digraph G {
	rankdir=LR
	node [shape=box]
	"1 | Cn1oc(=O)nc1/C(=N\OCc1cccc(N)n1)c1ccccc1" [color=lightblue shape=box style=filled]
	1 [color=lightblue shape=rarrow style=filled]
	"1 | Cn1oc(=O)nc1/C(=N\OCc1cccc(N)n1)c1ccccc1" -> 1 [label=0.000]
	2 [color=aquamarine shape=rarrow style=filled]
	"1 | Cn1oc(=O)nc1/C(=N\OCc1cccc(N)n1)c1ccccc1" -> 2 [label=0.000]
	3 [color=aquamarine shape=rarrow style=filled]
	"1 | Cn1oc(=O)nc1/C(=N\OCc1cccc(N)n1)c1ccccc1" -> 3 [label=0.000]
	4 [color=aquamarine shape=rarrow style=filled]
	"1 | Cn1oc(=O)nc1/C(=N\OCc1cccc(N)n1)c1ccccc1" -> 4 [label=0.000]
	5 [color=aquamarine shape=rarrow style=filled]
	"1 | Cn1oc(=O)nc1/C(=N\OCc1cccc(N)n1)c1ccccc1" -> 5 [label=0.000]
	6 [color=aquamarine shape=rarrow style=filled]
	"1 | Cn1oc(=O)nc1/C(=N\OCc1cccc(N)n1)c1ccccc1" -> 6 [label=0.000]
	7 [color=aquamarine shape=rarrow style=filled]
	"1 | Cn1oc(=O)nc1/C(=N\OCc1cccc(N)n1)c1ccccc1" -> 7 [label=0.000]
	8 [color=aquamarine shape=rarrow style=filled]
	"1 | Cn1oc(=O)nc1/C(=N\OCc1cccc(N)n1)c1ccccc1" -> 8 [label=0.000]
	9 [color=aquamarine shape=rarrow style=filled]
	"1 | Cn1oc(=O)nc1/C(=N\OCc1cccc(N)n1)c1ccccc1" -> 9 [label=0.000]
	"2 | NOCc1cccc(N)n1" [color=lightblue shape=box style=filled]
	1 -> "2 | NOCc1cccc(N)n1" [label=""]
	"3 | Cn1oc(=O)nc1C(=O)c1ccccc1" [color=lightblue shape=box style=filled]
	1 -> "3 | Cn1oc(=O)nc1C(=O)c1ccccc1" [label=""]
	"4 | Nc1cccc(CO)n1" [color=lightyellow shape=box style=filled]
	2 -> "4 | Nc1cccc(CO)n1" [label=""]
	"5 | Cn1oc(=O)nc1/C(=N/Cl)c1ccccc1" [color=aquamarine shape=box style=filled]
	2 -> "5 | Cn1oc(=O)nc1/C(=N/Cl)c1ccccc1" [label=""]
	"6 | Cn1oc(=O)nc1C(O)c1ccccc1" [color=aquamarine shape=box style=filled]
	3 -> "6 | Cn1oc(=O)nc1C(O)c1ccccc1" [label=""]
	"7 | NOCc1cccc(N)n1" [color=lightblue shape=box style=filled]
	3 -> "7 | NOCc1cccc(N)n1" [label=""]
	"8 | Cn1oc(=O)nc1/C(c1ccccc1)=[N+](/O)Cl" [color=aquamarine shape=box style=filled]
	4 -> "8 | Cn1oc(=O)nc1/C(c1ccccc1)=[N+](/O)Cl" [label=""]
	"9 | Cc1cccc(N)n1" [color=lightyellow shape=box style=filled]
	4 -> "9 | Cc1cccc(N)n1" [label=""]
	"10 | Cn1oc(=O)nc1/C(=N/O)c1ccccc1" [color=aquamarine shape=box style=filled]
	5 -> "10 | Cn1oc(=O)nc1/C(=N/O)c1ccccc1" [label=""]
	"11 | Nc1cccc(CO)n1" [color=lightyellow shape=box style=filled]
	5 -> "11 | Nc1cccc(CO)n1" [label=""]
	"12 | Cn1oc(=O)nc1C(Cl)c1ccccc1" [color=aquamarine shape=box style=filled]
	6 -> "12 | Cn1oc(=O)nc1C(Cl)c1ccccc1" [label=""]
	"13 | NOCc1cccc(N)n1" [color=lightblue shape=box style=filled]
	6 -> "13 | NOCc1cccc(N)n1" [label=""]
	"14 | Cn1oc(=O)nc1/C(=N\O)c1ccccc1" [color=aquamarine shape=box style=filled]
	7 -> "14 | Cn1oc(=O)nc1/C(=N\O)c1ccccc1" [label=""]
	"15 | Nc1cccc(C=O)n1" [color=lightyellow shape=box style=filled]
	7 -> "15 | Nc1cccc(C=O)n1" [label=""]
	"16 | Cn1oc(=O)nc1C(=N)c1ccccc1" [color=aquamarine shape=box style=filled]
	8 -> "16 | Cn1oc(=O)nc1C(=N)c1ccccc1" [label=""]
	"17 | Nc1cccc(COO)n1" [color=lightblue shape=box style=filled]
	8 -> "17 | Nc1cccc(COO)n1" [label=""]
	"18 | NOCc1cccc(N)n1" [color=lightblue shape=box style=filled]
	9 -> "18 | NOCc1cccc(N)n1" [label=""]
	"19 | Cn1oc(=O)nc1C(=O)c1ccccc1" [color=aquamarine shape=box style=filled]
	9 -> "19 | Cn1oc(=O)nc1C(=O)c1ccccc1" [label=""]
	10 [color=lightblue shape=rarrow style=filled]
	"2 | NOCc1cccc(N)n1" -> 10 [label=0.000]
	11 [color=lightblue shape=rarrow style=filled]
	"2 | NOCc1cccc(N)n1" -> 11 [label=0.000]
	12 [color=lightblue shape=rarrow style=filled]
	"2 | NOCc1cccc(N)n1" -> 12 [label=0.000]
	13 [color=lightblue shape=rarrow style=filled]
	"2 | NOCc1cccc(N)n1" -> 13 [label=0.000]
	14 [color=lightblue shape=rarrow style=filled]
	"2 | NOCc1cccc(N)n1" -> 14 [label=0.000]
	15 [color=lightblue shape=rarrow style=filled]
	"2 | NOCc1cccc(N)n1" -> 15 [label=0.000]
	16 [color=lightblue shape=rarrow style=filled]
	"2 | NOCc1cccc(N)n1" -> 16 [label=0.000]
	17 [color=lightblue shape=rarrow style=filled]
	"3 | Cn1oc(=O)nc1C(=O)c1ccccc1" -> 17 [label=0.000]
	18 [color=aquamarine shape=rarrow style=filled]
	"3 | Cn1oc(=O)nc1C(=O)c1ccccc1" -> 18 [label=0.000]
	19 [color=aquamarine shape=rarrow style=filled]
	"3 | Cn1oc(=O)nc1C(=O)c1ccccc1" -> 19 [label=0.000]
	20 [color=aquamarine shape=rarrow style=filled]
	"3 | Cn1oc(=O)nc1C(=O)c1ccccc1" -> 20 [label=0.000]
	21 [color=aquamarine shape=rarrow style=filled]
	"5 | Cn1oc(=O)nc1/C(=N/Cl)c1ccccc1" -> 21 [label=0.000]
	22 [color=aquamarine shape=rarrow style=filled]
	"5 | Cn1oc(=O)nc1/C(=N/Cl)c1ccccc1" -> 22 [label=0.000]
	23 [color=aquamarine shape=rarrow style=filled]
	"5 | Cn1oc(=O)nc1/C(=N/Cl)c1ccccc1" -> 23 [label=0.000]
	24 [color=aquamarine shape=rarrow style=filled]
	"5 | Cn1oc(=O)nc1/C(=N/Cl)c1ccccc1" -> 24 [label=0.000]
	25 [color=aquamarine shape=rarrow style=filled]
	"5 | Cn1oc(=O)nc1/C(=N/Cl)c1ccccc1" -> 25 [label=0.000]
	26 [color=aquamarine shape=rarrow style=filled]
	"5 | Cn1oc(=O)nc1/C(=N/Cl)c1ccccc1" -> 26 [label=0.000]
	27 [color=aquamarine shape=rarrow style=filled]
	"5 | Cn1oc(=O)nc1/C(=N/Cl)c1ccccc1" -> 27 [label=0.000]
	28 [color=aquamarine shape=rarrow style=filled]
	"5 | Cn1oc(=O)nc1/C(=N/Cl)c1ccccc1" -> 28 [label=0.000]
	29 [color=aquamarine shape=rarrow style=filled]
	"5 | Cn1oc(=O)nc1/C(=N/Cl)c1ccccc1" -> 29 [label=0.000]
	30 [color=aquamarine shape=rarrow style=filled]
