digraph G {
	rankdir=LR
	node [shape=box]
	"1 | C/C=C/c1c(N)nc(-c2ccc(Cl)c(OC)c2F)nc1C(=O)OC" [color=lightblue shape=box style=filled]
	1 [color=lightblue shape=rarrow style=filled]
	"1 | C/C=C/c1c(N)nc(-c2ccc(Cl)c(OC)c2F)nc1C(=O)OC" -> 1 [label=0.000]
	2 [color=aquamarine shape=rarrow style=filled]
	"1 | C/C=C/c1c(N)nc(-c2ccc(Cl)c(OC)c2F)nc1C(=O)OC" -> 2 [label=0.000]
	3 [color=aquamarine shape=rarrow style=filled]
	"1 | C/C=C/c1c(N)nc(-c2ccc(Cl)c(OC)c2F)nc1C(=O)OC" -> 3 [label=0.000]
	4 [color=aquamarine shape=rarrow style=filled]
	"1 | C/C=C/c1c(N)nc(-c2ccc(Cl)c(OC)c2F)nc1C(=O)OC" -> 4 [label=0.000]
	5 [color=aquamarine shape=rarrow style=filled]
	"1 | C/C=C/c1c(N)nc(-c2ccc(Cl)c(OC)c2F)nc1C(=O)OC" -> 5 [label=0.000]
	6 [color=aquamarine shape=rarrow style=filled]
	"1 | C/C=C/c1c(N)nc(-c2ccc(Cl)c(OC)c2F)nc1C(=O)OC" -> 6 [label=0.000]
	7 [color=aquamarine shape=rarrow style=filled]
	"1 | C/C=C/c1c(N)nc(-c2ccc(Cl)c(OC)c2F)nc1C(=O)OC" -> 7 [label=0.000]
	8 [color=aquamarine shape=rarrow style=filled]
	"1 | C/C=C/c1c(N)nc(-c2ccc(Cl)c(OC)c2F)nc1C(=O)OC" -> 8 [label=0.000]
	9 [color=aquamarine shape=rarrow style=filled]
	"1 | C/C=C/c1c(N)nc(-c2ccc(Cl)c(OC)c2F)nc1C(=O)OC" -> 9 [label=0.000]
	10 [color=aquamarine shape=rarrow style=filled]
	"1 | C/C=C/c1c(N)nc(-c2ccc(Cl)c(OC)c2F)nc1C(=O)OC" -> 10 [label=0.000]
	"2 | C/C=C/c1c(N)nc(Cl)nc1C(=O)OC" [color=lightblue shape=box style=filled]
	1 -> "2 | C/C=C/c1c(N)nc(Cl)nc1C(=O)OC" [label=""]
	"3 | COc1c(Cl)ccc(Br)c1F" [color=lightyellow shape=box style=filled]
	1 -> "3 | COc1c(Cl)ccc(Br)c1F" [label=""]
	"4 | C/C=C/c1c(N)nc(Cl)nc1C(=O)OC" [color=lightgrey shape=box style=filled]
	2 -> "4 | C/C=C/c1c(N)nc(Cl)nc1C(=O)OC" [label=""]
	"5 | COc1c(F)cccc1Cl" [color=lightyellow shape=box style=filled]
	2 -> "5 | COc1c(F)cccc1Cl" [label=""]
	"6 | C/C=C/c1c(N)nc(Cl)nc1C(=O)OC" [color=lightgrey shape=box style=filled]
	3 -> "6 | C/C=C/c1c(N)nc(Cl)nc1C(=O)OC" [label=""]
	"7 | COc1c(Cl)ccc(B(O)O)c1F" [color=lightyellow shape=box style=filled]
	3 -> "7 | COc1c(Cl)ccc(B(O)O)c1F" [label=""]
	"8 | C/C=C/c1c(N)nc(Cl)nc1C(=O)OC" [color=lightgrey shape=box style=filled]
	4 -> "8 | C/C=C/c1c(N)nc(Cl)nc1C(=O)OC" [label=""]
	"9 | COc1c(Cl)ccc(Br)c1F" [color=lightyellow shape=box style=filled]
	4 -> "9 | COc1c(Cl)ccc(Br)c1F" [label=""]
	"10 | C/C=C/c1c(N)nc(Cl)nc1C(=O)OC" [color=lightgrey shape=box style=filled]
