digraph G {
	rankdir=LR
	node [shape=box]
	"1 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" [color=lightblue shape=box style=filled]
	1 [color=lightblue shape=rarrow style=filled]
	"1 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 1 [label=0.000]
	2 [color=aquamarine shape=rarrow style=filled]
	"1 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 2 [label=0.000]
	3 [color=aquamarine shape=rarrow style=filled]
	"1 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 3 [label=0.000]
	4 [color=aquamarine shape=rarrow style=filled]
	"1 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 4 [label=0.000]
	5 [color=aquamarine shape=rarrow style=filled]
	"1 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 5 [label=0.000]
	6 [color=aquamarine shape=rarrow style=filled]
	"1 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 6 [label=0.000]
	7 [color=aquamarine shape=rarrow style=filled]
	"1 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 7 [label=0.000]
	8 [color=aquamarine shape=rarrow style=filled]
	"1 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 8 [label=0.000]
	9 [color=aquamarine shape=rarrow style=filled]
	"1 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 9 [label=0.000]
	10 [color=aquamarine shape=rarrow style=filled]
	"1 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 10 [label=0.000]
	"2 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" [color=lightblue shape=box style=filled]
	1 -> "2 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" [label=""]
	"3 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1B(O)O" [color=lightyellow shape=box style=filled]
	1 -> "3 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1B(O)O" [label=""]
	"4 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1Br" [color=lightyellow shape=box style=filled]
	2 -> "4 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1Br" [label=""]
	"5 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" [color=aquamarine shape=box style=filled]
	2 -> "5 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" [label=""]
	"6 | Nc1ccon1" [color=lightyellow shape=box style=filled]
	3 -> "6 | Nc1ccon1" [label=""]
	"7 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1-c1nncc2cc(S(=O)(=O)Cl)ccc12" [color=aquamarine shape=box style=filled]
	3 -> "7 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1-c1nncc2cc(S(=O)(=O)Cl)ccc12" [label=""]
	"8 | Nc1ccon1" [color=lightyellow shape=box style=filled]
	4 -> "8 | Nc1ccon1" [label=""]
	"9 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1-c1nncc2cc(S(=O)(=O)O)ccc12" [color=aquamarine shape=box style=filled]
	4 -> "9 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1-c1nncc2cc(S(=O)(=O)O)ccc12" [label=""]
	"10 | OB(O)c1cccc(C(F)(F)F)c1" [color=lightyellow shape=box style=filled]
	5 -> "10 | OB(O)c1cccc(C(F)(F)F)c1" [label=""]
	"11 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" [color=aquamarine shape=box style=filled]
	5 -> "11 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" [label=""]
	"12 | OB(O)c1cccc(C(F)(F)F)c1" [color=lightyellow shape=box style=filled]
	6 -> "12 | OB(O)c1cccc(C(F)(F)F)c1" [label=""]
	"13 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" [color=aquamarine shape=box style=filled]
	6 -> "13 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" [label=""]
	"14 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" [color=aquamarine shape=box style=filled]
	7 -> "14 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" [label=""]
	"15 | COc1ccc(F)c(-c2cccc(C(F)(F)F)c2)c1" [color=lightyellow shape=box style=filled]
	7 -> "15 | COc1ccc(F)c(-c2cccc(C(F)(F)F)c2)c1" [label=""]
	"16 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1Br" [color=lightyellow shape=box style=filled]
	8 -> "16 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1Br" [label=""]
	"17 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" [color=aquamarine shape=box style=filled]
	8 -> "17 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" [label=""]
