shape=box style=filled]
	111 -> "230 | COCCC(Br)c1cc(O)cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)c1" [label=""]
	"231 | CC(C)(CCCl)C(=O)O" [color=lightyellow shape=box style=filled]
	111 -> "231 | CC(C)(CCCl)C(=O)O" [label=""]
	"232 | Oc1ccc(Br)cc1" [color=lightyellow shape=box style=filled]
	112 -> "232 | Oc1ccc(Br)cc1" [label=""]
	"233 | COCCC(Br)c1cc(CN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	112 -> "233 | COCCC(Br)c1cc(CN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"234 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [color=lightgrey shape=box style=filled]
	113 -> "234 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [label=""]
	"235 | COCCC(Br)c1cc(CCl)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	113 -> "235 | COCCC(Br)c1cc(CCl)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"236 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [color=lightgrey shape=box style=filled]
	114 -> "236 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [label=""]
	"237 | COCCC(Br)c1cc(CBr)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	114 -> "237 | COCCC(Br)c1cc(CBr)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"238 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [color=lightgrey shape=box style=filled]
	115 -> "238 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [label=""]
	"239 | COCCC(Br)c1cc(C=O)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	115 -> "239 | COCCC(Br)c1cc(C=O)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"240 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [color=lightgrey shape=box style=filled]
	116 -> "240 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [label=""]
	"241 | COCCC(Br)c1cc(CO)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	116 -> "241 | COCCC(Br)c1cc(CO)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"242 | COCCC(Br)c1cc(CN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	117 -> "242 | COCCC(Br)c1cc(CN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"243 | OB(O)c1ccc(O)cc1" [color=lightyellow shape=box style=filled]
	117 -> "243 | OB(O)c1ccc(O)cc1" [label=""]
	"244 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)[N]C2CC2)C1" [color=lightgrey shape=box style=filled]
	118 -> "244 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)[N]C2CC2)C1" [label=""]
	"245 | [CH2]C(C)(C)C(=O)O" [color=lightgrey shape=box style=filled]
	118 -> "245 | [CH2]C(C)(C)C(=O)O" [label=""]
	"246 | [CH2]Oc1cc([CH2])cc(C(Br)CCOC)c1" [color=lightgrey shape=box style=filled]
	118 -> "246 | [CH2]Oc1cc([CH2])cc(C(Br)CCOC)c1" [label=""]
	"247 | COCCC(Br)c1cc(CN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	119 -> "247 | COCCC(Br)c1cc(CN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"248 | CC1(C)OB(c2ccc(O)cc2)OC1(C)C" [color=lightyellow shape=box style=filled]
	119 -> "248 | CC1(C)OB(c2ccc(O)cc2)OC1(C)C" [label=""]
	"249 | OCCBr" [color=lightyellow shape=box style=filled]
	120 -> "249 | OCCBr" [label=""]
	"250 | Cc1cc(Cl)c(O)c(Cl)c1" [color=lightyellow shape=box style=filled]
	120 -> "250 | Cc1cc(Cl)c(O)c(Cl)c1" [label=""]
	"251 | OCCO" [color=lightyellow shape=box style=filled]
	121 -> "251 | OCCO" [label=""]
	"252 | Cc1cc(Cl)c(Br)c(Cl)c1" [color=lightyellow shape=box style=filled]
	121 -> "252 | Cc1cc(Cl)c(Br)c(Cl)c1" [label=""]
	"253 | O=C1CCC(=O)N1Cl" [color=lightyellow shape=box style=filled]
	122 -> "253 | O=C1CCC(=O)N1Cl" [label=""]
	"254 | Cc1ccc(OCCO)c(Cl)c1" [color=lightyellow shape=box style=filled]
	122 -> "254 | Cc1ccc(OCCO)c(Cl)c1" [label=""]
	"255 | Cc1cc(Cl)c(Cl)c(Cl)c1" [color=lightyellow shape=box style=filled]
	123 -> "255 | Cc1cc(Cl)c(Cl)c(Cl)c1" [label=""]
