digraph G {
	rankdir=LR
	node [shape=box]
	"1 | CC(C)(C)OC(=O)NC1(c2nc(NCc3ccccn3)c3c(Cl)ccn3n2)CC1" [color=lightblue shape=box style=filled]
	1 [color=lightblue shape=rarrow style=filled]
	"1 | CC(C)(C)OC(=O)NC1(c2nc(NCc3ccccn3)c3c(Cl)ccn3n2)CC1" -> 1 [label=0.000]
	2 [color=aquamarine shape=rarrow style=filled]
	"1 | CC(C)(C)OC(=O)NC1(c2nc(NCc3ccccn3)c3c(Cl)ccn3n2)CC1" -> 2 [label=0.000]
	3 [color=aquamarine shape=rarrow style=filled]
	"1 | CC(C)(C)OC(=O)NC1(c2nc(NCc3ccccn3)c3c(Cl)ccn3n2)CC1" -> 3 [label=0.000]
	4 [color=aquamarine shape=rarrow style=filled]
	"1 | CC(C)(C)OC(=O)NC1(c2nc(NCc3ccccn3)c3c(Cl)ccn3n2)CC1" -> 4 [label=0.000]
	5 [color=aquamarine shape=rarrow style=filled]
	"1 | CC(C)(C)OC(=O)NC1(c2nc(NCc3ccccn3)c3c(Cl)ccn3n2)CC1" -> 5 [label=0.000]
	6 [color=aquamarine shape=rarrow style=filled]
	"1 | CC(C)(C)OC(=O)NC1(c2nc(NCc3ccccn3)c3c(Cl)ccn3n2)CC1" -> 6 [label=0.000]
	7 [color=aquamarine shape=rarrow style=filled]
	"1 | CC(C)(C)OC(=O)NC1(c2nc(NCc3ccccn3)c3c(Cl)ccn3n2)CC1" -> 7 [label=0.000]
	8 [color=aquamarine shape=rarrow style=filled]
	"1 | CC(C)(C)OC(=O)NC1(c2nc(NCc3ccccn3)c3c(Cl)ccn3n2)CC1" -> 8 [label=0.000]
	9 [color=aquamarine shape=rarrow style=filled]
	"1 | CC(C)(C)OC(=O)NC1(c2nc(NCc3ccccn3)c3c(Cl)ccn3n2)CC1" -> 9 [label=0.000]
	10 [color=aquamarine shape=rarrow style=filled]
	"1 | CC(C)(C)OC(=O)NC1(c2nc(NCc3ccccn3)c3c(Cl)ccn3n2)CC1" -> 10 [label=0.000]
	"2 | NCc1ccccn1" [color=lightyellow shape=box style=filled]
	1 -> "2 | NCc1ccccn1" [label=""]
	"3 | CC(C)(C)OC(=O)NC1(c2nc(Cl)c3c(Cl)ccn3n2)CC1" [color=lightblue shape=box style=filled]
	1 -> "3 | CC(C)(C)OC(=O)NC1(c2nc(Cl)c3c(Cl)ccn3n2)CC1" [label=""]
	"4 | CC(C)(C)OC(=O)NC1(c2nc(N)c3c(Cl)ccn3n2)CC1" [color=lightgrey shape=box style=filled]
	2 -> "4 | CC(C)(C)OC(=O)NC1(c2nc(N)c3c(Cl)ccn3n2)CC1" [label=""]
	"5 | O=Cc1ccccn1" [color=lightyellow shape=box style=filled]
	2 -> "5 | O=Cc1ccccn1" [label=""]
	"6 | NCc1ccccn1" [color=lightyellow shape=box style=filled]
	3 -> "6 | NCc1ccccn1" [label=""]
	"7 | CC(C)(C)OC(=O)NC1(c2nc(Br)c3c(Cl)ccn3n2)CC1" [color=lightgrey shape=box style=filled]
	3 -> "7 | CC(C)(C)OC(=O)NC1(c2nc(Br)c3c(Cl)ccn3n2)CC1" [label=""]
	"8 | Clc1nc(NCc2ccccn2)c2c(Cl)ccn2n1" [color=lightgrey shape=box style=filled]
	4 -> "8 | Clc1nc(NCc2ccccn2)c2c(Cl)ccn2n1" [label=""]
	"9 | CC(C)(C)OC(=O)NC1CC1" [color=lightyellow shape=box style=filled]
	4 -> "9 | CC(C)(C)OC(=O)NC1CC1" [label=""]
	"10 | CC(C)(C)OC(=O)C(N)c1ccccn1" [color=lightyellow shape=box style=filled]
	5 -> "10 | CC(C)(C)OC(=O)C(N)c1ccccn1" [label=""]
	"11 | CC(C)(C)OC(=O)NC1(c2ncc3c(Cl)ccn3n2)CC1" [color=lightgrey shape=box style=filled]