	"18 | FC(F)(F)c1cccc(Br)c1" [color=lightyellow shape=box style=filled]
	9 -> "18 | FC(F)(F)c1cccc(Br)c1" [label=""]
	"19 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" [color=aquamarine shape=box style=filled]
	9 -> "19 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" [label=""]
	"20 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1I" [color=lightyellow shape=box style=filled]
	10 -> "20 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1I" [label=""]
	"21 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" [color=aquamarine shape=box style=filled]
	10 -> "21 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" [label=""]
	11 [color=aquamarine shape=rarrow style=filled]
	"2 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" -> 11 [label=0.000]
	12 [color=lightblue shape=rarrow style=filled]
	"2 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" -> 12 [label=0.000]
	13 [color=aquamarine shape=rarrow style=filled]
	"5 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" -> 13 [label=0.000]
	14 [color=aquamarine shape=rarrow style=filled]
	"5 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" -> 14 [label=0.000]
	15 [color=aquamarine shape=rarrow style=filled]
	"7 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1-c1nncc2cc(S(=O)(=O)Cl)ccc12" -> 15 [label=0.000]
	16 [color=aquamarine shape=rarrow style=filled]
	"7 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1-c1nncc2cc(S(=O)(=O)Cl)ccc12" -> 16 [label=0.000]
	17 [color=aquamarine shape=rarrow style=filled]
	"7 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1-c1nncc2cc(S(=O)(=O)Cl)ccc12" -> 17 [label=0.000]
	18 [color=aquamarine shape=rarrow style=filled]
	"7 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1-c1nncc2cc(S(=O)(=O)Cl)ccc12" -> 18 [label=0.000]
	19 [color=aquamarine shape=rarrow style=filled]
	"7 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1-c1nncc2cc(S(=O)(=O)Cl)ccc12" -> 19 [label=0.000]
	20 [color=aquamarine shape=rarrow style=filled]
	"7 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1-c1nncc2cc(S(=O)(=O)Cl)ccc12" -> 20 [label=0.000]
	21 [color=aquamarine shape=rarrow style=filled]
	"7 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1-c1nncc2cc(S(=O)(=O)Cl)ccc12" -> 21 [label=0.000]
	22 [color=aquamarine shape=rarrow style=filled]
	"7 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1-c1nncc2cc(S(=O)(=O)Cl)ccc12" -> 22 [label=0.000]
	23 [color=aquamarine shape=rarrow style=filled]
	"7 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1-c1nncc2cc(S(=O)(=O)Cl)ccc12" -> 23 [label=0.000]
	24 [color=aquamarine shape=rarrow style=filled]
	"7 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1-c1nncc2cc(S(=O)(=O)Cl)ccc12" -> 24 [label=0.000]
	25 [color=aquamarine shape=rarrow style=filled]
	"9 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1-c1nncc2cc(S(=O)(=O)O)ccc12" -> 25 [label=0.000]
	26 [color=aquamarine shape=rarrow style=filled]
	"9 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1-c1nncc2cc(S(=O)(=O)O)ccc12" -> 26 [label=0.000]
	27 [color=aquamarine shape=rarrow style=filled]
	"9 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1-c1nncc2cc(S(=O)(=O)O)ccc12" -> 27 [label=0.000]
	28 [color=aquamarine shape=rarrow style=filled]
	"9 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1-c1nncc2cc(S(=O)(=O)O)ccc12" -> 28 [label=0.000]
	29 [color=aquamarine shape=rarrow style=filled]
	"9 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1-c1nncc2cc(S(=O)(=O)O)ccc12" -> 29 [label=0.000]
	30 [color=aquamarine shape=rarrow style=filled]
	"9 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1-c1nncc2cc(S(=O)(=O)O)ccc12" -> 30 [label=0.000]
	31 [color=aquamarine shape=rarrow style=filled]
	"9 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1-c1nncc2cc(S(=O)(=O)O)ccc12" -> 31 [label=0.000]
	32 [color=aquamarine shape=rarrow style=filled]
	"9 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1-c1nncc2cc(S(=O)(=O)O)ccc12" -> 32 [label=0.000]