	5 -> "10 | C/C=C/c1c(N)nc(Cl)nc1C(=O)OC" [label=""]
	"11 | COc1c(Cl)ccc(B2OC(C)(C)C(C)(C)O2)c1F" [color=lightyellow shape=box style=filled]
	5 -> "11 | COc1c(Cl)ccc(B2OC(C)(C)C(C)(C)O2)c1F" [label=""]
	"12 | COc1c(Cl)ccc(Br)c1F" [color=lightyellow shape=box style=filled]
	6 -> "12 | COc1c(Cl)ccc(Br)c1F" [label=""]
	"13 | C/C=C/c1c(N)ncnc1C(=O)OC" [color=lightgrey shape=box style=filled]
	6 -> "13 | C/C=C/c1c(N)ncnc1C(=O)OC" [label=""]
	"14 | COc1c(Cl)ccc(Br)c1F" [color=lightyellow shape=box style=filled]
	7 -> "14 | COc1c(Cl)ccc(Br)c1F" [label=""]
	"15 | C/C=C/c1c(N)nc(Br)nc1C(=O)OC" [color=lightgrey shape=box style=filled]
	7 -> "15 | C/C=C/c1c(N)nc(Br)nc1C(=O)OC" [label=""]
	"16 | C/C=C/c1c(N)nc(Cl)nc1C(=O)OC" [color=lightgrey shape=box style=filled]
	8 -> "16 | C/C=C/c1c(N)nc(Cl)nc1C(=O)OC" [label=""]
	"17 | COc1c(Cl)ccc(B(O)O)c1F" [color=lightyellow shape=box style=filled]
	8 -> "17 | COc1c(Cl)ccc(B(O)O)c1F" [label=""]
	"18 | C/C=C/c1c(N)ncnc1C(=O)OC" [color=lightgrey shape=box style=filled]
	9 -> "18 | C/C=C/c1c(N)ncnc1C(=O)OC" [label=""]
	"19 | COc1c(Cl)ccc(B2OC(C)(C)C(C)(C)O2)c1F" [color=lightyellow shape=box style=filled]
	9 -> "19 | COc1c(Cl)ccc(B2OC(C)(C)C(C)(C)O2)c1F" [label=""]
	"20 | C/C=C/c1c(N)ncnc1C(=O)OC" [color=lightgrey shape=box style=filled]
	10 -> "20 | C/C=C/c1c(N)ncnc1C(=O)OC" [label=""]
	"21 | COc1c(Cl)ccc(B(O)O)c1F" [color=lightyellow shape=box style=filled]
	10 -> "21 | COc1c(Cl)ccc(B(O)O)c1F" [label=""]
	11 [color=aquamarine shape=rarrow style=filled]
	"2 | C/C=C/c1c(N)nc(Cl)nc1C(=O)OC" -> 11 [label=0.000]
	12 [color=aquamarine shape=rarrow style=filled]
	"2 | C/C=C/c1c(N)nc(Cl)nc1C(=O)OC" -> 12 [label=0.000]
	13 [color=aquamarine shape=rarrow style=filled]
	"2 | C/C=C/c1c(N)nc(Cl)nc1C(=O)OC" -> 13 [label=0.000]
	14 [color=aquamarine shape=rarrow style=filled]
	"2 | C/C=C/c1c(N)nc(Cl)nc1C(=O)OC" -> 14 [label=0.000]
	15 [color=lightblue shape=rarrow style=filled]
	"2 | C/C=C/c1c(N)nc(Cl)nc1C(=O)OC" -> 15 [label=0.000]
	16 [color=aquamarine shape=rarrow style=filled]
	"2 | C/C=C/c1c(N)nc(Cl)nc1C(=O)OC" -> 16 [label=0.000]
	17 [color=aquamarine shape=rarrow style=filled]
	"2 | C/C=C/c1c(N)nc(Cl)nc1C(=O)OC" -> 17 [label=0.000]
	18 [color=lightblue shape=rarrow style=filled]
	"2 | C/C=C/c1c(N)nc(Cl)nc1C(=O)OC" -> 18 [label=0.000]
	19 [color=lightblue shape=rarrow style=filled]