	"256 | OCCO" [color=lightyellow shape=box style=filled]
	123 -> "256 | OCCO" [label=""]
	"257 | Cc1cc(Cl)c(OCCOCl)c(Cl)c1" [color=lightgrey shape=box style=filled]
	124 -> "257 | Cc1cc(Cl)c(OCCOCl)c(Cl)c1" [label=""]
	"258 | Cc1cc(Cl)c(O)c(Cl)c1" [color=lightyellow shape=box style=filled]
	125 -> "258 | Cc1cc(Cl)c(O)c(Cl)c1" [label=""]
	"259 | OCCO" [color=lightyellow shape=box style=filled]
	125 -> "259 | OCCO" [label=""]
	"260 | Cc1cc(Cl)c(OCCOBr)c(Cl)c1" [color=lightgrey shape=box style=filled]
	126 -> "260 | Cc1cc(Cl)c(OCCOBr)c(Cl)c1" [label=""]
	"261 | Cc1cc(Cl)c(OCC[O])c(Cl)c1" [color=lightgrey shape=box style=filled]
	127 -> "261 | Cc1cc(Cl)c(OCC[O])c(Cl)c1" [label=""]
	"262 | CC(=O)OCCOc1c(Cl)cc(C)cc1Cl" [color=lightgrey shape=box style=filled]
	128 -> "262 | CC(=O)OCCOc1c(Cl)cc(C)cc1Cl" [label=""]
	"263 | Cc1cc(Cl)c(OCCOCc2ccccc2)c(Cl)c1" [color=lightgrey shape=box style=filled]
	129 -> "263 | Cc1cc(Cl)c(OCCOCc2ccccc2)c(Cl)c1" [label=""]
	"264 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)O)C1" [color=lightgrey shape=box style=filled]
	130 -> "264 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)O)C1" [label=""]
	"265 | COCCCc1cc(CNC2CC2)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	130 -> "265 | COCCCc1cc(CNC2CC2)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"266 | COCCCc1cc(O)cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)c1" [color=lightgrey shape=box style=filled]
	131 -> "266 | COCCCc1cc(O)cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(O)cc2)C2CC2)c1" [label=""]
	"267 | CC(C)(CCCl)C(=O)O" [color=lightyellow shape=box style=filled]
	131 -> "267 | CC(C)(CCCl)C(=O)O" [label=""]
	"268 | Oc1ccc(Br)cc1" [color=lightyellow shape=box style=filled]
	132 -> "268 | Oc1ccc(Br)cc1" [label=""]
	"269 | COCCCc1cc(CN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	132 -> "269 | COCCCc1cc(CN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"270 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [color=lightgrey shape=box style=filled]
	133 -> "270 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [label=""]
	"271 | COCCCc1cc(CCl)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	133 -> "271 | COCCCc1cc(CCl)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"272 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [color=lightgrey shape=box style=filled]
	134 -> "272 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [label=""]
	"273 | COCCCc1cc(CBr)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	134 -> "273 | COCCCc1cc(CBr)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"274 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [color=lightgrey shape=box style=filled]
	135 -> "274 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [label=""]
	"275 | COCCCc1cc(C=O)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	135 -> "275 | COCCCc1cc(C=O)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"276 | COCCCc1cc(CN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	136 -> "276 | COCCCc1cc(CN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"277 | OB(O)c1ccc(O)cc1" [color=lightyellow shape=box style=filled]
	136 -> "277 | OB(O)c1ccc(O)cc1" [label=""]
	"278 | COCCCc1cc(CN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	137 -> "278 | COCCCc1cc(CN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"279 | Oc1ccc(Cl)cc1" [color=lightyellow shape=box style=filled]
	137 -> "279 | Oc1ccc(Cl)cc1" [label=""]
	"280 | COCCCc1cc(CN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	138 -> "280 | COCCCc1cc(CN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"281 | CC1(C)OB(c2ccc(O)cc2)OC1(C)C" [color=lightyellow shape=box style=filled]