	33 [color=aquamarine shape=rarrow style=filled]
	"9 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1-c1nncc2cc(S(=O)(=O)O)ccc12" -> 33 [label=0.000]
	34 [color=aquamarine shape=rarrow style=filled]
	"9 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1-c1nncc2cc(S(=O)(=O)O)ccc12" -> 34 [label=0.000]
	35 [color=aquamarine shape=rarrow style=filled]
	"11 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 35 [label=0.000]
	36 [color=aquamarine shape=rarrow style=filled]
	"11 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 36 [label=0.000]
	37 [color=aquamarine shape=rarrow style=filled]
	"11 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 37 [label=0.000]
	38 [color=aquamarine shape=rarrow style=filled]
	"11 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 38 [label=0.000]
	39 [color=aquamarine shape=rarrow style=filled]
	"11 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 39 [label=0.000]
	40 [color=aquamarine shape=rarrow style=filled]
	"11 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 40 [label=0.000]
	41 [color=aquamarine shape=rarrow style=filled]
	"11 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 41 [label=0.000]
	42 [color=aquamarine shape=rarrow style=filled]
	"11 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 42 [label=0.000]
	43 [color=aquamarine shape=rarrow style=filled]
	"11 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 43 [label=0.000]
	44 [color=aquamarine shape=rarrow style=filled]
	"11 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 44 [label=0.000]
	45 [color=aquamarine shape=rarrow style=filled]
	"13 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 45 [label=0.000]
	46 [color=aquamarine shape=rarrow style=filled]
	"13 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 46 [label=0.000]
	47 [color=aquamarine shape=rarrow style=filled]
	"13 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 47 [label=0.000]
	48 [color=aquamarine shape=rarrow style=filled]
	"13 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 48 [label=0.000]
	49 [color=aquamarine shape=rarrow style=filled]
	"13 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 49 [label=0.000]
	50 [color=aquamarine shape=rarrow style=filled]
	"13 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 50 [label=0.000]
	51 [color=aquamarine shape=rarrow style=filled]
	"13 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 51 [label=0.000]
	52 [color=aquamarine shape=rarrow style=filled]
	"13 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 52 [label=0.000]
	53 [color=aquamarine shape=rarrow style=filled]
	"13 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 53 [label=0.000]
	54 [color=aquamarine shape=rarrow style=filled]
	"13 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 54 [label=0.000]
	55 [color=aquamarine shape=rarrow style=filled]
	"14 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" -> 55 [label=0.000]
	56 [color=aquamarine shape=rarrow style=filled]
	"14 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" -> 56 [label=0.000]
	57 [color=aquamarine shape=rarrow style=filled]
	"17 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" -> 57 [label=0.000]
	58 [color=aquamarine shape=rarrow style=filled]
	"17 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" -> 58 [label=0.000]
	59 [color=aquamarine shape=rarrow style=filled]
	"19 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 59 [label=0.000]
	60 [color=aquamarine shape=rarrow style=filled]
	"19 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 60 [label=0.000]
	61 [color=aquamarine shape=rarrow style=filled]
	"19 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 61 [label=0.000]
	62 [color=aquamarine shape=rarrow style=filled]
	"19 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 62 [label=0.000]
	63 [color=aquamarine shape=rarrow style=filled]
	"19 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 63 [label=0.000]
	64 [color=aquamarine shape=rarrow style=filled]