	"5 | Cn1oc(=O)nc1/C(=N/Cl)c1ccccc1" -> 30 [label=0.000]
	31 [color=aquamarine shape=rarrow style=filled]
	"6 | Cn1oc(=O)nc1C(O)c1ccccc1" -> 31 [label=0.000]
	32 [color=aquamarine shape=rarrow style=filled]
	"6 | Cn1oc(=O)nc1C(O)c1ccccc1" -> 32 [label=0.000]
	33 [color=aquamarine shape=rarrow style=filled]
	"6 | Cn1oc(=O)nc1C(O)c1ccccc1" -> 33 [label=0.000]
	34 [color=aquamarine shape=rarrow style=filled]
	"6 | Cn1oc(=O)nc1C(O)c1ccccc1" -> 34 [label=0.000]
	35 [color=aquamarine shape=rarrow style=filled]
	"6 | Cn1oc(=O)nc1C(O)c1ccccc1" -> 35 [label=0.000]
	36 [color=aquamarine shape=rarrow style=filled]
	"6 | Cn1oc(=O)nc1C(O)c1ccccc1" -> 36 [label=0.000]
	37 [color=aquamarine shape=rarrow style=filled]
	"6 | Cn1oc(=O)nc1C(O)c1ccccc1" -> 37 [label=0.000]
	38 [color=aquamarine shape=rarrow style=filled]
	"6 | Cn1oc(=O)nc1C(O)c1ccccc1" -> 38 [label=0.000]
	39 [color=aquamarine shape=rarrow style=filled]
	"6 | Cn1oc(=O)nc1C(O)c1ccccc1" -> 39 [label=0.000]
	40 [color=aquamarine shape=rarrow style=filled]
	"6 | Cn1oc(=O)nc1C(O)c1ccccc1" -> 40 [label=0.000]
	41 [color=lightblue shape=rarrow style=filled]
	"7 | NOCc1cccc(N)n1" -> 41 [label=0.000]
	42 [color=lightblue shape=rarrow style=filled]
	"7 | NOCc1cccc(N)n1" -> 42 [label=0.000]
	43 [color=lightblue shape=rarrow style=filled]
	"7 | NOCc1cccc(N)n1" -> 43 [label=0.000]
	44 [color=lightblue shape=rarrow style=filled]
	"7 | NOCc1cccc(N)n1" -> 44 [label=0.000]
	45 [color=lightblue shape=rarrow style=filled]
	"7 | NOCc1cccc(N)n1" -> 45 [label=0.000]
	46 [color=lightblue shape=rarrow style=filled]
	"7 | NOCc1cccc(N)n1" -> 46 [label=0.000]
	47 [color=lightblue shape=rarrow style=filled]
	"7 | NOCc1cccc(N)n1" -> 47 [label=0.000]
	48 [color=aquamarine shape=rarrow style=filled]
	"8 | Cn1oc(=O)nc1/C(c1ccccc1)=[N+](/O)Cl" -> 48 [label=0.000]
	49 [color=aquamarine shape=rarrow style=filled]
	"8 | Cn1oc(=O)nc1/C(c1ccccc1)=[N+](/O)Cl" -> 49 [label=0.000]
	50 [color=aquamarine shape=rarrow style=filled]
	"8 | Cn1oc(=O)nc1/C(c1ccccc1)=[N+](/O)Cl" -> 50 [label=0.000]
	51 [color=aquamarine shape=rarrow style=filled]
	"8 | Cn1oc(=O)nc1/C(c1ccccc1)=[N+](/O)Cl" -> 51 [label=0.000]
	52 [color=aquamarine shape=rarrow style=filled]
	"8 | Cn1oc(=O)nc1/C(c1ccccc1)=[N+](/O)Cl" -> 52 [label=0.000]
	53 [color=aquamarine shape=rarrow style=filled]
	"8 | Cn1oc(=O)nc1/C(c1ccccc1)=[N+](/O)Cl" -> 53 [label=0.000]
	54 [color=aquamarine shape=rarrow style=filled]
	"8 | Cn1oc(=O)nc1/C(c1ccccc1)=[N+](/O)Cl" -> 54 [label=0.000]
	55 [color=aquamarine shape=rarrow style=filled]
	"8 | Cn1oc(=O)nc1/C(c1ccccc1)=[N+](/O)Cl" -> 55 [label=0.000]
	56 [color=aquamarine shape=rarrow style=filled]
	"8 | Cn1oc(=O)nc1/C(c1ccccc1)=[N+](/O)Cl" -> 56 [label=0.000]
	57 [color=aquamarine shape=rarrow style=filled]
	"8 | Cn1oc(=O)nc1/C(c1ccccc1)=[N+](/O)Cl" -> 57 [label=0.000]
	58 [color=aquamarine shape=rarrow style=filled]
	"10 | Cn1oc(=O)nc1/C(=N/O)c1ccccc1" -> 58 [label=0.000]
	59 [color=aquamarine shape=rarrow style=filled]
	"10 | Cn1oc(=O)nc1/C(=N/O)c1ccccc1" -> 59 [label=0.000]
	60 [color=aquamarine shape=rarrow style=filled]
	"10 | Cn1oc(=O)nc1/C(=N/O)c1ccccc1" -> 60 [label=0.000]
	61 [color=aquamarine shape=rarrow style=filled]
	"10 | Cn1oc(=O)nc1/C(=N/O)c1ccccc1" -> 61 [label=0.000]
	62 [color=aquamarine shape=rarrow style=filled]
	"10 | Cn1oc(=O)nc1/C(=N/O)c1ccccc1" -> 62 [label=0.000]
	63 [color=aquamarine shape=rarrow style=filled]
	"10 | Cn1oc(=O)nc1/C(=N/O)c1ccccc1" -> 63 [label=0.000]
	64 [color=aquamarine shape=rarrow style=filled]
	"10 | Cn1oc(=O)nc1/C(=N/O)c1ccccc1" -> 64 [label=0.000]
	65 [color=aquamarine shape=rarrow style=filled]
	"10 | Cn1oc(=O)nc1/C(=N/O)c1ccccc1" -> 65 [label=0.000]
	66 [color=aquamarine shape=rarrow style=filled]
	"10 | Cn1oc(=O)nc1/C(=N/O)c1ccccc1" -> 66 [label=0.000]
	67 [color=aquamarine shape=rarrow style=filled]
	"10 | Cn1oc(=O)nc1/C(=N/O)c1ccccc1" -> 67 [label=0.000]
	68 [color=aquamarine shape=rarrow style=filled]
	"12 | Cn1oc(=O)nc1C(Cl)c1ccccc1" -> 68 [label=0.000]
	69 [color=aquamarine shape=rarrow style=filled]
	"12 | Cn1oc(=O)nc1C(Cl)c1ccccc1" -> 69 [label=0.000]
	70 [color=aquamarine shape=rarrow style=filled]
	"12 | Cn1oc(=O)nc1C(Cl)c1ccccc1" -> 70 [label=0.000]
	71 [color=aquamarine shape=rarrow style=filled]
	"12 | Cn1oc(=O)nc1C(Cl)c1ccccc1" -> 71 [label=0.000]
	72 [color=aquamarine shape=rarrow style=filled]
	"12 | Cn1oc(=O)nc1C(Cl)c1ccccc1" -> 72 [label=0.000]
	73 [color=aquamarine shape=rarrow style=filled]
	"12 | Cn1oc(=O)nc1C(Cl)c1ccccc1" -> 73 [label=0.000]
	74 [color=aquamarine shape=rarrow style=filled]
	"12 | Cn1oc(=O)nc1C(Cl)c1ccccc1" -> 74 [label=0.000]
	75 [color=aquamarine shape=rarrow style=filled]
	"12 | Cn1oc(=O)nc1C(Cl)c1ccccc1" -> 75 [label=0.000]
	76 [color=aquamarine shape=rarrow style=filled]
	"12 | Cn1oc(=O)nc1C(Cl)c1ccccc1" -> 76 [label=0.000]
	77 [color=aquamarine shape=rarrow style=filled]
	"12 | Cn1oc(=O)nc1C(Cl)c1ccccc1" -> 77 [label=0.000]
	78 [color=lightblue shape=rarrow style=filled]
	"13 | NOCc1cccc(N)n1" -> 78 [label=0.000]
	79 [color=lightblue shape=rarrow style=filled]
	"13 | NOCc1cccc(N)n1" -> 79 [label=0.000]
	80 [color=lightblue shape=rarrow style=filled]
	"13 | NOCc1cccc(N)n1" -> 80 [label=0.000]
	81 [color=lightblue shape=rarrow style=filled]