	138 -> "281 | CC1(C)OB(c2ccc(O)cc2)OC1(C)C" [label=""]
	"282 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [color=lightgrey shape=box style=filled]
	139 -> "282 | CC(C)(C)OC(=O)N1CC[C@H](c2ccc(O)cc2)[C@@H](C(=O)NC2CC2)C1" [label=""]
	"283 | COCCCc1cccc(OCCC(C)(C)C(=O)O)c1" [color=lightgrey shape=box style=filled]
	139 -> "283 | COCCCc1cccc(OCCC(C)(C)C(=O)O)c1" [label=""]
	"284 | CI" [color=lightyellow shape=box style=filled]
	139 -> "284 | CI" [label=""]
	140 [color=aquamarine shape=rarrow style=filled]
	"22 | COCCCc1cc(O)cc(CNC2CC2)c1" -> 140 [label=0.000]
	141 [color=lightblue shape=rarrow style=filled]
	"22 | COCCCc1cc(O)cc(CNC2CC2)c1" -> 141 [label=0.000]
	142 [color=aquamarine shape=rarrow style=filled]
	"22 | COCCCc1cc(O)cc(CNC2CC2)c1" -> 142 [label=0.000]
	143 [color=aquamarine shape=rarrow style=filled]
	"22 | COCCCc1cc(O)cc(CNC2CC2)c1" -> 143 [label=0.000]
	144 [color=aquamarine shape=rarrow style=filled]
	"22 | COCCCc1cc(O)cc(CNC2CC2)c1" -> 144 [label=0.000]
	145 [color=aquamarine shape=rarrow style=filled]
	"22 | COCCCc1cc(O)cc(CNC2CC2)c1" -> 145 [label=0.000]
	146 [color=aquamarine shape=rarrow style=filled]
	"22 | COCCCc1cc(O)cc(CNC2CC2)c1" -> 146 [label=0.000]
	147 [color=aquamarine shape=rarrow style=filled]
	"22 | COCCCc1cc(O)cc(CNC2CC2)c1" -> 147 [label=0.000]
	148 [color=aquamarine shape=rarrow style=filled]
	"22 | COCCCc1cc(O)cc(CNC2CC2)c1" -> 148 [label=0.000]
	149 [color=aquamarine shape=rarrow style=filled]
	"22 | COCCCc1cc(O)cc(CNC2CC2)c1" -> 149 [label=0.000]
	150 [color=aquamarine shape=rarrow style=filled]
	"25 | COCCCc1cc(C=O)cc(OCCC(C)(C)C(=O)O)c1" -> 150 [label=0.000]
	151 [color=aquamarine shape=rarrow style=filled]
	"25 | COCCCc1cc(C=O)cc(OCCC(C)(C)C(=O)O)c1" -> 151 [label=0.000]
	152 [color=aquamarine shape=rarrow style=filled]
	"25 | COCCCc1cc(C=O)cc(OCCC(C)(C)C(=O)O)c1" -> 152 [label=0.000]
	153 [color=aquamarine shape=rarrow style=filled]
	"27 | COCCCc1cc(Br)cc(OCCC(C)(C)C(=O)O)c1" -> 153 [label=0.000]
	154 [color=aquamarine shape=rarrow style=filled]
	"29 | COCCCc1cc(CCl)cc(OCCC(C)(C)C(=O)O)c1" -> 154 [label=0.000]
	155 [color=aquamarine shape=rarrow style=filled]
	"29 | COCCCc1cc(CCl)cc(OCCC(C)(C)C(=O)O)c1" -> 155 [label=0.000]
	156 [color=lightblue shape=rarrow style=filled]
	"29 | COCCCc1cc(CCl)cc(OCCC(C)(C)C(=O)O)c1" -> 156 [label=0.000]
	157 [color=aquamarine shape=rarrow style=filled]
	"29 | COCCCc1cc(CCl)cc(OCCC(C)(C)C(=O)O)c1" -> 157 [label=0.000]
	158 [color=lightblue shape=rarrow style=filled]
	"29 | COCCCc1cc(CCl)cc(OCCC(C)(C)C(=O)O)c1" -> 158 [label=0.000]
	159 [color=aquamarine shape=rarrow style=filled]
	"31 | COCCCc1cc(Cl)cc(OCCC(C)(C)C(=O)O)c1" -> 159 [label=0.000]
	160 [color=lightblue shape=rarrow style=filled]
	"31 | COCCCc1cc(Cl)cc(OCCC(C)(C)C(=O)O)c1" -> 160 [label=0.000]
	161 [color=aquamarine shape=rarrow style=filled]
	"31 | COCCCc1cc(Cl)cc(OCCC(C)(C)C(=O)O)c1" -> 161 [label=0.000]
	162 [color=aquamarine shape=rarrow style=filled]
	"33 | COCCCc1cccc(OCCC(C)(C)C(=O)O)c1" -> 162 [label=0.000]
	163 [color=lightblue shape=rarrow style=filled]
	"33 | COCCCc1cccc(OCCC(C)(C)C(=O)O)c1" -> 163 [label=0.000]
	164 [color=lightblue shape=rarrow style=filled]
	"33 | COCCCc1cccc(OCCC(C)(C)C(=O)O)c1" -> 164 [label=0.000]
	165 [color=aquamarine shape=rarrow style=filled]
	"33 | COCCCc1cccc(OCCC(C)(C)C(=O)O)c1" -> 165 [label=0.000]
	166 [color=aquamarine shape=rarrow style=filled]
	"34 | COCCCc1cccc(OCCC(C)(C)C(=O)O)c1" -> 166 [label=0.000]
	167 [color=lightblue shape=rarrow style=filled]
	"34 | COCCCc1cccc(OCCC(C)(C)C(=O)O)c1" -> 167 [label=0.000]
	168 [color=lightblue shape=rarrow style=filled]
	"34 | COCCCc1cccc(OCCC(C)(C)C(=O)O)c1" -> 168 [label=0.000]