	"19 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 64 [label=0.000]
	65 [color=aquamarine shape=rarrow style=filled]
	"19 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 65 [label=0.000]
	66 [color=aquamarine shape=rarrow style=filled]
	"19 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 66 [label=0.000]
	67 [color=aquamarine shape=rarrow style=filled]
	"19 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 67 [label=0.000]
	68 [color=aquamarine shape=rarrow style=filled]
	"19 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Nc3ccon3)ccc12" -> 68 [label=0.000]
	69 [color=aquamarine shape=rarrow style=filled]
	"21 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" -> 69 [label=0.000]
	70 [color=aquamarine shape=rarrow style=filled]
	"21 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" -> 70 [label=0.000]
	"22 | O=S(=O)(Cl)c1ccc2c(Br)nncc2c1" [color=aquamarine shape=box style=filled]
	11 -> "22 | O=S(=O)(Cl)c1ccc2c(Br)nncc2c1" [label=""]
	"23 | Nc1ccon1" [color=lightyellow shape=box style=filled]
	11 -> "23 | Nc1ccon1" [label=""]
	"24 | O=S(=O)(O)c1ccc2c(Br)nncc2c1" [color=lightblue shape=box style=filled]
	12 -> "24 | O=S(=O)(O)c1ccc2c(Br)nncc2c1" [label=""]
	"25 | Nc1ccon1" [color=lightyellow shape=box style=filled]
	12 -> "25 | Nc1ccon1" [label=""]
	"26 | O=S(=O)(Cl)c1ccc2c(Br)nncc2c1" [color=lightgrey shape=box style=filled]
	13 -> "26 | O=S(=O)(Cl)c1ccc2c(Br)nncc2c1" [label=""]
	"27 | Nc1ccon1" [color=lightyellow shape=box style=filled]
	13 -> "27 | Nc1ccon1" [label=""]
	"28 | O=S(=O)(O)c1ccc2c(Br)nncc2c1" [color=lightgrey shape=box style=filled]
	14 -> "28 | O=S(=O)(O)c1ccc2c(Br)nncc2c1" [label=""]
	"29 | Nc1ccon1" [color=lightyellow shape=box style=filled]
	14 -> "29 | Nc1ccon1" [label=""]
	"30 | O=S(=O)(Cl)c1ccc2c(Br)nncc2c1" [color=lightgrey shape=box style=filled]
	15 -> "30 | O=S(=O)(Cl)c1ccc2c(Br)nncc2c1" [label=""]
	"31 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1Br" [color=lightyellow shape=box style=filled]
	15 -> "31 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1Br" [label=""]
	"32 | O=S(=O)(Cl)c1ccc2c(Br)nncc2c1" [color=lightgrey shape=box style=filled]
	16 -> "32 | O=S(=O)(Cl)c1ccc2c(Br)nncc2c1" [label=""]
	"33 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1B(O)O" [color=lightyellow shape=box style=filled]
	16 -> "33 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1B(O)O" [label=""]
	"34 | O=S(=O)(Cl)c1ccc2c(Br)nncc2c1" [color=lightgrey shape=box style=filled]
	17 -> "34 | O=S(=O)(Cl)c1ccc2c(Br)nncc2c1" [label=""]
	"35 | COc1ccc(F)c(-c2cccc(C(F)(F)F)c2)c1" [color=lightyellow shape=box style=filled]
	17 -> "35 | COc1ccc(F)c(-c2cccc(C(F)(F)F)c2)c1" [label=""]
	"36 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Cl)ccc12" [color=lightgrey shape=box style=filled]
	18 -> "36 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Cl)ccc12" [label=""]
	"37 | OB(O)c1cccc(C(F)(F)F)c1" [color=lightyellow shape=box style=filled]
	18 -> "37 | OB(O)c1cccc(C(F)(F)F)c1" [label=""]
	"38 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1Br" [color=lightyellow shape=box style=filled]
	19 -> "38 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1Br" [label=""]
	"39 | O=S(=O)(Cl)c1ccc2cnncc2c1" [color=lightgrey shape=box style=filled]
	19 -> "39 | O=S(=O)(Cl)c1ccc2cnncc2c1" [label=""]
	"40 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Cl)ccc12" [color=lightgrey shape=box style=filled]
	20 -> "40 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Cl)ccc12" [label=""]
	"41 | OB(O)c1cccc(C(F)(F)F)c1" [color=lightyellow shape=box style=filled]
	20 -> "41 | OB(O)c1cccc(C(F)(F)F)c1" [label=""]
	"42 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1I" [color=lightyellow shape=box style=filled]
	21 -> "42 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1I" [label=""]
	"43 | O=S(=O)(Cl)c1ccc2c(Br)nncc2c1" [color=lightgrey shape=box style=filled]
	21 -> "43 | O=S(=O)(Cl)c1ccc2c(Br)nncc2c1" [label=""]