	"13 | NOCc1cccc(N)n1" -> 81 [label=0.000]
	82 [color=lightblue shape=rarrow style=filled]
	"13 | NOCc1cccc(N)n1" -> 82 [label=0.000]
	83 [color=lightblue shape=rarrow style=filled]
	"13 | NOCc1cccc(N)n1" -> 83 [label=0.000]
	84 [color=lightblue shape=rarrow style=filled]
	"13 | NOCc1cccc(N)n1" -> 84 [label=0.000]
	85 [color=aquamarine shape=rarrow style=filled]
	"14 | Cn1oc(=O)nc1/C(=N\O)c1ccccc1" -> 85 [label=0.000]
	86 [color=aquamarine shape=rarrow style=filled]
	"14 | Cn1oc(=O)nc1/C(=N\O)c1ccccc1" -> 86 [label=0.000]
	87 [color=aquamarine shape=rarrow style=filled]
	"14 | Cn1oc(=O)nc1/C(=N\O)c1ccccc1" -> 87 [label=0.000]
	88 [color=aquamarine shape=rarrow style=filled]
	"14 | Cn1oc(=O)nc1/C(=N\O)c1ccccc1" -> 88 [label=0.000]
	89 [color=aquamarine shape=rarrow style=filled]
	"14 | Cn1oc(=O)nc1/C(=N\O)c1ccccc1" -> 89 [label=0.000]
	90 [color=aquamarine shape=rarrow style=filled]
	"14 | Cn1oc(=O)nc1/C(=N\O)c1ccccc1" -> 90 [label=0.000]
	91 [color=aquamarine shape=rarrow style=filled]
	"14 | Cn1oc(=O)nc1/C(=N\O)c1ccccc1" -> 91 [label=0.000]
	92 [color=aquamarine shape=rarrow style=filled]
	"14 | Cn1oc(=O)nc1/C(=N\O)c1ccccc1" -> 92 [label=0.000]
	93 [color=aquamarine shape=rarrow style=filled]
	"14 | Cn1oc(=O)nc1/C(=N\O)c1ccccc1" -> 93 [label=0.000]
	94 [color=aquamarine shape=rarrow style=filled]
	"14 | Cn1oc(=O)nc1/C(=N\O)c1ccccc1" -> 94 [label=0.000]
	95 [color=aquamarine shape=rarrow style=filled]
	"16 | Cn1oc(=O)nc1C(=N)c1ccccc1" -> 95 [label=0.000]
	96 [color=aquamarine shape=rarrow style=filled]
	"16 | Cn1oc(=O)nc1C(=N)c1ccccc1" -> 96 [label=0.000]
	97 [color=aquamarine shape=rarrow style=filled]
	"16 | Cn1oc(=O)nc1C(=N)c1ccccc1" -> 97 [label=0.000]
	98 [color=aquamarine shape=rarrow style=filled]
	"16 | Cn1oc(=O)nc1C(=N)c1ccccc1" -> 98 [label=0.000]
	99 [color=aquamarine shape=rarrow style=filled]
	"16 | Cn1oc(=O)nc1C(=N)c1ccccc1" -> 99 [label=0.000]
	100 [color=aquamarine shape=rarrow style=filled]
	"16 | Cn1oc(=O)nc1C(=N)c1ccccc1" -> 100 [label=0.000]
	101 [color=aquamarine shape=rarrow style=filled]
	"16 | Cn1oc(=O)nc1C(=N)c1ccccc1" -> 101 [label=0.000]
	102 [color=aquamarine shape=rarrow style=filled]
	"16 | Cn1oc(=O)nc1C(=N)c1ccccc1" -> 102 [label=0.000]
	103 [color=aquamarine shape=rarrow style=filled]
	"16 | Cn1oc(=O)nc1C(=N)c1ccccc1" -> 103 [label=0.000]
	104 [color=aquamarine shape=rarrow style=filled]
	"16 | Cn1oc(=O)nc1C(=N)c1ccccc1" -> 104 [label=0.000]
	105 [color=lightblue shape=rarrow style=filled]
	"17 | Nc1cccc(COO)n1" -> 105 [label=0.000]
	106 [color=lightblue shape=rarrow style=filled]
	"17 | Nc1cccc(COO)n1" -> 106 [label=0.000]
	107 [color=lightblue shape=rarrow style=filled]
	"17 | Nc1cccc(COO)n1" -> 107 [label=0.000]
	108 [color=lightblue shape=rarrow style=filled]
	"17 | Nc1cccc(COO)n1" -> 108 [label=0.000]
	109 [color=aquamarine shape=rarrow style=filled]
	"17 | Nc1cccc(COO)n1" -> 109 [label=0.000]
	110 [color=lightblue shape=rarrow style=filled]
	"17 | Nc1cccc(COO)n1" -> 110 [label=0.000]
	111 [color=lightblue shape=rarrow style=filled]
	"17 | Nc1cccc(COO)n1" -> 111 [label=0.000]
	112 [color=aquamarine shape=rarrow style=filled]
	"17 | Nc1cccc(COO)n1" -> 112 [label=0.000]
	113 [color=aquamarine shape=rarrow style=filled]
	"17 | Nc1cccc(COO)n1" -> 113 [label=0.000]
	114 [color=aquamarine shape=rarrow style=filled]
	"17 | Nc1cccc(COO)n1" -> 114 [label=0.000]
	115 [color=lightblue shape=rarrow style=filled]
	"18 | NOCc1cccc(N)n1" -> 115 [label=0.000]
	116 [color=lightblue shape=rarrow style=filled]
	"18 | NOCc1cccc(N)n1" -> 116 [label=0.000]
	117 [color=lightblue shape=rarrow style=filled]
	"18 | NOCc1cccc(N)n1" -> 117 [label=0.000]
	118 [color=lightblue shape=rarrow style=filled]
	"18 | NOCc1cccc(N)n1" -> 118 [label=0.000]
	119 [color=lightblue shape=rarrow style=filled]
	"18 | NOCc1cccc(N)n1" -> 119 [label=0.000]
	120 [color=lightblue shape=rarrow style=filled]
	"18 | NOCc1cccc(N)n1" -> 120 [label=0.000]
	121 [color=lightblue shape=rarrow style=filled]
	"18 | NOCc1cccc(N)n1" -> 121 [label=0.000]
	122 [color=aquamarine shape=rarrow style=filled]
	"19 | Cn1oc(=O)nc1C(=O)c1ccccc1" -> 122 [label=0.000]
	123 [color=aquamarine shape=rarrow style=filled]
	"19 | Cn1oc(=O)nc1C(=O)c1ccccc1" -> 123 [label=0.000]
	124 [color=aquamarine shape=rarrow style=filled]
	"19 | Cn1oc(=O)nc1C(=O)c1ccccc1" -> 124 [label=0.000]
	125 [color=aquamarine shape=rarrow style=filled]
	"19 | Cn1oc(=O)nc1C(=O)c1ccccc1" -> 125 [label=0.000]
	"20 | Cc1cccc(N)n1" [color=lightyellow shape=box style=filled]
	10 -> "20 | Cc1cccc(N)n1" [label=""]
	"21 | CC(C)(C)OC(=O)NO" [color=lightyellow shape=box style=filled]
	10 -> "21 | CC(C)(C)OC(=O)NO" [label=""]
	"22 | Nc1cccc(CO)n1" [color=lightyellow shape=box style=filled]
	11 -> "22 | Nc1cccc(CO)n1" [label=""]
	"23 | CC(C)(C)OC(N)=O" [color=lightyellow shape=box style=filled]
	11 -> "23 | CC(C)(C)OC(N)=O" [label=""]
	"24 | NO" [color=lightyellow shape=box style=filled]
	12 -> "24 | NO" [label=""]
	"25 | Nc1cccc(C=O)n1" [color=lightyellow shape=box style=filled]
	12 -> "25 | Nc1cccc(C=O)n1" [label=""]
	"26 | NO" [color=lightyellow shape=box style=filled]
	13 -> "26 | NO" [label=""]
	"27 | Nc1cccc(CCl)n1" [color=lightyellow shape=box style=filled]
	13 -> "27 | Nc1cccc(CCl)n1" [label=""]
	"28 | NO" [color=lightyellow shape=box style=filled]