	169 [color=aquamarine shape=rarrow style=filled]
	"34 | COCCCc1cccc(OCCC(C)(C)C(=O)O)c1" -> 169 [label=0.000]
	170 [color=aquamarine shape=rarrow style=filled]
	"37 | COCCCc1cc(OCCC(C)(C)C(=O)O)cc(B2OC(C)(C)C(C)(C)O2)c1" -> 170 [label=0.000]
	171 [color=lightblue shape=rarrow style=filled]
	"37 | COCCCc1cc(OCCC(C)(C)C(=O)O)cc(B2OC(C)(C)C(C)(C)O2)c1" -> 171 [label=0.000]
	172 [color=aquamarine shape=rarrow style=filled]
	"37 | COCCCc1cc(OCCC(C)(C)C(=O)O)cc(B2OC(C)(C)C(C)(C)O2)c1" -> 172 [label=0.000]
	173 [color=lightblue shape=rarrow style=filled]
	"37 | COCCCc1cc(OCCC(C)(C)C(=O)O)cc(B2OC(C)(C)C(C)(C)O2)c1" -> 173 [label=0.000]
	174 [color=aquamarine shape=rarrow style=filled]
	"37 | COCCCc1cc(OCCC(C)(C)C(=O)O)cc(B2OC(C)(C)C(C)(C)O2)c1" -> 174 [label=0.000]
	175 [color=aquamarine shape=rarrow style=filled]
	"39 | CC(C)(CCOc1cc(Br)cc(CCCOC=O)c1)C(=O)O" -> 175 [label=0.000]
	176 [color=aquamarine shape=rarrow style=filled]
	"39 | CC(C)(CCOc1cc(Br)cc(CCCOC=O)c1)C(=O)O" -> 176 [label=0.000]
	177 [color=aquamarine shape=rarrow style=filled]
	"39 | CC(C)(CCOc1cc(Br)cc(CCCOC=O)c1)C(=O)O" -> 177 [label=0.000]
	178 [color=aquamarine shape=rarrow style=filled]
	"39 | CC(C)(CCOc1cc(Br)cc(CCCOC=O)c1)C(=O)O" -> 178 [label=0.000]
	179 [color=aquamarine shape=rarrow style=filled]
	"39 | CC(C)(CCOc1cc(Br)cc(CCCOC=O)c1)C(=O)O" -> 179 [label=0.000]
	180 [color=aquamarine shape=rarrow style=filled]
	"39 | CC(C)(CCOc1cc(Br)cc(CCCOC=O)c1)C(=O)O" -> 180 [label=0.000]
	181 [color=aquamarine shape=rarrow style=filled]
	"39 | CC(C)(CCOc1cc(Br)cc(CCCOC=O)c1)C(=O)O" -> 181 [label=0.000]
	182 [color=aquamarine shape=rarrow style=filled]
	"39 | CC(C)(CCOc1cc(Br)cc(CCCOC=O)c1)C(=O)O" -> 182 [label=0.000]
	183 [color=aquamarine shape=rarrow style=filled]
	"39 | CC(C)(CCOc1cc(Br)cc(CCCOC=O)c1)C(=O)O" -> 183 [label=0.000]
	184 [color=aquamarine shape=rarrow style=filled]
	"39 | CC(C)(CCOc1cc(Br)cc(CCCOC=O)c1)C(=O)O" -> 184 [label=0.000]
	185 [color=aquamarine shape=rarrow style=filled]
	"41 | COCCCc1cc(Br)cc(OCCC(C)(C)C(=O)O)c1" -> 185 [label=0.000]
	186 [color=aquamarine shape=rarrow style=filled]
	"42 | Cc1cc(Cl)c(OCCOc2ccc(C3CCN(C(=O)OC(C)(C)C)CC3)cc2)c(Cl)c1" -> 186 [label=0.000]
	187 [color=aquamarine shape=rarrow style=filled]
	"42 | Cc1cc(Cl)c(OCCOc2ccc(C3CCN(C(=O)OC(C)(C)C)CC3)cc2)c(Cl)c1" -> 187 [label=0.000]
	188 [color=aquamarine shape=rarrow style=filled]
	"42 | Cc1cc(Cl)c(OCCOc2ccc(C3CCN(C(=O)OC(C)(C)C)CC3)cc2)c(Cl)c1" -> 188 [label=0.000]
	189 [color=aquamarine shape=rarrow style=filled]
	"42 | Cc1cc(Cl)c(OCCOc2ccc(C3CCN(C(=O)OC(C)(C)C)CC3)cc2)c(Cl)c1" -> 189 [label=0.000]
	190 [color=lightblue shape=rarrow style=filled]
	"42 | Cc1cc(Cl)c(OCCOc2ccc(C3CCN(C(=O)OC(C)(C)C)CC3)cc2)c(Cl)c1" -> 190 [label=0.000]
	191 [color=aquamarine shape=rarrow style=filled]
	"42 | Cc1cc(Cl)c(OCCOc2ccc(C3CCN(C(=O)OC(C)(C)C)CC3)cc2)c(Cl)c1" -> 191 [label=0.000]
	192 [color=aquamarine shape=rarrow style=filled]
	"42 | Cc1cc(Cl)c(OCCOc2ccc(C3CCN(C(=O)OC(C)(C)C)CC3)cc2)c(Cl)c1" -> 192 [label=0.000]
	193 [color=aquamarine shape=rarrow style=filled]
	"42 | Cc1cc(Cl)c(OCCOc2ccc(C3CCN(C(=O)OC(C)(C)C)CC3)cc2)c(Cl)c1" -> 193 [label=0.000]
	194 [color=aquamarine shape=rarrow style=filled]
	"42 | Cc1cc(Cl)c(OCCOc2ccc(C3CCN(C(=O)OC(C)(C)C)CC3)cc2)c(Cl)c1" -> 194 [label=0.000]
	195 [color=aquamarine shape=rarrow style=filled]
	"42 | Cc1cc(Cl)c(OCCOc2ccc(C3CCN(C(=O)OC(C)(C)C)CC3)cc2)c(Cl)c1" -> 195 [label=0.000]
	"285 | NC1CC1" [color=lightyellow shape=box style=filled]
	140 -> "285 | NC1CC1" [label=""]
	"286 | COCCCc1cc(O)cc(C=O)c1" [color=lightgrey shape=box style=filled]
	140 -> "286 | COCCCc1cc(O)cc(C=O)c1" [label=""]
	"287 | Oc1cccc(CNC2CC2)c1" [color=lightyellow shape=box style=filled]