	"44 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1Br" [color=lightyellow shape=box style=filled]
	22 -> "44 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1Br" [label=""]
	"45 | O=S(=O)(Cl)c1ccc2c(Cl)nncc2c1" [color=lightgrey shape=box style=filled]
	22 -> "45 | O=S(=O)(Cl)c1ccc2c(Cl)nncc2c1" [label=""]
	"46 | O=S(=O)(Cl)c1ccc2c(Cl)nncc2c1" [color=lightgrey shape=box style=filled]
	23 -> "46 | O=S(=O)(Cl)c1ccc2c(Cl)nncc2c1" [label=""]
	"47 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1B(O)O" [color=lightyellow shape=box style=filled]
	23 -> "47 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1B(O)O" [label=""]
	"48 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Cl)ccc12" [color=lightgrey shape=box style=filled]
	24 -> "48 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Cl)ccc12" [label=""]
	"49 | FC(F)(F)c1cccc(Br)c1" [color=lightyellow shape=box style=filled]
	24 -> "49 | FC(F)(F)c1cccc(Br)c1" [label=""]
	"50 | O=S(=O)(O)c1ccc2c(Br)nncc2c1" [color=lightgrey shape=box style=filled]
	25 -> "50 | O=S(=O)(O)c1ccc2c(Br)nncc2c1" [label=""]
	"51 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1Br" [color=lightyellow shape=box style=filled]
	25 -> "51 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1Br" [label=""]
	"52 | O=S(=O)(O)c1ccc2c(Br)nncc2c1" [color=lightgrey shape=box style=filled]
	26 -> "52 | O=S(=O)(O)c1ccc2c(Br)nncc2c1" [label=""]
	"53 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1B(O)O" [color=lightyellow shape=box style=filled]
	26 -> "53 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1B(O)O" [label=""]
	"54 | OB(O)c1cccc(C(F)(F)F)c1" [color=lightyellow shape=box style=filled]
	27 -> "54 | OB(O)c1cccc(C(F)(F)F)c1" [label=""]
	"55 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)O)ccc12" [color=lightgrey shape=box style=filled]
	27 -> "55 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)O)ccc12" [label=""]
	"56 | O=S(=O)(O)c1ccc2c(Br)nncc2c1" [color=lightgrey shape=box style=filled]
	28 -> "56 | O=S(=O)(O)c1ccc2c(Br)nncc2c1" [label=""]
	"57 | COc1ccc(F)c(-c2cccc(C(F)(F)F)c2)c1" [color=lightyellow shape=box style=filled]
	28 -> "57 | COc1ccc(F)c(-c2cccc(C(F)(F)F)c2)c1" [label=""]
	"58 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1Br" [color=lightyellow shape=box style=filled]
	29 -> "58 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1Br" [label=""]
	"59 | O=S(=O)(O)c1ccc2cnncc2c1" [color=lightgrey shape=box style=filled]
	29 -> "59 | O=S(=O)(O)c1ccc2cnncc2c1" [label=""]
	"60 | OB(O)c1cccc(C(F)(F)F)c1" [color=lightyellow shape=box style=filled]
	30 -> "60 | OB(O)c1cccc(C(F)(F)F)c1" [label=""]
	"61 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)O)ccc12" [color=lightgrey shape=box style=filled]
	30 -> "61 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)O)ccc12" [label=""]
	"62 | O=S(=O)(O)c1ccc2c(Br)nncc2c1" [color=lightgrey shape=box style=filled]
	31 -> "62 | O=S(=O)(O)c1ccc2c(Br)nncc2c1" [label=""]
	"63 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1Br" [color=lightyellow shape=box style=filled]
	31 -> "63 | COc1cc(-c2cccc(C(F)(F)F)c2)c(F)cc1Br" [label=""]
	"64 | FC(F)(F)c1cccc(Br)c1" [color=lightyellow shape=box style=filled]
	32 -> "64 | FC(F)(F)c1cccc(Br)c1" [label=""]
	"65 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)O)ccc12" [color=lightgrey shape=box style=filled]
	32 -> "65 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)O)ccc12" [label=""]
	"66 | FC(F)(F)c1cccc(Br)c1" [color=lightyellow shape=box style=filled]
	33 -> "66 | FC(F)(F)c1cccc(Br)c1" [label=""]
	"67 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)O)ccc12" [color=lightgrey shape=box style=filled]
	33 -> "67 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)O)ccc12" [label=""]
	"68 | FC(F)(F)c1cccc(I)c1" [color=lightyellow shape=box style=filled]
	34 -> "68 | FC(F)(F)c1cccc(I)c1" [label=""]
	"69 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)O)ccc12" [color=lightgrey shape=box style=filled]
	34 -> "69 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)O)ccc12" [label=""]