	14 -> "28 | NO" [label=""]
	"29 | Nc1cccc(CBr)n1" [color=lightyellow shape=box style=filled]
	14 -> "29 | Nc1cccc(CBr)n1" [label=""]
	"30 | NO" [color=lightyellow shape=box style=filled]
	15 -> "30 | NO" [label=""]
	"31 | Nc1cccc(CO)n1" [color=lightyellow shape=box style=filled]
	15 -> "31 | Nc1cccc(CO)n1" [label=""]
	"32 | NO" [color=lightyellow shape=box style=filled]
	16 -> "32 | NO" [label=""]
	"33 | Nc1cccc(C(=O)O)n1" [color=lightyellow shape=box style=filled]
	16 -> "33 | Nc1cccc(C(=O)O)n1" [label=""]
	"34 | Cn1cnc(=O)o1" [color=lightblue shape=box style=filled]
	17 -> "34 | Cn1cnc(=O)o1" [label=""]
	"35 | O=C(Cl)c1ccccc1" [color=lightyellow shape=box style=filled]
	17 -> "35 | O=C(Cl)c1ccccc1" [label=""]
	"36 | Cn1cnc(=O)o1" [color=lightgrey shape=box style=filled]
	18 -> "36 | Cn1cnc(=O)o1" [label=""]
	"37 | O=C(O)c1ccccc1" [color=lightyellow shape=box style=filled]
	18 -> "37 | O=C(O)c1ccccc1" [label=""]
	"38 | O[B]O" [color=lightgrey shape=box style=filled]
	19 -> "38 | O[B]O" [label=""]
	"39 | CC1(C)OB(c2ccc(Br)c(Br)c2)OC1(C)C" [color=lightyellow shape=box style=filled]
	19 -> "39 | CC1(C)OB(c2ccc(Br)c(Br)c2)OC1(C)C" [label=""]
	"40 | Cn1c(C(=O)Cl)nc(=O)[o+]1Cl" [color=lightgrey shape=box style=filled]
	19 -> "40 | Cn1c(C(=O)Cl)nc(=O)[o+]1Cl" [label=""]
	"41 | Cn1oc(=O)nc1C(=O)Cl" [color=lightgrey shape=box style=filled]
	20 -> "41 | Cn1oc(=O)nc1C(=O)Cl" [label=""]
	"42 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	20 -> "42 | O=C1CCC(=O)N1Br" [label=""]
	"43 | OB(O)c1ccc(Br)c(Cl)c1" [color=lightyellow shape=box style=filled]
	20 -> "43 | OB(O)c1ccc(Br)c(Cl)c1" [label=""]
	"44 | NCl" [color=lightgrey shape=box style=filled]
	21 -> "44 | NCl" [label=""]
	"45 | Cn1oc(=O)nc1C(=O)c1ccccc1" [color=lightgrey shape=box style=filled]
	21 -> "45 | Cn1oc(=O)nc1C(=O)c1ccccc1" [label=""]
	"46 | Cn1cnc(=O)o1" [color=lightgrey shape=box style=filled]
	22 -> "46 | Cn1cnc(=O)o1" [label=""]
	"47 | Cl/N=C(\Cl)c1ccccc1" [color=lightgrey shape=box style=filled]
	22 -> "47 | Cl/N=C(\Cl)c1ccccc1" [label=""]
	"48 | Cn1oc(=O)nc1C(O)c1ccccc1" [color=lightgrey shape=box style=filled]
	23 -> "48 | Cn1oc(=O)nc1C(O)c1ccccc1" [label=""]
	"49 | NCl" [color=lightgrey shape=box style=filled]
	23 -> "49 | NCl" [label=""]
	"50 | Cn1oc(=O)nc1C(Cl)c1ccccc1" [color=lightgrey shape=box style=filled]
	24 -> "50 | Cn1oc(=O)nc1C(Cl)c1ccccc1" [label=""]
	"51 | NCl" [color=lightgrey shape=box style=filled]
	24 -> "51 | NCl" [label=""]
	"52 | [N]Cl" [color=lightgrey shape=box style=filled]
	25 -> "52 | [N]Cl" [label=""]
	"53 | Cn1oc(=O)nc1[C]c1ccccc1" [color=lightgrey shape=box style=filled]
	25 -> "53 | Cn1oc(=O)nc1[C]c1ccccc1" [label=""]
	"54 | Cn1oc(=O)nc1Cc1ccccc1" [color=lightgrey shape=box style=filled]
	26 -> "54 | Cn1oc(=O)nc1Cc1ccccc1" [label=""]
	"55 | ClNCl" [color=lightgrey shape=box style=filled]
	26 -> "55 | ClNCl" [label=""]
	"56 | Cn1cnc(=O)o1" [color=lightgrey shape=box style=filled]
	27 -> "56 | Cn1cnc(=O)o1" [label=""]
	"57 | O/C(=N\Cl)c1ccccc1" [color=lightgrey shape=box style=filled]
	27 -> "57 | O/C(=N\Cl)c1ccccc1" [label=""]
	"58 | Cl/N=C(\Br)c1ccccc1" [color=lightgrey shape=box style=filled]
	28 -> "58 | Cl/N=C(\Br)c1ccccc1" [label=""]
	"59 | Cn1cnc(=O)o1" [color=lightgrey shape=box style=filled]
	28 -> "59 | Cn1cnc(=O)o1" [label=""]
	"60 | NCl" [color=lightgrey shape=box style=filled]
	29 -> "60 | NCl" [label=""]
	"61 | Cn1oc(=O)nc1C(=O)c1ccccc1" [color=lightgrey shape=box style=filled]
	29 -> "61 | Cn1oc(=O)nc1C(=O)c1ccccc1" [label=""]
	"62 | NCl" [color=lightgrey shape=box style=filled]
	30 -> "62 | NCl" [label=""]
	"63 | Cn1oc(=O)nc1C(=O)c1ccccc1" [color=lightgrey shape=box style=filled]
	30 -> "63 | Cn1oc(=O)nc1C(=O)c1ccccc1" [label=""]
	"64 | Cn1cnc(=O)o1" [color=lightgrey shape=box style=filled]
	31 -> "64 | Cn1cnc(=O)o1" [label=""]
	"65 | O=Cc1ccccc1" [color=lightyellow shape=box style=filled]
	31 -> "65 | O=Cc1ccccc1" [label=""]
	"66 | O=c1nc(C(O)c2ccccc2)[nH]o1" [color=lightgrey shape=box style=filled]
	32 -> "66 | O=c1nc(C(O)c2ccccc2)[nH]o1" [label=""]
	"67 | CI" [color=lightyellow shape=box style=filled]
	32 -> "67 | CI" [label=""]
	"68 | c1ccccc1" [color=lightyellow shape=box style=filled]
	33 -> "68 | c1ccccc1" [label=""]
	"69 | Cn1oc(=O)nc1C=O" [color=lightgrey shape=box style=filled]
	33 -> "69 | Cn1oc(=O)nc1C=O" [label=""]
	"70 | CN(Cl)C(=NC(=O)O)C(O)c1ccccc1" [color=lightgrey shape=box style=filled]
	34 -> "70 | CN(Cl)C(=NC(=O)O)C(O)c1ccccc1" [label=""]
	"71 | Ic1ccccc1" [color=lightyellow shape=box style=filled]
	35 -> "71 | Ic1ccccc1" [label=""]
	"72 | Cn1oc(=O)nc1C=O" [color=lightgrey shape=box style=filled]
	35 -> "72 | Cn1oc(=O)nc1C=O" [label=""]
	"73 | CNC(=NC(=O)O)C(=O)c1ccccc1" [color=lightgrey shape=box style=filled]
	36 -> "73 | CNC(=NC(=O)O)C(=O)c1ccccc1" [label=""]
	"74 | CN(Br)C(=NC(=O)O)C(O)c1ccccc1" [color=lightgrey shape=box style=filled]
	37 -> "74 | CN(Br)C(=NC(=O)O)C(O)c1ccccc1" [label=""]
	"75 | Cn1cnc(=O)o1" [color=lightgrey shape=box style=filled]
	38 -> "75 | Cn1cnc(=O)o1" [label=""]
	"76 | O=C(O)c1ccccc1" [color=lightyellow shape=box style=filled]
	38 -> "76 | O=C(O)c1ccccc1" [label=""]
	"77 | Cn1oc(=O)nc1C=O" [color=lightgrey shape=box style=filled]
	39 -> "77 | Cn1oc(=O)nc1C=O" [label=""]
	"78 | Brc1ccccc1" [color=lightyellow shape=box style=filled]
