digraph G {
	rankdir=LR
	node [shape=box]
	"1 | CC(=O)Nc1cccc(N2CCN(CCc3nn(C)c(=O)n3CC3CCCCC3)CC2)c1" [color=lightblue shape=box style=filled]
	1 [color=lightblue shape=rarrow style=filled]
	"1 | CC(=O)Nc1cccc(N2CCN(CCc3nn(C)c(=O)n3CC3CCCCC3)CC2)c1" -> 1 [label=0.000]
	2 [color=aquamarine shape=rarrow style=filled]
	"1 | CC(=O)Nc1cccc(N2CCN(CCc3nn(C)c(=O)n3CC3CCCCC3)CC2)c1" -> 2 [label=0.000]
	3 [color=aquamarine shape=rarrow style=filled]
	"1 | CC(=O)Nc1cccc(N2CCN(CCc3nn(C)c(=O)n3CC3CCCCC3)CC2)c1" -> 3 [label=0.000]
	4 [color=aquamarine shape=rarrow style=filled]
	"1 | CC(=O)Nc1cccc(N2CCN(CCc3nn(C)c(=O)n3CC3CCCCC3)CC2)c1" -> 4 [label=0.000]
	5 [color=aquamarine shape=rarrow style=filled]
	"1 | CC(=O)Nc1cccc(N2CCN(CCc3nn(C)c(=O)n3CC3CCCCC3)CC2)c1" -> 5 [label=0.000]
	6 [color=aquamarine shape=rarrow style=filled]
	"1 | CC(=O)Nc1cccc(N2CCN(CCc3nn(C)c(=O)n3CC3CCCCC3)CC2)c1" -> 6 [label=0.000]
	7 [color=aquamarine shape=rarrow style=filled]
	"1 | CC(=O)Nc1cccc(N2CCN(CCc3nn(C)c(=O)n3CC3CCCCC3)CC2)c1" -> 7 [label=0.000]
	8 [color=aquamarine shape=rarrow style=filled]
	"1 | CC(=O)Nc1cccc(N2CCN(CCc3nn(C)c(=O)n3CC3CCCCC3)CC2)c1" -> 8 [label=0.000]
	9 [color=aquamarine shape=rarrow style=filled]
	"1 | CC(=O)Nc1cccc(N2CCN(CCc3nn(C)c(=O)n3CC3CCCCC3)CC2)c1" -> 9 [label=0.000]
	10 [color=aquamarine shape=rarrow style=filled]
	"1 | CC(=O)Nc1cccc(N2CCN(CCc3nn(C)c(=O)n3CC3CCCCC3)CC2)c1" -> 10 [label=0.000]
	"2 | Cn1nc(CC=O)n(CC2CCCCC2)c1=O" [color=lightblue shape=box style=filled]
	1 -> "2 | Cn1nc(CC=O)n(CC2CCCCC2)c1=O" [label=""]
	"3 | CC(=O)Nc1cccc(N2CCNCC2)c1" [color=lightyellow shape=box style=filled]
	1 -> "3 | CC(=O)Nc1cccc(N2CCNCC2)c1" [label=""]
	"4 | Cn1nc(CCN2CCNCC2)n(CC2CCCCC2)c1=O" [color=lightgrey shape=box style=filled]
	2 -> "4 | Cn1nc(CCN2CCNCC2)n(CC2CCCCC2)c1=O" [label=""]
	"5 | CC(=O)Nc1cccc(Br)c1" [color=lightyellow shape=box style=filled]
	2 -> "5 | CC(=O)Nc1cccc(Br)c1" [label=""]
	"6 | Cn1nc(CCO)n(CC2CCCCC2)c1=O" [color=lightgrey shape=box style=filled]
	3 -> "6 | Cn1nc(CCO)n(CC2CCCCC2)c1=O" [label=""]
	"7 | CC(=O)Nc1cccc(N2CCNCC2)c1" [color=lightyellow shape=box style=filled]
	3 -> "7 | CC(=O)Nc1cccc(N2CCNCC2)c1" [label=""]
	"8 | O=CC1CCCCC1" [color=lightyellow shape=box style=filled]
	4 -> "8 | O=CC1CCCCC1" [label=""]
	"9 | CC(=O)Nc1cccc(N2CCN(CCc3nn(C)c(=O)[nH]3)CC2)c1" [color=lightgrey shape=box style=filled]
	4 -> "9 | CC(=O)Nc1cccc(N2CCN(CCc3nn(C)c(=O)[nH]3)CC2)c1" [label=""]