	"70 | COc1cc(Br)c(F)cc1Br" [color=lightyellow shape=box style=filled]
	35 -> "70 | COc1cc(Br)c(F)cc1Br" [label=""]
	"71 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" [color=lightgrey shape=box style=filled]
	35 -> "71 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" [label=""]
	"72 | COc1cc(Br)c(F)cc1B(O)O" [color=lightyellow shape=box style=filled]
	36 -> "72 | COc1cc(Br)c(F)cc1B(O)O" [label=""]
	"73 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" [color=lightgrey shape=box style=filled]
	36 -> "73 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" [label=""]
	"74 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Cl)ccc12" [color=lightgrey shape=box style=filled]
	37 -> "74 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Cl)ccc12" [label=""]
	"75 | Nc1ccon1" [color=lightyellow shape=box style=filled]
	37 -> "75 | Nc1ccon1" [label=""]
	"76 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)O)ccc12" [color=lightgrey shape=box style=filled]
	38 -> "76 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)O)ccc12" [label=""]
	"77 | Nc1ccon1" [color=lightyellow shape=box style=filled]
	38 -> "77 | Nc1ccon1" [label=""]
	"78 | COc1cc(Br)c(F)cc1Br" [color=lightyellow shape=box style=filled]
	39 -> "78 | COc1cc(Br)c(F)cc1Br" [label=""]
	"79 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" [color=lightgrey shape=box style=filled]
	39 -> "79 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" [label=""]
	"80 | COc1ccc(F)c(Br)c1" [color=lightyellow shape=box style=filled]
	40 -> "80 | COc1ccc(F)c(Br)c1" [label=""]
	"81 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" [color=lightgrey shape=box style=filled]
	40 -> "81 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" [label=""]
	"82 | COc1cc(Br)c(F)cc1Br" [color=lightyellow shape=box style=filled]
	41 -> "82 | COc1cc(Br)c(F)cc1Br" [label=""]
	"83 | O=S(=O)(Nc1ccon1)c1ccc2cnncc2c1" [color=lightgrey shape=box style=filled]
	41 -> "83 | O=S(=O)(Nc1ccon1)c1ccc2cnncc2c1" [label=""]
	"84 | O=[S](=O)O" [color=lightgrey shape=box style=filled]
	42 -> "84 | O=[S](=O)O" [label=""]
	"85 | COc1cc(Br)c(F)cc1-c1nncc2ccccc12" [color=lightgrey shape=box style=filled]
	42 -> "85 | COc1cc(Br)c(F)cc1-c1nncc2ccccc12" [label=""]
	"86 | Nc1ccon1" [color=lightyellow shape=box style=filled]
	42 -> "86 | Nc1ccon1" [label=""]
	"87 | COc1cc(Br)c(F)cc1-c1nncc2ccccc12" [color=lightgrey shape=box style=filled]
	43 -> "87 | COc1cc(Br)c(F)cc1-c1nncc2ccccc12" [label=""]
	"88 | Nc1ccon1" [color=lightyellow shape=box style=filled]
	43 -> "88 | Nc1ccon1" [label=""]
	"89 | O=[S](=O)Cl" [color=lightgrey shape=box style=filled]
	43 -> "89 | O=[S](=O)Cl" [label=""]
	"90 | O=S=O" [color=lightyellow shape=box style=filled]
	44 -> "90 | O=S=O" [label=""]
	"91 | COc1cc(Br)c(F)cc1-c1nncc2cc(Br)ccc12" [color=lightgrey shape=box style=filled]
	44 -> "91 | COc1cc(Br)c(F)cc1-c1nncc2cc(Br)ccc12" [label=""]
	"92 | Nc1ccon1" [color=lightyellow shape=box style=filled]
	44 -> "92 | Nc1ccon1" [label=""]
	"93 | COc1cc(Br)c(F)cc1Br" [color=lightyellow shape=box style=filled]
	45 -> "93 | COc1cc(Br)c(F)cc1Br" [label=""]
	"94 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" [color=lightgrey shape=box style=filled]
	45 -> "94 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" [label=""]
	"95 | COc1cc(Br)c(F)cc1B(O)O" [color=lightyellow shape=box style=filled]
	46 -> "95 | COc1cc(Br)c(F)cc1B(O)O" [label=""]
	"96 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" [color=lightgrey shape=box style=filled]
	46 -> "96 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" [label=""]
	"97 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Cl)ccc12" [color=lightgrey shape=box style=filled]
	47 -> "97 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Cl)ccc12" [label=""]
	"98 | Nc1ccon1" [color=lightyellow shape=box style=filled]
	47 -> "98 | Nc1ccon1" [label=""]
	"99 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)O)ccc12" [color=lightgrey shape=box style=filled]