	39 -> "78 | Brc1ccccc1" [label=""]
	"79 | C[N+](=O)C(=NC(=O)O)C(O)c1ccccc1" [color=lightgrey shape=box style=filled]
	40 -> "79 | C[N+](=O)C(=NC(=O)O)C(O)c1ccccc1" [label=""]
	"80 | Cc1cccc(N)n1" [color=lightyellow shape=box style=filled]
	41 -> "80 | Cc1cccc(N)n1" [label=""]
	"81 | CC(C)(C)OC(=O)NO" [color=lightyellow shape=box style=filled]
	41 -> "81 | CC(C)(C)OC(=O)NO" [label=""]
	"82 | Nc1cccc(CO)n1" [color=lightyellow shape=box style=filled]
	42 -> "82 | Nc1cccc(CO)n1" [label=""]
	"83 | CC(C)(C)OC(N)=O" [color=lightyellow shape=box style=filled]
	42 -> "83 | CC(C)(C)OC(N)=O" [label=""]
	"84 | NO" [color=lightyellow shape=box style=filled]
	43 -> "84 | NO" [label=""]
	"85 | Nc1cccc(C=O)n1" [color=lightyellow shape=box style=filled]
	43 -> "85 | Nc1cccc(C=O)n1" [label=""]
	"86 | NO" [color=lightyellow shape=box style=filled]
	44 -> "86 | NO" [label=""]
	"87 | Nc1cccc(CCl)n1" [color=lightyellow shape=box style=filled]
	44 -> "87 | Nc1cccc(CCl)n1" [label=""]
	"88 | NO" [color=lightyellow shape=box style=filled]
	45 -> "88 | NO" [label=""]
	"89 | Nc1cccc(CBr)n1" [color=lightyellow shape=box style=filled]
	45 -> "89 | Nc1cccc(CBr)n1" [label=""]
	"90 | NO" [color=lightyellow shape=box style=filled]
	46 -> "90 | NO" [label=""]
	"91 | Nc1cccc(CO)n1" [color=lightyellow shape=box style=filled]
	46 -> "91 | Nc1cccc(CO)n1" [label=""]
	"92 | NO" [color=lightyellow shape=box style=filled]
	47 -> "92 | NO" [label=""]
	"93 | Nc1cccc(C(=O)O)n1" [color=lightyellow shape=box style=filled]
	47 -> "93 | Nc1cccc(C(=O)O)n1" [label=""]
	"94 | O[N+]Cl" [color=lightgrey shape=box style=filled]
	48 -> "94 | O[N+]Cl" [label=""]
	"95 | Cn1oc(=O)nc1C(=O)c1ccccc1" [color=lightgrey shape=box style=filled]
	48 -> "95 | Cn1oc(=O)nc1C(=O)c1ccccc1" [label=""]
	"96 | Cn1oc(=O)nc1C(O)c1ccccc1" [color=lightgrey shape=box style=filled]
	49 -> "96 | Cn1oc(=O)nc1C(O)c1ccccc1" [label=""]
	"97 | O[N+]Cl" [color=lightgrey shape=box style=filled]
	49 -> "97 | O[N+]Cl" [label=""]
	"98 | O[N+]Cl" [color=lightgrey shape=box style=filled]
	50 -> "98 | O[N+]Cl" [label=""]
	"99 | Cn1oc(=O)nc1C(Cl)c1ccccc1" [color=lightgrey shape=box style=filled]
	50 -> "99 | Cn1oc(=O)nc1C(Cl)c1ccccc1" [label=""]
	"100 | O/[N+](Cl)=C(\Cl)c1ccccc1" [color=lightgrey shape=box style=filled]
	51 -> "100 | O/[N+](Cl)=C(\Cl)c1ccccc1" [label=""]
	"101 | Cn1cnc(=O)o1" [color=lightgrey shape=box style=filled]
	51 -> "101 | Cn1cnc(=O)o1" [label=""]
	"102 | O[N+]Cl" [color=lightgrey shape=box style=filled]
	52 -> "102 | O[N+]Cl" [label=""]
	"103 | Cn1oc(=O)nc1C(Br)c1ccccc1" [color=lightgrey shape=box style=filled]
	52 -> "103 | Cn1oc(=O)nc1C(Br)c1ccccc1" [label=""]
	"104 | O[N+]Cl" [color=lightgrey shape=box style=filled]
	53 -> "104 | O[N+]Cl" [label=""]
	"105 | Cn1oc(=O)nc1[C]c1ccccc1" [color=lightgrey shape=box style=filled]
	53 -> "105 | Cn1oc(=O)nc1[C]c1ccccc1" [label=""]
	"106 | O[N+]Cl" [color=lightgrey shape=box style=filled]
	54 -> "106 | O[N+]Cl" [label=""]
	"107 | Cn1cnc(=O)o1" [color=lightgrey shape=box style=filled]
	54 -> "107 | Cn1cnc(=O)o1" [label=""]
	"108 | O=Cc1ccccc1" [color=lightyellow shape=box style=filled]
	54 -> "108 | O=Cc1ccccc1" [label=""]
	"109 | O/[N+](Cl)=C\c1ccccc1" [color=lightgrey shape=box style=filled]
	55 -> "109 | O/[N+](Cl)=C\c1ccccc1" [label=""]
	"110 | Cn1oc(=O)nc1Cl" [color=lightgrey shape=box style=filled]
	55 -> "110 | Cn1oc(=O)nc1Cl" [label=""]
	"111 | O/C(c1ccccc1)=[N+](\O)Cl" [color=lightgrey shape=box style=filled]
	56 -> "111 | O/C(c1ccccc1)=[N+](\O)Cl" [label=""]
	"112 | Cn1cnc(=O)o1" [color=lightgrey shape=box style=filled]
	56 -> "112 | Cn1cnc(=O)o1" [label=""]
	"113 | O[N+]Cl" [color=lightgrey shape=box style=filled]
	57 -> "113 | O[N+]Cl" [label=""]
	"114 | Cn1oc(=O)nc1C(=O)c1ccccc1" [color=lightgrey shape=box style=filled]
	57 -> "114 | Cn1oc(=O)nc1C(=O)c1ccccc1" [label=""]
	"115 | NO" [color=lightyellow shape=box style=filled]
	58 -> "115 | NO" [label=""]
	"116 | Cn1oc(=O)nc1C(=O)c1ccccc1" [color=lightgrey shape=box style=filled]
	58 -> "116 | Cn1oc(=O)nc1C(=O)c1ccccc1" [label=""]
	"117 | Cn1oc(=O)nc1C(O)c1ccccc1" [color=lightgrey shape=box style=filled]
	59 -> "117 | Cn1oc(=O)nc1C(O)c1ccccc1" [label=""]
	"118 | NO" [color=lightyellow shape=box style=filled]
	59 -> "118 | NO" [label=""]
	"119 | NO" [color=lightyellow shape=box style=filled]
	60 -> "119 | NO" [label=""]
	"120 | Cn1oc(=O)nc1C(Cl)c1ccccc1" [color=lightgrey shape=box style=filled]
	60 -> "120 | Cn1oc(=O)nc1C(Cl)c1ccccc1" [label=""]
	"121 | Cn1cnc(=O)o1" [color=lightgrey shape=box style=filled]
	61 -> "121 | Cn1cnc(=O)o1" [label=""]
	"122 | O/N=C(\Cl)c1ccccc1" [color=lightyellow shape=box style=filled]
	61 -> "122 | O/N=C(\Cl)c1ccccc1" [label=""]
	"123 | Cn1oc(=O)nc1Cc1ccccc1" [color=lightgrey shape=box style=filled]
	62 -> "123 | Cn1oc(=O)nc1Cc1ccccc1" [label=""]
	"124 | O=NO" [color=lightyellow shape=box style=filled]
	62 -> "124 | O=NO" [label=""]
	"125 | Cn1cnc(=O)o1" [color=lightgrey shape=box style=filled]
	63 -> "125 | Cn1cnc(=O)o1" [label=""]
	"126 | ONCc1ccccc1" [color=lightyellow shape=box style=filled]
	63 -> "126 | ONCc1ccccc1" [label=""]
	"127 | O/N=C\c1ccccc1" [color=lightyellow shape=box style=filled]
	64 -> "127 | O/N=C\c1ccccc1" [label=""]
	"128 | Cn1oc(=O)nc1Cl" [color=lightgrey shape=box style=filled]