	141 -> "287 | Oc1cccc(CNC2CC2)c1" [label=""]
	"288 | COCCCBr" [color=lightyellow shape=box style=filled]
	141 -> "288 | COCCCBr" [label=""]
	"289 | COCCCc1cccc(O)c1" [color=lightgrey shape=box style=filled]
	142 -> "289 | COCCCc1cccc(O)c1" [label=""]
	"290 | O=CNC1CC1" [color=lightyellow shape=box style=filled]
	142 -> "290 | O=CNC1CC1" [label=""]
	"291 | COCCCc1cc(O)cc(Br)c1" [color=lightgrey shape=box style=filled]
	143 -> "291 | COCCCc1cc(O)cc(Br)c1" [label=""]
	"292 | CNC1CC1" [color=lightyellow shape=box style=filled]
	143 -> "292 | CNC1CC1" [label=""]
	"293 | COCCCc1cc(O)cc(CBr)c1" [color=lightgrey shape=box style=filled]
	144 -> "293 | COCCCc1cc(O)cc(CBr)c1" [label=""]
	"294 | NC1CC1" [color=lightyellow shape=box style=filled]
	144 -> "294 | NC1CC1" [label=""]
	"295 | NC1CC1" [color=lightyellow shape=box style=filled]
	145 -> "295 | NC1CC1" [label=""]
	"296 | COCCCc1cc(O)cc(CCl)c1" [color=lightgrey shape=box style=filled]
	145 -> "296 | COCCCc1cc(O)cc(CCl)c1" [label=""]
	"297 | COCCCc1cc(O)cc(CN)c1" [color=lightgrey shape=box style=filled]
	146 -> "297 | COCCCc1cc(O)cc(CN)c1" [label=""]
	"298 | BrC1CC1" [color=lightyellow shape=box style=filled]
	146 -> "298 | BrC1CC1" [label=""]
	"299 | COCCCc1cc(O)cc(CN)c1" [color=lightgrey shape=box style=filled]
	147 -> "299 | COCCCc1cc(O)cc(CN)c1" [label=""]
	"300 | [Mg+]C1CC1" [color=lightyellow shape=box style=filled]
	147 -> "300 | [Mg+]C1CC1" [label=""]
	"301 | OB(O)C1CC1" [color=lightyellow shape=box style=filled]
	148 -> "301 | OB(O)C1CC1" [label=""]
	"302 | COCCCc1cc(O)cc(CN)c1" [color=lightgrey shape=box style=filled]
	148 -> "302 | COCCCc1cc(O)cc(CN)c1" [label=""]
	"303 | COCCCc1cccc(O)c1" [color=lightgrey shape=box style=filled]
	149 -> "303 | COCCCc1cccc(O)c1" [label=""]
	"304 | NC1CC1" [color=lightyellow shape=box style=filled]
	149 -> "304 | NC1CC1" [label=""]
	"305 | CI" [color=lightyellow shape=box style=filled]
	149 -> "305 | CI" [label=""]
	"306 | CC(C)(CCCl)C(=O)O" [color=lightyellow shape=box style=filled]
	150 -> "306 | CC(C)(CCCl)C(=O)O" [label=""]
	"307 | COCCCc1cc(O)cc(C=O)c1" [color=lightgrey shape=box style=filled]
	150 -> "307 | COCCCc1cc(O)cc(C=O)c1" [label=""]
	"308 | COCCCBr" [color=lightyellow shape=box style=filled]
	151 -> "308 | COCCCBr" [label=""]
	"309 | CC(C)(CCOc1cccc(C=O)c1)C(=O)O" [color=lightgrey shape=box style=filled]
	151 -> "309 | CC(C)(CCOc1cccc(C=O)c1)C(=O)O" [label=""]
	"310 | CCC(C)(C)C(=O)O" [color=lightyellow shape=box style=filled]
	152 -> "310 | CCC(C)(C)C(=O)O" [label=""]
	"311 | COCCCc1cc(O)cc(C(=O)O)c1" [color=lightgrey shape=box style=filled]
	152 -> "311 | COCCCc1cc(O)cc(C(=O)O)c1" [label=""]
	"312 | COCCCc1cc(O)cc(Br)c1" [color=lightgrey shape=box style=filled]
	153 -> "312 | COCCCc1cc(O)cc(Br)c1" [label=""]
	"313 | CC(C)(CCCl)C(=O)O" [color=lightyellow shape=box style=filled]
	153 -> "313 | CC(C)(CCCl)C(=O)O" [label=""]
	"314 | COCCCc1cc(O)cc(CCl)c1" [color=lightgrey shape=box style=filled]
	154 -> "314 | COCCCc1cc(O)cc(CCl)c1" [label=""]
	"315 | CC(C)(CCCl)C(=O)O" [color=lightyellow shape=box style=filled]
	154 -> "315 | CC(C)(CCCl)C(=O)O" [label=""]
	"316 | CC(C)(CCOc1cccc(CCl)c1)C(=O)O" [color=lightgrey shape=box style=filled]
	155 -> "316 | CC(C)(CCOc1cccc(CCl)c1)C(=O)O" [label=""]
	"317 | COCCCBr" [color=lightyellow shape=box style=filled]
	155 -> "317 | COCCCBr" [label=""]
	"318 | COCCCBr" [color=lightyellow shape=box style=filled]
	156 -> "318 | COCCCBr" [label=""]
	"319 | Oc1cccc(CCl)c1" [color=lightyellow shape=box style=filled]
	156 -> "319 | Oc1cccc(CCl)c1" [label=""]
	"320 | CCC(C)(C)C(=O)O" [color=lightyellow shape=box style=filled]
	156 -> "320 | CCC(C)(C)C(=O)O" [label=""]