	48 -> "99 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)O)ccc12" [label=""]
	"100 | Nc1ccon1" [color=lightyellow shape=box style=filled]
	48 -> "100 | Nc1ccon1" [label=""]
	"101 | COc1cc(Br)c(F)cc1Br" [color=lightyellow shape=box style=filled]
	49 -> "101 | COc1cc(Br)c(F)cc1Br" [label=""]
	"102 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" [color=lightgrey shape=box style=filled]
	49 -> "102 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" [label=""]
	"103 | COc1ccc(F)c(Br)c1" [color=lightyellow shape=box style=filled]
	50 -> "103 | COc1ccc(F)c(Br)c1" [label=""]
	"104 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" [color=lightgrey shape=box style=filled]
	50 -> "104 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" [label=""]
	"105 | COc1cc(Br)c(F)cc1Br" [color=lightyellow shape=box style=filled]
	51 -> "105 | COc1cc(Br)c(F)cc1Br" [label=""]
	"106 | O=S(=O)(Nc1ccon1)c1ccc2cnncc2c1" [color=lightgrey shape=box style=filled]
	51 -> "106 | O=S(=O)(Nc1ccon1)c1ccc2cnncc2c1" [label=""]
	"107 | O=[S](=O)O" [color=lightgrey shape=box style=filled]
	52 -> "107 | O=[S](=O)O" [label=""]
	"108 | COc1cc(Br)c(F)cc1-c1nncc2ccccc12" [color=lightgrey shape=box style=filled]
	52 -> "108 | COc1cc(Br)c(F)cc1-c1nncc2ccccc12" [label=""]
	"109 | Nc1ccon1" [color=lightyellow shape=box style=filled]
	52 -> "109 | Nc1ccon1" [label=""]
	"110 | COc1cc(Br)c(F)cc1-c1nncc2ccccc12" [color=lightgrey shape=box style=filled]
	53 -> "110 | COc1cc(Br)c(F)cc1-c1nncc2ccccc12" [label=""]
	"111 | Nc1ccon1" [color=lightyellow shape=box style=filled]
	53 -> "111 | Nc1ccon1" [label=""]
	"112 | O=[S](=O)Cl" [color=lightgrey shape=box style=filled]
	53 -> "112 | O=[S](=O)Cl" [label=""]
	"113 | O=S=O" [color=lightyellow shape=box style=filled]
	54 -> "113 | O=S=O" [label=""]
	"114 | COc1cc(Br)c(F)cc1-c1nncc2cc(Br)ccc12" [color=lightgrey shape=box style=filled]
	54 -> "114 | COc1cc(Br)c(F)cc1-c1nncc2cc(Br)ccc12" [label=""]
	"115 | Nc1ccon1" [color=lightyellow shape=box style=filled]
	54 -> "115 | Nc1ccon1" [label=""]
	"116 | O=S(=O)(Cl)c1ccc2c(Br)nncc2c1" [color=lightgrey shape=box style=filled]
	55 -> "116 | O=S(=O)(Cl)c1ccc2c(Br)nncc2c1" [label=""]
	"117 | Nc1ccon1" [color=lightyellow shape=box style=filled]
	55 -> "117 | Nc1ccon1" [label=""]
	"118 | O=S(=O)(O)c1ccc2c(Br)nncc2c1" [color=lightgrey shape=box style=filled]
	56 -> "118 | O=S(=O)(O)c1ccc2c(Br)nncc2c1" [label=""]
	"119 | Nc1ccon1" [color=lightyellow shape=box style=filled]
	56 -> "119 | Nc1ccon1" [label=""]
	"120 | O=S(=O)(Cl)c1ccc2c(Br)nncc2c1" [color=lightgrey shape=box style=filled]
	57 -> "120 | O=S(=O)(Cl)c1ccc2c(Br)nncc2c1" [label=""]
	"121 | Nc1ccon1" [color=lightyellow shape=box style=filled]
	57 -> "121 | Nc1ccon1" [label=""]
	"122 | O=S(=O)(O)c1ccc2c(Br)nncc2c1" [color=lightgrey shape=box style=filled]
	58 -> "122 | O=S(=O)(O)c1ccc2c(Br)nncc2c1" [label=""]
	"123 | Nc1ccon1" [color=lightyellow shape=box style=filled]
	58 -> "123 | Nc1ccon1" [label=""]
	"124 | COc1cc(Br)c(F)cc1Br" [color=lightyellow shape=box style=filled]
	59 -> "124 | COc1cc(Br)c(F)cc1Br" [label=""]
	"125 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" [color=lightgrey shape=box style=filled]
	59 -> "125 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" [label=""]
	"126 | COc1cc(Br)c(F)cc1B(O)O" [color=lightyellow shape=box style=filled]
	60 -> "126 | COc1cc(Br)c(F)cc1B(O)O" [label=""]
	"127 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" [color=lightgrey shape=box style=filled]
	60 -> "127 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" [label=""]
	"128 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Cl)ccc12" [color=lightgrey shape=box style=filled]
	61 -> "128 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)Cl)ccc12" [label=""]
	"129 | Nc1ccon1" [color=lightyellow shape=box style=filled]
	61 -> "129 | Nc1ccon1" [label=""]
	"130 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)O)ccc12" [color=lightgrey shape=box style=filled]