	64 -> "128 | Cn1oc(=O)nc1Cl" [label=""]
	"129 | Cn1cnc(=O)o1" [color=lightgrey shape=box style=filled]
	65 -> "129 | Cn1cnc(=O)o1" [label=""]
	"130 | O=C(NO)c1ccccc1" [color=lightyellow shape=box style=filled]
	65 -> "130 | O=C(NO)c1ccccc1" [label=""]
	"131 | O/N=C(\O)c1ccccc1" [color=lightgrey shape=box style=filled]
	66 -> "131 | O/N=C(\O)c1ccccc1" [label=""]
	"132 | Cn1cnc(=O)o1" [color=lightgrey shape=box style=filled]
	66 -> "132 | Cn1cnc(=O)o1" [label=""]
	"133 | O[N+]#Cc1ccccc1" [color=lightgrey shape=box style=filled]
	67 -> "133 | O[N+]#Cc1ccccc1" [label=""]
	"134 | Cn1cnc(=O)o1" [color=lightgrey shape=box style=filled]
	67 -> "134 | Cn1cnc(=O)o1" [label=""]
	"135 | Cn1oc(=O)nc1Cc1ccccc1" [color=lightgrey shape=box style=filled]
	68 -> "135 | Cn1oc(=O)nc1Cc1ccccc1" [label=""]
	"136 | O=C1CCC(=O)N1Cl" [color=lightyellow shape=box style=filled]
	68 -> "136 | O=C1CCC(=O)N1Cl" [label=""]
	"137 | Cn1oc(=O)nc1Cc1ccccc1" [color=lightgrey shape=box style=filled]
	69 -> "137 | Cn1oc(=O)nc1Cc1ccccc1" [label=""]
	"138 | ClC(Cl)(Cl)Cl" [color=lightyellow shape=box style=filled]
	69 -> "138 | ClC(Cl)(Cl)Cl" [label=""]
	"139 | Cn1cnc(=O)o1" [color=lightgrey shape=box style=filled]
	70 -> "139 | Cn1cnc(=O)o1" [label=""]
	"140 | ClC(Cl)c1ccccc1" [color=lightyellow shape=box style=filled]
	70 -> "140 | ClC(Cl)c1ccccc1" [label=""]
	"141 | Cn1oc(=O)nc1Cc1ccccc1" [color=lightgrey shape=box style=filled]
	71 -> "141 | Cn1oc(=O)nc1Cc1ccccc1" [label=""]
	"142 | ClCl" [color=lightyellow shape=box style=filled]
	71 -> "142 | ClCl" [label=""]
	"143 | Cl" [color=lightyellow shape=box style=filled]
	72 -> "143 | Cl" [label=""]
	"144 | Cn1oc(=O)nc1C(=O)c1ccccc1" [color=lightgrey shape=box style=filled]
	72 -> "144 | Cn1oc(=O)nc1C(=O)c1ccccc1" [label=""]
	"145 | O=c1nc(C(Cl)c2ccccc2)[nH]o1" [color=lightgrey shape=box style=filled]
	73 -> "145 | O=c1nc(C(Cl)c2ccccc2)[nH]o1" [label=""]
	"146 | CI" [color=lightyellow shape=box style=filled]
	73 -> "146 | CI" [label=""]
	"147 | Cn1cnc(=O)o1" [color=lightgrey shape=box style=filled]
	74 -> "147 | Cn1cnc(=O)o1" [label=""]
	"148 | ClC(Br)c1ccccc1" [color=lightgrey shape=box style=filled]
	74 -> "148 | ClC(Br)c1ccccc1" [label=""]
	"149 | Cn1cnc(=O)o1" [color=lightgrey shape=box style=filled]
	75 -> "149 | Cn1cnc(=O)o1" [label=""]
	"150 | O=C(Cl)c1ccccc1" [color=lightyellow shape=box style=filled]
	75 -> "150 | O=C(Cl)c1ccccc1" [label=""]
	"151 | CO" [color=lightyellow shape=box style=filled]
	76 -> "151 | CO" [label=""]
	"152 | O=c1nc(C(Cl)c2ccccc2)[nH]o1" [color=lightgrey shape=box style=filled]
	76 -> "152 | O=c1nc(C(Cl)c2ccccc2)[nH]o1" [label=""]
	"153 | BrCc1ccccc1" [color=lightyellow shape=box style=filled]
	77 -> "153 | BrCc1ccccc1" [label=""]
	"154 | Cn1cnc(=O)o1" [color=lightgrey shape=box style=filled]
	77 -> "154 | Cn1cnc(=O)o1" [label=""]
	"155 | Cl" [color=lightyellow shape=box style=filled]
	77 -> "155 | Cl" [label=""]
	"156 | Cc1cccc(N)n1" [color=lightyellow shape=box style=filled]
	78 -> "156 | Cc1cccc(N)n1" [label=""]
	"157 | CC(C)(C)OC(=O)NO" [color=lightyellow shape=box style=filled]
	78 -> "157 | CC(C)(C)OC(=O)NO" [label=""]
	"158 | Nc1cccc(CO)n1" [color=lightyellow shape=box style=filled]
	79 -> "158 | Nc1cccc(CO)n1" [label=""]
	"159 | CC(C)(C)OC(N)=O" [color=lightyellow shape=box style=filled]
	79 -> "159 | CC(C)(C)OC(N)=O" [label=""]
	"160 | NO" [color=lightyellow shape=box style=filled]
	80 -> "160 | NO" [label=""]
	"161 | Nc1cccc(C=O)n1" [color=lightyellow shape=box style=filled]
	80 -> "161 | Nc1cccc(C=O)n1" [label=""]
	"162 | NO" [color=lightyellow shape=box style=filled]
	81 -> "162 | NO" [label=""]
	"163 | Nc1cccc(CCl)n1" [color=lightyellow shape=box style=filled]
	81 -> "163 | Nc1cccc(CCl)n1" [label=""]
	"164 | NO" [color=lightyellow shape=box style=filled]
	82 -> "164 | NO" [label=""]
	"165 | Nc1cccc(CBr)n1" [color=lightyellow shape=box style=filled]
	82 -> "165 | Nc1cccc(CBr)n1" [label=""]
	"166 | NO" [color=lightyellow shape=box style=filled]
	83 -> "166 | NO" [label=""]
	"167 | Nc1cccc(CO)n1" [color=lightyellow shape=box style=filled]
	83 -> "167 | Nc1cccc(CO)n1" [label=""]
	"168 | NO" [color=lightyellow shape=box style=filled]
	84 -> "168 | NO" [label=""]
	"169 | Nc1cccc(C(=O)O)n1" [color=lightyellow shape=box style=filled]
	84 -> "169 | Nc1cccc(C(=O)O)n1" [label=""]
	"170 | NO" [color=lightyellow shape=box style=filled]
	85 -> "170 | NO" [label=""]
	"171 | Cn1oc(=O)nc1C(=O)c1ccccc1" [color=lightgrey shape=box style=filled]
	85 -> "171 | Cn1oc(=O)nc1C(=O)c1ccccc1" [label=""]
	"172 | O/N=C/c1ccccc1" [color=lightyellow shape=box style=filled]
	86 -> "172 | O/N=C/c1ccccc1" [label=""]
	"173 | Cn1oc(=O)nc1Cl" [color=lightgrey shape=box style=filled]
	86 -> "173 | Cn1oc(=O)nc1Cl" [label=""]
	"174 | Cn1oc(=O)nc1C(O)c1ccccc1" [color=lightgrey shape=box style=filled]
	87 -> "174 | Cn1oc(=O)nc1C(O)c1ccccc1" [label=""]
	"175 | NO" [color=lightyellow shape=box style=filled]
	87 -> "175 | NO" [label=""]
	"176 | O[N+]#Cc1ccccc1" [color=lightgrey shape=box style=filled]
	88 -> "176 | O[N+]#Cc1ccccc1" [label=""]
	"177 | Cn1cnc(=O)o1" [color=lightgrey shape=box style=filled]
	88 -> "177 | Cn1cnc(=O)o1" [label=""]
	"178 | ON=Cc1ccccc1" [color=lightyellow shape=box style=filled]
	89 -> "178 | ON=Cc1ccccc1" [label=""]