	"2 | C/C=C/c1c(N)nc(Cl)nc1C(=O)OC" -> 19 [label=0.000]
	20 [color=aquamarine shape=rarrow style=filled]
	"2 | C/C=C/c1c(N)nc(Cl)nc1C(=O)OC" -> 20 [label=0.000]
	"22 | COC(=O)c1nc(Cl)nc(N)c1C" [color=lightgrey shape=box style=filled]
	11 -> "22 | COC(=O)c1nc(Cl)nc(N)c1C" [label=""]
	"23 | CC[P+](c1ccccc1)(c1ccccc1)c1ccccc1" [color=lightyellow shape=box style=filled]
	11 -> "23 | CC[P+](c1ccccc1)(c1ccccc1)c1ccccc1" [label=""]
	"24 | C/C=C/c1cnc(Cl)nc1N" [color=lightgrey shape=box style=filled]
	12 -> "24 | C/C=C/c1cnc(Cl)nc1N" [label=""]
	"25 | COC(=O)Cl" [color=lightgrey shape=box style=filled]
	12 -> "25 | COC(=O)Cl" [label=""]
	"26 | C/C=C/c1c(N)nc(Cl)nc1Cl" [color=lightgrey shape=box style=filled]
	13 -> "26 | C/C=C/c1c(N)nc(Cl)nc1Cl" [label=""]
	"27 | COC=O" [color=lightgrey shape=box style=filled]
	13 -> "27 | COC=O" [label=""]
	"28 | COC(=O)c1nc(Cl)nc(N)c1C" [color=lightgrey shape=box style=filled]
	14 -> "28 | COC(=O)c1nc(Cl)nc(N)c1C" [label=""]
	"29 | CC=O" [color=lightgrey shape=box style=filled]
	14 -> "29 | CC=O" [label=""]
	"30 | C=CC" [color=lightyellow shape=box style=filled]
	15 -> "30 | C=CC" [label=""]
	"31 | COC(=O)c1cc(N)nc(Cl)n1" [color=lightyellow shape=box style=filled]
	15 -> "31 | COC(=O)c1cc(N)nc(Cl)n1" [label=""]
	"32 | COC(=O)c1nc(Cl)nc(N)c1C" [color=lightgrey shape=box style=filled]
	16 -> "32 | COC(=O)c1nc(Cl)nc(N)c1C" [label=""]
	"33 | CCI" [color=lightyellow shape=box style=filled]
	16 -> "33 | CCI" [label=""]
	"34 | COC(=O)c1cc(N)nc(Cl)n1" [color=lightyellow shape=box style=filled]
	17 -> "34 | COC(=O)c1cc(N)nc(Cl)n1" [label=""]
	"35 | CC=C=O" [color=lightgrey shape=box style=filled]
	17 -> "35 | CC=C=O" [label=""]
	"36 | C=CC" [color=lightyellow shape=box style=filled]
	18 -> "36 | C=CC" [label=""]
	"37 | COC(=O)c1cc(N)nc(Cl)n1" [color=lightyellow shape=box style=filled]
	18 -> "37 | COC(=O)c1cc(N)nc(Cl)n1" [label=""]
	"38 | CC=CBr" [color=lightyellow shape=box style=filled]
	19 -> "38 | CC=CBr" [label=""]
	"39 | COC(=O)c1cc(N)nc(Cl)n1" [color=lightyellow shape=box style=filled]
	19 -> "39 | COC(=O)c1cc(N)nc(Cl)n1" [label=""]
	"40 | CC=CP(=O)(OCC)OCC" [color=lightgrey shape=box style=filled]
	20 -> "40 | CC=CP(=O)(OCC)OCC" [label=""]
	"41 | COC(=O)c1cc(N)nc(Cl)n1" [color=lightyellow shape=box style=filled]
	20 -> "41 | COC(=O)c1cc(N)nc(Cl)n1" [label=""]
}