	"321 | [CH2]CCOC" [color=lightgrey shape=box style=filled]
	157 -> "321 | [CH2]CCOC" [label=""]
	"322 | [O]c1c[c]cc(CCl)c1" [color=lightgrey shape=box style=filled]
	157 -> "322 | [O]c1c[c]cc(CCl)c1" [label=""]
	"323 | [CH2]CC(C)(C)C(=O)O" [color=lightgrey shape=box style=filled]
	157 -> "323 | [CH2]CC(C)(C)C(=O)O" [label=""]
	"324 | Oc1cccc(CCl)c1" [color=lightyellow shape=box style=filled]
	158 -> "324 | Oc1cccc(CCl)c1" [label=""]
	"325 | CCC(C)(C)C(=O)O" [color=lightyellow shape=box style=filled]
	158 -> "325 | CCC(C)(C)C(=O)O" [label=""]
	"326 | COCCC=O" [color=lightyellow shape=box style=filled]
	158 -> "326 | COCCC=O" [label=""]
	"327 | COCCCc1cc(O)cc(Cl)c1" [color=lightgrey shape=box style=filled]
	159 -> "327 | COCCCc1cc(O)cc(Cl)c1" [label=""]
	"328 | CC(C)(CCCl)C(=O)O" [color=lightyellow shape=box style=filled]
	159 -> "328 | CC(C)(CCCl)C(=O)O" [label=""]
	"329 | CC(C)(CCOc1cccc(Cl)c1)C(=O)O" [color=lightyellow shape=box style=filled]
	160 -> "329 | CC(C)(CCOc1cccc(Cl)c1)C(=O)O" [label=""]
	"330 | COCCCBr" [color=lightyellow shape=box style=filled]
	160 -> "330 | COCCCBr" [label=""]
	"331 | ClBr" [color=lightgrey shape=box style=filled]
	161 -> "331 | ClBr" [label=""]
	"332 | CC(C)(C=O)C(=O)O" [color=lightyellow shape=box style=filled]
	161 -> "332 | CC(C)(C=O)C(=O)O" [label=""]
	"333 | COCC(CBr)C(=O)OC(C)(C)C" [color=lightgrey shape=box style=filled]
	161 -> "333 | COCC(CBr)C(=O)OC(C)(C)C" [label=""]
	"334 | COc1cc(O)cc(Cl)c1" [color=lightyellow shape=box style=filled]
	161 -> "334 | COc1cc(O)cc(Cl)c1" [label=""]
	"335 | COCCCc1cccc(O)c1" [color=lightgrey shape=box style=filled]
	162 -> "335 | COCCCc1cccc(O)c1" [label=""]
	"336 | CC(C)(CCCl)C(=O)O" [color=lightyellow shape=box style=filled]
	162 -> "336 | CC(C)(CCCl)C(=O)O" [label=""]
	"337 | COCCCBr" [color=lightyellow shape=box style=filled]
	163 -> "337 | COCCCBr" [label=""]
	"338 | CC(C)(CCOc1ccccc1)C(=O)O" [color=lightyellow shape=box style=filled]
	163 -> "338 | CC(C)(CCOc1ccccc1)C(=O)O" [label=""]
	"339 | COCCCBr" [color=lightyellow shape=box style=filled]
	164 -> "339 | COCCCBr" [label=""]
	"340 | CC(C)(CCOc1cccc(Br)c1)C(=O)O" [color=lightyellow shape=box style=filled]
	164 -> "340 | CC(C)(CCOc1cccc(Br)c1)C(=O)O" [label=""]
	"341 | CC(C)(C)C(=O)O" [color=lightyellow shape=box style=filled]
	165 -> "341 | CC(C)(C)C(=O)O" [label=""]
	"342 | COc1cccc(CBr)c1" [color=lightyellow shape=box style=filled]
	165 -> "342 | COc1cccc(CBr)c1" [label=""]
	"343 | ClC(Cl)(Cl)Cl" [color=lightyellow shape=box style=filled]
	165 -> "343 | ClC(Cl)(Cl)Cl" [label=""]
	"344 | O=COCC(=O)Cl" [color=lightgrey shape=box style=filled]
	165 -> "344 | O=COCC(=O)Cl" [label=""]
	"345 | COCCCc1cccc(O)c1" [color=lightgrey shape=box style=filled]
	166 -> "345 | COCCCc1cccc(O)c1" [label=""]
	"346 | CC(C)(CCCl)C(=O)O" [color=lightyellow shape=box style=filled]
	166 -> "346 | CC(C)(CCCl)C(=O)O" [label=""]
	"347 | COCCCBr" [color=lightyellow shape=box style=filled]
	167 -> "347 | COCCCBr" [label=""]
	"348 | CC(C)(CCOc1ccccc1)C(=O)O" [color=lightyellow shape=box style=filled]
	167 -> "348 | CC(C)(CCOc1ccccc1)C(=O)O" [label=""]
	"349 | COCCCBr" [color=lightyellow shape=box style=filled]
	168 -> "349 | COCCCBr" [label=""]
	"350 | CC(C)(CCOc1cccc(Br)c1)C(=O)O" [color=lightyellow shape=box style=filled]
	168 -> "350 | CC(C)(CCOc1cccc(Br)c1)C(=O)O" [label=""]
	"351 | CC(C)(C)C(=O)O" [color=lightyellow shape=box style=filled]
	169 -> "351 | CC(C)(C)C(=O)O" [label=""]
	"352 | COc1cccc(CBr)c1" [color=lightyellow shape=box style=filled]
	169 -> "352 | COc1cccc(CBr)c1" [label=""]
	"353 | ClC(Cl)(Cl)Cl" [color=lightyellow shape=box style=filled]
	169 -> "353 | ClC(Cl)(Cl)Cl" [label=""]