	"10 | CC(=O)Cl" [color=lightyellow shape=box style=filled]
	5 -> "10 | CC(=O)Cl" [label=""]
	"11 | Cn1nc(CCN2CCN(c3cccc(N)c3)CC2)n(CC2CCCCC2)c1=O" [color=lightgrey shape=box style=filled]
	5 -> "11 | Cn1nc(CCN2CCN(c3cccc(N)c3)CC2)n(CC2CCCCC2)c1=O" [label=""]
	"12 | BrCC1CCCCC1" [color=lightyellow shape=box style=filled]
	6 -> "12 | BrCC1CCCCC1" [label=""]
	"13 | CC(=O)Nc1cccc(N2CCN(CCc3nn(C)c(=O)[nH]3)CC2)c1" [color=lightgrey shape=box style=filled]
	6 -> "13 | CC(=O)Nc1cccc(N2CCN(CCc3nn(C)c(=O)[nH]3)CC2)c1" [label=""]
	"14 | Cn1nc(CCCl)n(CC2CCCCC2)c1=O" [color=lightgrey shape=box style=filled]
	7 -> "14 | Cn1nc(CCCl)n(CC2CCCCC2)c1=O" [label=""]
	"15 | CC(=O)Nc1cccc(N2CCNCC2)c1" [color=lightyellow shape=box style=filled]
	7 -> "15 | CC(=O)Nc1cccc(N2CCNCC2)c1" [label=""]
	"16 | Cn1nc(CCBr)n(CC2CCCCC2)c1=O" [color=lightgrey shape=box style=filled]
	8 -> "16 | Cn1nc(CCBr)n(CC2CCCCC2)c1=O" [label=""]
	"17 | CC(=O)Nc1cccc(N2CCNCC2)c1" [color=lightyellow shape=box style=filled]
	8 -> "17 | CC(=O)Nc1cccc(N2CCNCC2)c1" [label=""]
	"18 | CC(=O)Nc1cccc(N2CCN(CCc3nn(C)c(=O)[nH]3)CC2)c1" [color=lightgrey shape=box style=filled]
	9 -> "18 | CC(=O)Nc1cccc(N2CCN(CCc3nn(C)c(=O)[nH]3)CC2)c1" [label=""]
	"19 | OCC1CCCCC1" [color=lightyellow shape=box style=filled]
	9 -> "19 | OCC1CCCCC1" [label=""]
	"20 | BrCC1CCCCC1" [color=lightyellow shape=box style=filled]
	10 -> "20 | BrCC1CCCCC1" [label=""]
	"21 | CC(=O)Nc1cccc(N2CCNCC2)c1" [color=lightyellow shape=box style=filled]
	10 -> "21 | CC(=O)Nc1cccc(N2CCNCC2)c1" [label=""]
	"22 | CCc1nn(C)c(=O)[nH]1" [color=lightgrey shape=box style=filled]
	10 -> "22 | CCc1nn(C)c(=O)[nH]1" [label=""]
	11 [color=aquamarine shape=rarrow style=filled]
	"2 | Cn1nc(CC=O)n(CC2CCCCC2)c1=O" -> 11 [label=0.000]
	12 [color=aquamarine shape=rarrow style=filled]
	"2 | Cn1nc(CC=O)n(CC2CCCCC2)c1=O" -> 12 [label=0.000]
	13 [color=aquamarine shape=rarrow style=filled]
	"2 | Cn1nc(CC=O)n(CC2CCCCC2)c1=O" -> 13 [label=0.000]
	14 [color=aquamarine shape=rarrow style=filled]
	"2 | Cn1nc(CC=O)n(CC2CCCCC2)c1=O" -> 14 [label=0.000]
	15 [color=aquamarine shape=rarrow style=filled]
	"2 | Cn1nc(CC=O)n(CC2CCCCC2)c1=O" -> 15 [label=0.000]
	16 [color=aquamarine shape=rarrow style=filled]
	"2 | Cn1nc(CC=O)n(CC2CCCCC2)c1=O" -> 16 [label=0.000]
	17 [color=aquamarine shape=rarrow style=filled]
	"2 | Cn1nc(CC=O)n(CC2CCCCC2)c1=O" -> 17 [label=0.000]