	5 -> "11 | CC(C)(C)OC(=O)NC1(c2ncc3c(Cl)ccn3n2)CC1" [label=""]
	"12 | NCc1cc(Br)ccn1" [color=lightyellow shape=box style=filled]
	6 -> "12 | NCc1cc(Br)ccn1" [label=""]
	"13 | CC(C)(C)OC(=O)NC1(c2nc(Cl)c3c(Cl)ccn3n2)CC1" [color=lightgrey shape=box style=filled]
	6 -> "13 | CC(C)(C)OC(=O)NC1(c2nc(Cl)c3c(Cl)ccn3n2)CC1" [label=""]
	"14 | BrCc1ccccn1" [color=lightyellow shape=box style=filled]
	7 -> "14 | BrCc1ccccn1" [label=""]
	"15 | CC(C)(C)OC(=O)NC1(c2nc(N)c3c(Cl)ccn3n2)CC1" [color=lightgrey shape=box style=filled]
	7 -> "15 | CC(C)(C)OC(=O)NC1(c2nc(N)c3c(Cl)ccn3n2)CC1" [label=""]
	"16 | Clc1ccn2nc(Br)nc(NCc3ccccn3)c12" [color=lightgrey shape=box style=filled]
	8 -> "16 | Clc1ccn2nc(Br)nc(NCc3ccccn3)c12" [label=""]
	"17 | CC(C)(C)OC(=O)NC1CC1" [color=lightyellow shape=box style=filled]
	8 -> "17 | CC(C)(C)OC(=O)NC1CC1" [label=""]
	"18 | ClCc1ccccn1" [color=lightyellow shape=box style=filled]
	9 -> "18 | ClCc1ccccn1" [label=""]
	"19 | CC(C)(C)OC(=O)NC1(c2nc(N)c3c(Cl)ccn3n2)CC1" [color=lightgrey shape=box style=filled]
	9 -> "19 | CC(C)(C)OC(=O)NC1(c2nc(N)c3c(Cl)ccn3n2)CC1" [label=""]
	"20 | O=C(Nc1ncnn2ccc(Cl)c12)c1ccccn1" [color=lightgrey shape=box style=filled]
	10 -> "20 | O=C(Nc1ncnn2ccc(Cl)c12)c1ccccn1" [label=""]
	"21 | CC(C)(C)OC(=O)NC1CC1" [color=lightyellow shape=box style=filled]
	10 -> "21 | CC(C)(C)OC(=O)NC1CC1" [label=""]
	11 [color=aquamarine shape=rarrow style=filled]
	"3 | CC(C)(C)OC(=O)NC1(c2nc(Cl)c3c(Cl)ccn3n2)CC1" -> 11 [label=0.000]
	12 [color=lightblue shape=rarrow style=filled]
	"3 | CC(C)(C)OC(=O)NC1(c2nc(Cl)c3c(Cl)ccn3n2)CC1" -> 12 [label=0.000]
	13 [color=aquamarine shape=rarrow style=filled]
	"3 | CC(C)(C)OC(=O)NC1(c2nc(Cl)c3c(Cl)ccn3n2)CC1" -> 13 [label=0.000]
	14 [color=aquamarine shape=rarrow style=filled]
	"3 | CC(C)(C)OC(=O)NC1(c2nc(Cl)c3c(Cl)ccn3n2)CC1" -> 14 [label=0.000]
	15 [color=aquamarine shape=rarrow style=filled]
	"3 | CC(C)(C)OC(=O)NC1(c2nc(Cl)c3c(Cl)ccn3n2)CC1" -> 15 [label=0.000]
	16 [color=aquamarine shape=rarrow style=filled]
	"3 | CC(C)(C)OC(=O)NC1(c2nc(Cl)c3c(Cl)ccn3n2)CC1" -> 16 [label=0.000]
	17 [color=lightblue shape=rarrow style=filled]
	"3 | CC(C)(C)OC(=O)NC1(c2nc(Cl)c3c(Cl)ccn3n2)CC1" -> 17 [label=0.000]
	18 [color=aquamarine shape=rarrow style=filled]
	"3 | CC(C)(C)OC(=O)NC1(c2nc(Cl)c3c(Cl)ccn3n2)CC1" -> 18 [label=0.000]
	19 [color=aquamarine shape=rarrow style=filled]
	"3 | CC(C)(C)OC(=O)NC1(c2nc(Cl)c3c(Cl)ccn3n2)CC1" -> 19 [label=0.000]
	20 [color=lightblue shape=rarrow style=filled]
	"3 | CC(C)(C)OC(=O)NC1(c2nc(Cl)c3c(Cl)ccn3n2)CC1" -> 20 [label=0.000]
	"22 | Clc1ccn2nc(Br)nc(Cl)c12" [color=lightgrey shape=box style=filled]