	"354 | O=COCC(=O)Cl" [color=lightgrey shape=box style=filled]
	169 -> "354 | O=COCC(=O)Cl" [label=""]
	"355 | CC(C)(CCCl)C(=O)O" [color=lightyellow shape=box style=filled]
	170 -> "355 | CC(C)(CCCl)C(=O)O" [label=""]
	"356 | COCCCc1cc(O)cc(B2OC(C)(C)C(C)(C)O2)c1" [color=lightgrey shape=box style=filled]
	170 -> "356 | COCCCc1cc(O)cc(B2OC(C)(C)C(C)(C)O2)c1" [label=""]
	"357 | COCCCBr" [color=lightyellow shape=box style=filled]
	171 -> "357 | COCCCBr" [label=""]
	"358 | CCC(C)(C)C(=O)O" [color=lightyellow shape=box style=filled]
	171 -> "358 | CCC(C)(C)C(=O)O" [label=""]
	"359 | CC1(C)OB(c2cccc(O)c2)OC1(C)C" [color=lightyellow shape=box style=filled]
	171 -> "359 | CC1(C)OB(c2cccc(O)c2)OC1(C)C" [label=""]
	"360 | [CH2]CCOC" [color=lightgrey shape=box style=filled]
	172 -> "360 | [CH2]CCOC" [label=""]
	"361 | CC1(C)OB(c2c[c]cc([O])c2)OC1(C)C" [color=lightgrey shape=box style=filled]
	172 -> "361 | CC1(C)OB(c2c[c]cc([O])c2)OC1(C)C" [label=""]
	"362 | [CH2]CC(C)(C)C(=O)O" [color=lightgrey shape=box style=filled]
	172 -> "362 | [CH2]CC(C)(C)C(=O)O" [label=""]
	"363 | CCC(C)(C)C(=O)O" [color=lightyellow shape=box style=filled]
	173 -> "363 | CCC(C)(C)C(=O)O" [label=""]
	"364 | CC1(C)OB(c2cccc(O)c2)OC1(C)C" [color=lightyellow shape=box style=filled]
	173 -> "364 | CC1(C)OB(c2cccc(O)c2)OC1(C)C" [label=""]
	"365 | COCCC=O" [color=lightyellow shape=box style=filled]
	173 -> "365 | COCCC=O" [label=""]
	"366 | CC1(C)OB(Br)OC1(C)C" [color=lightgrey shape=box style=filled]
	174 -> "366 | CC1(C)OB(Br)OC1(C)C" [label=""]
	"367 | CCCOC" [color=lightyellow shape=box style=filled]
	174 -> "367 | CCCOC" [label=""]
	"368 | CC(C)(C=O)C(=O)O" [color=lightyellow shape=box style=filled]
	174 -> "368 | CC(C)(C=O)C(=O)O" [label=""]
	"369 | ClCOc1cc(Cl)cc(Br)c1" [color=lightyellow shape=box style=filled]
	174 -> "369 | ClCOc1cc(Cl)cc(Br)c1" [label=""]
	"370 | O=COCCCc1cc(O)cc(Br)c1" [color=lightgrey shape=box style=filled]
	175 -> "370 | O=COCCCc1cc(O)cc(Br)c1" [label=""]
	"371 | CC(C)(CCCl)C(=O)O" [color=lightyellow shape=box style=filled]
	175 -> "371 | CC(C)(CCCl)C(=O)O" [label=""]
	"372 | O=COCCCc1cc(Br)cc(Br)c1" [color=lightgrey shape=box style=filled]
	176 -> "372 | O=COCCCc1cc(Br)cc(Br)c1" [label=""]
	"373 | CC(C)(CCO)C(=O)O" [color=lightyellow shape=box style=filled]
	176 -> "373 | CC(C)(CCO)C(=O)O" [label=""]
	"374 | CC(C)(CCOc1cc(Br)cc(CCCO)c1)C(=O)O" [color=lightgrey shape=box style=filled]
	177 -> "374 | CC(C)(CCOc1cc(Br)cc(CCCO)c1)C(=O)O" [label=""]
	"375 | O=CO" [color=lightyellow shape=box style=filled]
	177 -> "375 | O=CO" [label=""]
	"376 | CC(C)(CCOc1cc(Br)cc(CCCO)c1)C(=O)O" [color=lightgrey shape=box style=filled]
	178 -> "376 | CC(C)(CCOc1cc(Br)cc(CCCO)c1)C(=O)O" [label=""]
	"377 | CN(C)C=O" [color=lightyellow shape=box style=filled]
	178 -> "377 | CN(C)C=O" [label=""]
	"378 | O=COCCCc1cc(Cl)cc(Br)c1" [color=lightgrey shape=box style=filled]
	179 -> "378 | O=COCCCc1cc(Cl)cc(Br)c1" [label=""]
	"379 | CC(C)(CCO)C(=O)O" [color=lightyellow shape=box style=filled]
	179 -> "379 | CC(C)(CCO)C(=O)O" [label=""]
	"380 | CC(C)(CCOc1cc(Br)cc(CCCO)c1)C(=O)O" [color=lightgrey shape=box style=filled]
	180 -> "380 | CC(C)(CCOc1cc(Br)cc(CCCO)c1)C(=O)O" [label=""]
	"381 | O=COC(=O)c1cccc(Cl)c1" [color=lightgrey shape=box style=filled]
	180 -> "381 | O=COC(=O)c1cccc(Cl)c1" [label=""]
	"382 | CC(C)(CCO)C(=O)O" [color=lightyellow shape=box style=filled]
	181 -> "382 | CC(C)(CCO)C(=O)O" [label=""]
	"383 | O=COCCCc1cc(F)cc(Br)c1" [color=lightgrey shape=box style=filled]
	181 -> "383 | O=COCCCc1cc(F)cc(Br)c1" [label=""]
	"384 | O=COCCCc1cc(Br)cc(B(O)O)c1" [color=lightgrey shape=box style=filled]
	182 -> "384 | O=COCCCc1cc(Br)cc(B(O)O)c1" [label=""]