	18 [color=aquamarine shape=rarrow style=filled]
	"2 | Cn1nc(CC=O)n(CC2CCCCC2)c1=O" -> 18 [label=0.000]
	19 [color=lightblue shape=rarrow style=filled]
	"2 | Cn1nc(CC=O)n(CC2CCCCC2)c1=O" -> 19 [label=0.000]
	20 [color=aquamarine shape=rarrow style=filled]
	"2 | Cn1nc(CC=O)n(CC2CCCCC2)c1=O" -> 20 [label=0.000]
	"23 | BrCC1CCCCC1" [color=lightyellow shape=box style=filled]
	11 -> "23 | BrCC1CCCCC1" [label=""]
	"24 | Cn1nc(CC=O)[nH]c1=O" [color=lightgrey shape=box style=filled]
	11 -> "24 | Cn1nc(CC=O)[nH]c1=O" [label=""]
	"25 | O=CC1CCCCC1" [color=lightyellow shape=box style=filled]
	12 -> "25 | O=CC1CCCCC1" [label=""]
	"26 | Cn1nc(CC=O)[nH]c1=O" [color=lightgrey shape=box style=filled]
	12 -> "26 | Cn1nc(CC=O)[nH]c1=O" [label=""]
	"27 | ICC1CCCCC1" [color=lightyellow shape=box style=filled]
	13 -> "27 | ICC1CCCCC1" [label=""]
	"28 | Cn1nc(CC=O)[nH]c1=O" [color=lightgrey shape=box style=filled]
	13 -> "28 | Cn1nc(CC=O)[nH]c1=O" [label=""]
	"29 | Cn1nc(CC=O)[nH]c1=O" [color=lightgrey shape=box style=filled]
	14 -> "29 | Cn1nc(CC=O)[nH]c1=O" [label=""]
	"30 | OCC1CCCCC1" [color=lightyellow shape=box style=filled]
	14 -> "30 | OCC1CCCCC1" [label=""]
	"31 | NC(=O)CC=O" [color=lightgrey shape=box style=filled]
	15 -> "31 | NC(=O)CC=O" [label=""]
	"32 | CNC(=O)NCC1CCCCC1" [color=lightyellow shape=box style=filled]
	15 -> "32 | CNC(=O)NCC1CCCCC1" [label=""]
	"33 | Cn1nc(CC=O)[nH]c1=O" [color=lightgrey shape=box style=filled]
	16 -> "33 | Cn1nc(CC=O)[nH]c1=O" [label=""]
	"34 | [Mg+]CC1CCCCC1" [color=lightyellow shape=box style=filled]
	16 -> "34 | [Mg+]CC1CCCCC1" [label=""]
	"35 | O=CCC=O" [color=lightgrey shape=box style=filled]
	17 -> "35 | O=CCC=O" [label=""]
	"36 | CN(N)C(=O)NCC1CCCCC1" [color=lightgrey shape=box style=filled]
	17 -> "36 | CN(N)C(=O)NCC1CCCCC1" [label=""]
	"37 | O=C(Cl)NCC1CCCCC1" [color=lightgrey shape=box style=filled]
	18 -> "37 | O=C(Cl)NCC1CCCCC1" [label=""]
	"38 | CNN=CCC=O" [color=lightgrey shape=box style=filled]
	18 -> "38 | CNN=CCC=O" [label=""]
	"39 | O=CCBr" [color=lightyellow shape=box style=filled]
	19 -> "39 | O=CCBr" [label=""]
	"40 | Cn1ncn(CC2CCCCC2)c1=O" [color=lightyellow shape=box style=filled]
	19 -> "40 | Cn1ncn(CC2CCCCC2)c1=O" [label=""]
	"41 | O=CNCC1CCCCC1" [color=lightgrey shape=box style=filled]
	20 -> "41 | O=CNCC1CCCCC1" [label=""]
	"42 | CNNC(=O)CC=O" [color=lightgrey shape=box style=filled]
	20 -> "42 | CNNC(=O)CC=O" [label=""]
}