	11 -> "22 | Clc1ccn2nc(Br)nc(Cl)c12" [label=""]
	"23 | CC(C)(C)OC(=O)NC1CC1" [color=lightyellow shape=box style=filled]
	11 -> "23 | CC(C)(C)OC(=O)NC1CC1" [label=""]
	"24 | Clc1nc(Cl)c2c(Cl)ccn2n1" [color=lightyellow shape=box style=filled]
	12 -> "24 | Clc1nc(Cl)c2c(Cl)ccn2n1" [label=""]
	"25 | CC(C)(C)OC(=O)NC1CC1" [color=lightyellow shape=box style=filled]
	12 -> "25 | CC(C)(C)OC(=O)NC1CC1" [label=""]
	"26 | O=C1CCC(=O)N1Cl" [color=lightyellow shape=box style=filled]
	13 -> "26 | O=C1CCC(=O)N1Cl" [label=""]
	"27 | CC(C)(C)OC(=O)NC1(c2nc(Cl)c3cccn3n2)CC1" [color=lightgrey shape=box style=filled]
	13 -> "27 | CC(C)(C)OC(=O)NC1(c2nc(Cl)c3cccn3n2)CC1" [label=""]
	"28 | CC(C)(C)OC(=O)[Cl+]c1ccn2nc(C3CC3)nc(Cl)c12" [color=lightgrey shape=box style=filled]
	14 -> "28 | CC(C)(C)OC(=O)[Cl+]c1ccn2nc(C3CC3)nc(Cl)c12" [label=""]
	"29 | CC(C)(C)OC(N)=O" [color=lightyellow shape=box style=filled]
	14 -> "29 | CC(C)(C)OC(N)=O" [label=""]
	"30 | Cl[Cl+]c1ccn2nc(C3CC3)nc(Cl)c12" [color=lightgrey shape=box style=filled]
	15 -> "30 | Cl[Cl+]c1ccn2nc(C3CC3)nc(Cl)c12" [label=""]
	"31 | CC(C)(C)OC(N)=O" [color=lightyellow shape=box style=filled]
	15 -> "31 | CC(C)(C)OC(N)=O" [label=""]
	"32 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	16 -> "32 | O=C1CCC(=O)N1Br" [label=""]
	"33 | Clc1ccn2nc(C3CC3)nc(Cl)c12" [color=lightgrey shape=box style=filled]
	16 -> "33 | Clc1ccn2nc(C3CC3)nc(Cl)c12" [label=""]
	"34 | CC(C)(C)OC(N)=O" [color=lightyellow shape=box style=filled]
	16 -> "34 | CC(C)(C)OC(N)=O" [label=""]
	"35 | BrC1CC1" [color=lightyellow shape=box style=filled]
	17 -> "35 | BrC1CC1" [label=""]
	"36 | Clc1ccn2ncnc(Cl)c12" [color=lightyellow shape=box style=filled]
	17 -> "36 | Clc1ccn2ncnc(Cl)c12" [label=""]
	"37 | CC(C)(C)OC(N)=O" [color=lightyellow shape=box style=filled]
	17 -> "37 | CC(C)(C)OC(N)=O" [label=""]
	"38 | Clc1nc(C2CC2)nn2ccc([Cl+]Br)c12" [color=lightgrey shape=box style=filled]
	18 -> "38 | Clc1nc(C2CC2)nn2ccc([Cl+]Br)c12" [label=""]
	"39 | CC(C)(C)OC(N)=O" [color=lightyellow shape=box style=filled]
	18 -> "39 | CC(C)(C)OC(N)=O" [label=""]
	"40 | CC(C)(C)OC([NH])=O" [color=lightgrey shape=box style=filled]
	19 -> "40 | CC(C)(C)OC([NH])=O" [label=""]
	"41 | Clc1ccn2nc([C]3CC3)nc(Cl)c12" [color=lightgrey shape=box style=filled]
	19 -> "41 | Clc1ccn2nc([C]3CC3)nc(Cl)c12" [label=""]
	"42 | Clc1nc(Cl)c2c(Cl)ccn2n1" [color=lightyellow shape=box style=filled]
	20 -> "42 | Clc1nc(Cl)c2c(Cl)ccn2n1" [label=""]
	"43 | CC(C)(C)OC(N)=O" [color=lightyellow shape=box style=filled]
	20 -> "43 | CC(C)(C)OC(N)=O" [label=""]
	"44 | C1CC1" [color=lightyellow shape=box style=filled]
	20 -> "44 | C1CC1" [label=""]
}