	"385 | CC(C)(CCO)C(=O)O" [color=lightyellow shape=box style=filled]
	182 -> "385 | CC(C)(CCO)C(=O)O" [label=""]
	"386 | O=COCCCc1cc(Br)cc(I)c1" [color=lightgrey shape=box style=filled]
	183 -> "386 | O=COCCCc1cc(Br)cc(I)c1" [label=""]
	"387 | CC(C)(CCO)C(=O)O" [color=lightyellow shape=box style=filled]
	183 -> "387 | CC(C)(CCO)C(=O)O" [label=""]
	"388 | CC(C)(CCOc1cc(Br)cc(CCCO)c1)C(=O)O" [color=lightgrey shape=box style=filled]
	184 -> "388 | CC(C)(CCOc1cc(Br)cc(CCCO)c1)C(=O)O" [label=""]
	"389 | C=O" [color=lightyellow shape=box style=filled]
	184 -> "389 | C=O" [label=""]
	"390 | COCCCc1cc(O)cc(Br)c1" [color=lightgrey shape=box style=filled]
	185 -> "390 | COCCCc1cc(O)cc(Br)c1" [label=""]
	"391 | CC(C)(CCCl)C(=O)O" [color=lightyellow shape=box style=filled]
	185 -> "391 | CC(C)(CCCl)C(=O)O" [label=""]
	"392 | Cc1cc(Cl)c(OCCBr)c(Cl)c1" [color=lightgrey shape=box style=filled]
	186 -> "392 | Cc1cc(Cl)c(OCCBr)c(Cl)c1" [label=""]
	"393 | CC(C)(C)OC(=O)N1CCC(c2ccc(O)cc2)CC1" [color=lightyellow shape=box style=filled]
	186 -> "393 | CC(C)(C)OC(=O)N1CCC(c2ccc(O)cc2)CC1" [label=""]
	"394 | Cc1cc(Cl)c(OCCOc2ccc(Br)cc2)c(Cl)c1" [color=lightgrey shape=box style=filled]
	187 -> "394 | Cc1cc(Cl)c(OCCOc2ccc(Br)cc2)c(Cl)c1" [label=""]
	"395 | CC(C)(C)OC(=O)N1CCCCC1" [color=lightyellow shape=box style=filled]
	187 -> "395 | CC(C)(C)OC(=O)N1CCCCC1" [label=""]
	"396 | Cc1cc(Cl)c(OCCCl)c(Cl)c1" [color=lightgrey shape=box style=filled]
	188 -> "396 | Cc1cc(Cl)c(OCCCl)c(Cl)c1" [label=""]
	"397 | CC(C)(C)OC(=O)N1CCC(c2ccc(O)cc2)CC1" [color=lightyellow shape=box style=filled]
	188 -> "397 | CC(C)(C)OC(=O)N1CCC(c2ccc(O)cc2)CC1" [label=""]
	"398 | Cc1cc(Cl)c(O)c(Cl)c1" [color=lightyellow shape=box style=filled]
	189 -> "398 | Cc1cc(Cl)c(O)c(Cl)c1" [label=""]
	"399 | CC(C)(C)OC(=O)N1CCC(c2ccc(OCCBr)cc2)CC1" [color=lightgrey shape=box style=filled]
	189 -> "399 | CC(C)(C)OC(=O)N1CCC(c2ccc(OCCBr)cc2)CC1" [label=""]
	"400 | CCOc1c(Cl)cc(C)cc1Cl" [color=lightyellow shape=box style=filled]
	190 -> "400 | CCOc1c(Cl)cc(C)cc1Cl" [label=""]
	"401 | Oc1ccc(Br)cc1" [color=lightyellow shape=box style=filled]
	190 -> "401 | Oc1ccc(Br)cc1" [label=""]
	"402 | CC(C)(C)OC(=O)N1CCCCC1" [color=lightyellow shape=box style=filled]
	190 -> "402 | CC(C)(C)OC(=O)N1CCCCC1" [label=""]
	"403 | Cc1cc(Cl)c(Br)c(Cl)c1" [color=lightyellow shape=box style=filled]
	191 -> "403 | Cc1cc(Cl)c(Br)c(Cl)c1" [label=""]
	"404 | CC(C)(C)OC(=O)N1CCC(c2ccc(OCCO)cc2)CC1" [color=lightgrey shape=box style=filled]
	191 -> "404 | CC(C)(C)OC(=O)N1CCC(c2ccc(OCCO)cc2)CC1" [label=""]
	"405 | O=C1CCC(=O)N1Cl" [color=lightyellow shape=box style=filled]
	192 -> "405 | O=C1CCC(=O)N1Cl" [label=""]
	"406 | Cc1ccc(OCCOc2ccc(C3CCN(C(=O)OC(C)(C)C)CC3)cc2)c(Cl)c1" [color=lightgrey shape=box style=filled]
	192 -> "406 | Cc1ccc(OCCOc2ccc(C3CCN(C(=O)OC(C)(C)C)CC3)cc2)c(Cl)c1" [label=""]
	"407 | Cc1cc(Cl)c(OCCOc2ccc(Br)cc2)c(Cl)c1" [color=lightgrey shape=box style=filled]
	193 -> "407 | Cc1cc(Cl)c(OCCOc2ccc(Br)cc2)c(Cl)c1" [label=""]
	"408 | CC(C)(C)OC(=O)N1CCC(Br)CC1" [color=lightyellow shape=box style=filled]
	193 -> "408 | CC(C)(C)OC(=O)N1CCC(Br)CC1" [label=""]
	"409 | CC(C)(C)OC(=O)N1CCC(Br)CC1" [color=lightyellow shape=box style=filled]
	194 -> "409 | CC(C)(C)OC(=O)N1CCC(Br)CC1" [label=""]
	"410 | Cc1cc(Cl)c(OCCOc2ccccc2)c(Cl)c1" [color=lightgrey shape=box style=filled]
	194 -> "410 | Cc1cc(Cl)c(OCCOc2ccccc2)c(Cl)c1" [label=""]
	"411 | Cc1cc(Cl)c(OCCOc2ccc(B(O)O)cc2)c(Cl)c1" [color=lightgrey shape=box style=filled]
	195 -> "411 | Cc1cc(Cl)c(OCCOc2ccc(B(O)O)cc2)c(Cl)c1" [label=""]
	"412 | CC(C)(C)OC(=O)N1CCCCC1" [color=lightyellow shape=box style=filled]
	195 -> "412 | CC(C)(C)OC(=O)N1CCCCC1" [label=""]
}