	"179 | Cn1cnc(=O)o1" [color=lightgrey shape=box style=filled]
	89 -> "179 | Cn1cnc(=O)o1" [label=""]
	"180 | NO" [color=lightyellow shape=box style=filled]
	90 -> "180 | NO" [label=""]
	"181 | Cn1cnc(=O)o1" [color=lightgrey shape=box style=filled]
	90 -> "181 | Cn1cnc(=O)o1" [label=""]
	"182 | O=Cc1ccccc1" [color=lightyellow shape=box style=filled]
	90 -> "182 | O=Cc1ccccc1" [label=""]
	"183 | Cn1cnc(=O)o1" [color=lightgrey shape=box style=filled]
	91 -> "183 | Cn1cnc(=O)o1" [label=""]
	"184 | ONCc1ccccc1" [color=lightyellow shape=box style=filled]
	91 -> "184 | ONCc1ccccc1" [label=""]
	"185 | NO" [color=lightyellow shape=box style=filled]
	92 -> "185 | NO" [label=""]
	"186 | Cn1oc(=O)nc1C(Cl)c1ccccc1" [color=lightgrey shape=box style=filled]
	92 -> "186 | Cn1oc(=O)nc1C(Cl)c1ccccc1" [label=""]
	"187 | Cn1cnc(=O)o1" [color=lightgrey shape=box style=filled]
	93 -> "187 | Cn1cnc(=O)o1" [label=""]
	"188 | O=C(NO)c1ccccc1" [color=lightyellow shape=box style=filled]
	93 -> "188 | O=C(NO)c1ccccc1" [label=""]
	"189 | Cn1oc(=O)nc1Cc1ccccc1" [color=lightgrey shape=box style=filled]
	94 -> "189 | Cn1oc(=O)nc1Cc1ccccc1" [label=""]
	"190 | CC(C)(C)OC(=O)NO" [color=lightyellow shape=box style=filled]
	94 -> "190 | CC(C)(C)OC(=O)NO" [label=""]
	"191 | N#Cc1ccccc1" [color=lightyellow shape=box style=filled]
	95 -> "191 | N#Cc1ccccc1" [label=""]
	"192 | Cn1cnc(=O)o1" [color=lightgrey shape=box style=filled]
	95 -> "192 | Cn1cnc(=O)o1" [label=""]
	"193 | N" [color=lightyellow shape=box style=filled]
	96 -> "193 | N" [label=""]
	"194 | Cn1oc(=O)nc1C(=O)c1ccccc1" [color=lightgrey shape=box style=filled]
	96 -> "194 | Cn1oc(=O)nc1C(=O)c1ccccc1" [label=""]
	"195 | Cn1oc(=O)nc1C(O)c1ccccc1" [color=lightgrey shape=box style=filled]
	97 -> "195 | Cn1oc(=O)nc1C(O)c1ccccc1" [label=""]
	"196 | N" [color=lightyellow shape=box style=filled]
	97 -> "196 | N" [label=""]
	"197 | Cn1oc(=O)nc1C(Cl)c1ccccc1" [color=lightgrey shape=box style=filled]
	98 -> "197 | Cn1oc(=O)nc1C(Cl)c1ccccc1" [label=""]
	"198 | N" [color=lightyellow shape=box style=filled]
	98 -> "198 | N" [label=""]
	"199 | CI" [color=lightyellow shape=box style=filled]
	99 -> "199 | CI" [label=""]
	"200 | N=C(c1ccccc1)c1nc(=O)o[nH]1" [color=lightgrey shape=box style=filled]
	99 -> "200 | N=C(c1ccccc1)c1nc(=O)o[nH]1" [label=""]
	"201 | Cn1oc(=O)nc1Cc1ccccc1" [color=lightgrey shape=box style=filled]
	100 -> "201 | Cn1oc(=O)nc1Cc1ccccc1" [label=""]
	"202 | N=O" [color=lightgrey shape=box style=filled]
	100 -> "202 | N=O" [label=""]
	"203 | N" [color=lightyellow shape=box style=filled]
	101 -> "203 | N" [label=""]
	"204 | Cn1oc(=O)nc1C(Br)c1ccccc1" [color=lightgrey shape=box style=filled]
	101 -> "204 | Cn1oc(=O)nc1C(Br)c1ccccc1" [label=""]
	"205 | Cn1oc(=O)nc1C(O)c1ccccc1" [color=lightgrey shape=box style=filled]
	102 -> "205 | Cn1oc(=O)nc1C(O)c1ccccc1" [label=""]
	"206 | CC(C)(C)OC(N)=O" [color=lightyellow shape=box style=filled]
	102 -> "206 | CC(C)(C)OC(N)=O" [label=""]
	"207 | Cn1oc(=O)nc1C(Cl)c1ccccc1" [color=lightgrey shape=box style=filled]
	103 -> "207 | Cn1oc(=O)nc1C(Cl)c1ccccc1" [label=""]
	"208 | CC(C)(C)OC(N)=O" [color=lightyellow shape=box style=filled]
	103 -> "208 | CC(C)(C)OC(N)=O" [label=""]
	"209 | Cn1oc(=O)nc1C(O)c1ccccc1" [color=lightgrey shape=box style=filled]
	104 -> "209 | Cn1oc(=O)nc1C(O)c1ccccc1" [label=""]
	"210 | N=O" [color=lightgrey shape=box style=filled]
	104 -> "210 | N=O" [label=""]
	"211 | Nc1cccc(CCl)n1" [color=lightyellow shape=box style=filled]
	105 -> "211 | Nc1cccc(CCl)n1" [label=""]
	"212 | OO" [color=lightyellow shape=box style=filled]
	105 -> "212 | OO" [label=""]
	"213 | OO" [color=lightyellow shape=box style=filled]
	106 -> "213 | OO" [label=""]
	"214 | Nc1cccc(CBr)n1" [color=lightyellow shape=box style=filled]
	106 -> "214 | Nc1cccc(CBr)n1" [label=""]
	"215 | OO" [color=lightyellow shape=box style=filled]
	107 -> "215 | OO" [label=""]
	"216 | Nc1cccc(C=O)n1" [color=lightyellow shape=box style=filled]
	107 -> "216 | Nc1cccc(C=O)n1" [label=""]
	"217 | Nc1cccc(CO)n1" [color=lightyellow shape=box style=filled]
	108 -> "217 | Nc1cccc(CO)n1" [label=""]
	"218 | OO" [color=lightyellow shape=box style=filled]
	108 -> "218 | OO" [label=""]
	"219 | Nc1cccc(Cl)n1" [color=lightyellow shape=box style=filled]
	109 -> "219 | Nc1cccc(Cl)n1" [label=""]
	"220 | COO" [color=lightgrey shape=box style=filled]
	109 -> "220 | COO" [label=""]
	"221 | O=C1CCC(=O)N1Cl" [color=lightyellow shape=box style=filled]
	110 -> "221 | O=C1CCC(=O)N1Cl" [label=""]
	"222 | Cc1cccc(N)n1" [color=lightyellow shape=box style=filled]
	110 -> "222 | Cc1cccc(N)n1" [label=""]
	"223 | OO" [color=lightyellow shape=box style=filled]
	110 -> "223 | OO" [label=""]
	"224 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	111 -> "224 | O=C1CCC(=O)N1Br" [label=""]
	"225 | Cc1cccc(N)n1" [color=lightyellow shape=box style=filled]
	111 -> "225 | Cc1cccc(N)n1" [label=""]
	"226 | OO" [color=lightyellow shape=box style=filled]
	111 -> "226 | OO" [label=""]
	"227 | [C]c1cccc(N)n1" [color=lightgrey shape=box style=filled]
	112 -> "227 | [C]c1cccc(N)n1" [label=""]
	"228 | [O]O" [color=lightyellow shape=box style=filled]
	112 -> "228 | [O]O" [label=""]
	"229 | O=O" [color=lightgrey shape=box style=filled]
	113 -> "229 | O=O" [label=""]
	"230 | Nc1cccc(CCl)n1" [color=lightyellow shape=box style=filled]
	113 -> "230 | Nc1cccc(CCl)n1" [label=""]
	"231 | O=O" [color=lightgrey shape=box style=filled]
	114 -> "231 | O=O" [label=""]
	"232 | Nc1cccc(CBr)n1" [color=lightyellow shape=box style=filled]
	114 -> "232 | Nc1cccc(CBr)n1" [label=""]
	"233 | Cc1cccc(N)n1" [color=lightyellow shape=box style=filled]
	115 -> "233 | Cc1cccc(N)n1" [label=""]
	"234 | CC(C)(C)OC(=O)NO" [color=lightyellow shape=box style=filled]
	115 -> "234 | CC(C)(C)OC(=O)NO" [label=""]
	"235 | Nc1cccc(CO)n1" [color=lightyellow shape=box style=filled]
	116 -> "235 | Nc1cccc(CO)n1" [label=""]
	"236 | CC(C)(C)OC(N)=O" [color=lightyellow shape=box style=filled]
	116 -> "236 | CC(C)(C)OC(N)=O" [label=""]
	"237 | NO" [color=lightyellow shape=box style=filled]
	117 -> "237 | NO" [label=""]
	"238 | Nc1cccc(C=O)n1" [color=lightyellow shape=box style=filled]
	117 -> "238 | Nc1cccc(C=O)n1" [label=""]
	"239 | NO" [color=lightyellow shape=box style=filled]
	118 -> "239 | NO" [label=""]
	"240 | Nc1cccc(CCl)n1" [color=lightyellow shape=box style=filled]
	118 -> "240 | Nc1cccc(CCl)n1" [label=""]
	"241 | NO" [color=lightyellow shape=box style=filled]
	119 -> "241 | NO" [label=""]
	"242 | Nc1cccc(CBr)n1" [color=lightyellow shape=box style=filled]
	119 -> "242 | Nc1cccc(CBr)n1" [label=""]
	"243 | NO" [color=lightyellow shape=box style=filled]
	120 -> "243 | NO" [label=""]
	"244 | Nc1cccc(CO)n1" [color=lightyellow shape=box style=filled]
	120 -> "244 | Nc1cccc(CO)n1" [label=""]
	"245 | NO" [color=lightyellow shape=box style=filled]
	121 -> "245 | NO" [label=""]
	"246 | Nc1cccc(C(=O)O)n1" [color=lightyellow shape=box style=filled]
	121 -> "246 | Nc1cccc(C(=O)O)n1" [label=""]
	"247 | Cn1cnc(=O)o1" [color=lightgrey shape=box style=filled]
	122 -> "247 | Cn1cnc(=O)o1" [label=""]
	"248 | O=C(Cl)c1ccccc1" [color=lightyellow shape=box style=filled]
	122 -> "248 | O=C(Cl)c1ccccc1" [label=""]
	"249 | Cn1cnc(=O)o1" [color=lightgrey shape=box style=filled]
	123 -> "249 | Cn1cnc(=O)o1" [label=""]
	"250 | O=C(O)c1ccccc1" [color=lightyellow shape=box style=filled]
	123 -> "250 | O=C(O)c1ccccc1" [label=""]
	"251 | O[B]O" [color=lightgrey shape=box style=filled]
	124 -> "251 | O[B]O" [label=""]
	"252 | CC1(C)OB(c2ccc(Br)c(Br)c2)OC1(C)C" [color=lightyellow shape=box style=filled]
	124 -> "252 | CC1(C)OB(c2ccc(Br)c(Br)c2)OC1(C)C" [label=""]
	"253 | Cn1c(C(=O)Cl)nc(=O)[o+]1Cl" [color=lightgrey shape=box style=filled]
	124 -> "253 | Cn1c(C(=O)Cl)nc(=O)[o+]1Cl" [label=""]
	"254 | Cn1oc(=O)nc1C(=O)Cl" [color=lightgrey shape=box style=filled]
	125 -> "254 | Cn1oc(=O)nc1C(=O)Cl" [label=""]
	"255 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	125 -> "255 | O=C1CCC(=O)N1Br" [label=""]
	"256 | OB(O)c1ccc(Br)c(Cl)c1" [color=lightyellow shape=box style=filled]
	125 -> "256 | OB(O)c1ccc(Br)c(Cl)c1" [label=""]
	126 [color=aquamarine shape=rarrow style=filled]
	"34 | Cn1cnc(=O)o1" -> 126 [label=0.000]
	127 [color=aquamarine shape=rarrow style=filled]
	"34 | Cn1cnc(=O)o1" -> 127 [label=0.000]
	128 [color=lightblue shape=rarrow style=filled]
	"34 | Cn1cnc(=O)o1" -> 128 [label=0.000]
	129 [color=aquamarine shape=rarrow style=filled]
	"34 | Cn1cnc(=O)o1" -> 129 [label=0.000]
	130 [color=aquamarine shape=rarrow style=filled]
	"34 | Cn1cnc(=O)o1" -> 130 [label=0.000]
	131 [color=aquamarine shape=rarrow style=filled]
	"34 | Cn1cnc(=O)o1" -> 131 [label=0.000]
	132 [color=aquamarine shape=rarrow style=filled]
	"34 | Cn1cnc(=O)o1" -> 132 [label=0.000]
	133 [color=aquamarine shape=rarrow style=filled]
	"34 | Cn1cnc(=O)o1" -> 133 [label=0.000]
	134 [color=aquamarine shape=rarrow style=filled]
	"34 | Cn1cnc(=O)o1" -> 134 [label=0.000]
	135 [color=aquamarine shape=rarrow style=filled]
	"34 | Cn1cnc(=O)o1" -> 135 [label=0.000]
	"257 | O=c1nc[nH]o1" [color=lightgrey shape=box style=filled]
	126 -> "257 | O=c1nc[nH]o1" [label=""]
	"258 | CI" [color=lightyellow shape=box style=filled]
	126 -> "258 | CI" [label=""]
	"259 | O=c1nc[nH]o1" [color=lightgrey shape=box style=filled]
	127 -> "259 | O=c1nc[nH]o1" [label=""]
	"260 | CO" [color=lightyellow shape=box style=filled]
	127 -> "260 | CO" [label=""]
	"261 | CNC=O" [color=lightyellow shape=box style=filled]
	128 -> "261 | CNC=O" [label=""]
	"262 | NC(=O)O" [color=lightyellow shape=box style=filled]
	128 -> "262 | NC(=O)O" [label=""]
	"263 | CN(C=N)OC(=O)Cl" [color=lightgrey shape=box style=filled]
	129 -> "263 | CN(C=N)OC(=O)Cl" [label=""]
	"264 | CN(O)C=NC(=O)O" [color=lightgrey shape=box style=filled]
	130 -> "264 | CN(O)C=NC(=O)O" [label=""]
	"265 | O=c1nc[nH]o1" [color=lightgrey shape=box style=filled]
	131 -> "265 | O=c1nc[nH]o1" [label=""]
	"266 | C=O" [color=lightyellow shape=box style=filled]
	131 -> "266 | C=O" [label=""]
	"267 | CN1C=NCO1" [color=lightgrey shape=box style=filled]
	132 -> "267 | CN1C=NCO1" [label=""]
	"268 | O=C(OO)c1cccc(Cl)c1" [color=lightyellow shape=box style=filled]
	132 -> "268 | O=C(OO)c1cccc(Cl)c1" [label=""]
	"269 | CN(O)C=NC(=O)Cl" [color=lightgrey shape=box style=filled]
	133 -> "269 | CN(O)C=NC(=O)Cl" [label=""]
	"270 | CN(C=N)OC(=O)O" [color=lightgrey shape=box style=filled]
	134 -> "270 | CN(C=N)OC(=O)O" [label=""]
	"271 | CN(C=N)OC(=O)Br" [color=lightgrey shape=box style=filled]
	135 -> "271 | CN(C=N)OC(=O)Br" [label=""]
}