	62 -> "130 | COc1cc(Br)c(F)cc1-c1nncc2cc(S(=O)(=O)O)ccc12" [label=""]
	"131 | Nc1ccon1" [color=lightyellow shape=box style=filled]
	62 -> "131 | Nc1ccon1" [label=""]
	"132 | COc1cc(Br)c(F)cc1Br" [color=lightyellow shape=box style=filled]
	63 -> "132 | COc1cc(Br)c(F)cc1Br" [label=""]
	"133 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" [color=lightgrey shape=box style=filled]
	63 -> "133 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" [label=""]
	"134 | COc1ccc(F)c(Br)c1" [color=lightyellow shape=box style=filled]
	64 -> "134 | COc1ccc(F)c(Br)c1" [label=""]
	"135 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" [color=lightgrey shape=box style=filled]
	64 -> "135 | O=S(=O)(Nc1ccon1)c1ccc2c(Br)nncc2c1" [label=""]
	"136 | COc1cc(Br)c(F)cc1Br" [color=lightyellow shape=box style=filled]
	65 -> "136 | COc1cc(Br)c(F)cc1Br" [label=""]
	"137 | O=S(=O)(Nc1ccon1)c1ccc2cnncc2c1" [color=lightgrey shape=box style=filled]
	65 -> "137 | O=S(=O)(Nc1ccon1)c1ccc2cnncc2c1" [label=""]
	"138 | O=[S](=O)O" [color=lightgrey shape=box style=filled]
	66 -> "138 | O=[S](=O)O" [label=""]
	"139 | COc1cc(Br)c(F)cc1-c1nncc2ccccc12" [color=lightgrey shape=box style=filled]
	66 -> "139 | COc1cc(Br)c(F)cc1-c1nncc2ccccc12" [label=""]
	"140 | Nc1ccon1" [color=lightyellow shape=box style=filled]
	66 -> "140 | Nc1ccon1" [label=""]
	"141 | COc1cc(Br)c(F)cc1-c1nncc2ccccc12" [color=lightgrey shape=box style=filled]
	67 -> "141 | COc1cc(Br)c(F)cc1-c1nncc2ccccc12" [label=""]
	"142 | Nc1ccon1" [color=lightyellow shape=box style=filled]
	67 -> "142 | Nc1ccon1" [label=""]
	"143 | O=[S](=O)Cl" [color=lightgrey shape=box style=filled]
	67 -> "143 | O=[S](=O)Cl" [label=""]
	"144 | O=S=O" [color=lightyellow shape=box style=filled]
	68 -> "144 | O=S=O" [label=""]
	"145 | COc1cc(Br)c(F)cc1-c1nncc2cc(Br)ccc12" [color=lightgrey shape=box style=filled]
	68 -> "145 | COc1cc(Br)c(F)cc1-c1nncc2cc(Br)ccc12" [label=""]
	"146 | Nc1ccon1" [color=lightyellow shape=box style=filled]
	68 -> "146 | Nc1ccon1" [label=""]
	"147 | O=S(=O)(Cl)c1ccc2c(Br)nncc2c1" [color=lightgrey shape=box style=filled]
	69 -> "147 | O=S(=O)(Cl)c1ccc2c(Br)nncc2c1" [label=""]
	"148 | Nc1ccon1" [color=lightyellow shape=box style=filled]
	69 -> "148 | Nc1ccon1" [label=""]
	"149 | O=S(=O)(O)c1ccc2c(Br)nncc2c1" [color=lightgrey shape=box style=filled]
	70 -> "149 | O=S(=O)(O)c1ccc2c(Br)nncc2c1" [label=""]
	"150 | Nc1ccon1" [color=lightyellow shape=box style=filled]
	70 -> "150 | Nc1ccon1" [label=""]
	71 [color=aquamarine shape=rarrow style=filled]
	"22 | O=S(=O)(Cl)c1ccc2c(Br)nncc2c1" -> 71 [label=0.000]
	72 [color=aquamarine shape=rarrow style=filled]
	"22 | O=S(=O)(Cl)c1ccc2c(Br)nncc2c1" -> 72 [label=0.000]
	73 [color=aquamarine shape=rarrow style=filled]
	"22 | O=S(=O)(Cl)c1ccc2c(Br)nncc2c1" -> 73 [label=0.000]
	74 [color=aquamarine shape=rarrow style=filled]
	"22 | O=S(=O)(Cl)c1ccc2c(Br)nncc2c1" -> 74 [label=0.000]
	75 [color=aquamarine shape=rarrow style=filled]
	"22 | O=S(=O)(Cl)c1ccc2c(Br)nncc2c1" -> 75 [label=0.000]
	76 [color=aquamarine shape=rarrow style=filled]
	"22 | O=S(=O)(Cl)c1ccc2c(Br)nncc2c1" -> 76 [label=0.000]
	77 [color=aquamarine shape=rarrow style=filled]
	"22 | O=S(=O)(Cl)c1ccc2c(Br)nncc2c1" -> 77 [label=0.000]
	78 [color=aquamarine shape=rarrow style=filled]
	"24 | O=S(=O)(O)c1ccc2c(Br)nncc2c1" -> 78 [label=0.000]
	79 [color=lightblue shape=rarrow style=filled]
	"24 | O=S(=O)(O)c1ccc2c(Br)nncc2c1" -> 79 [label=0.000]
	80 [color=aquamarine shape=rarrow style=filled]
	"24 | O=S(=O)(O)c1ccc2c(Br)nncc2c1" -> 80 [label=0.000]
	81 [color=aquamarine shape=rarrow style=filled]
	"24 | O=S(=O)(O)c1ccc2c(Br)nncc2c1" -> 81 [label=0.000]
	82 [color=aquamarine shape=rarrow style=filled]
	"24 | O=S(=O)(O)c1ccc2c(Br)nncc2c1" -> 82 [label=0.000]
	83 [color=lightblue shape=rarrow style=filled]
	"24 | O=S(=O)(O)c1ccc2c(Br)nncc2c1" -> 83 [label=0.000]
	84 [color=aquamarine shape=rarrow style=filled]
	"24 | O=S(=O)(O)c1ccc2c(Br)nncc2c1" -> 84 [label=0.000]
	85 [color=aquamarine shape=rarrow style=filled]
	"24 | O=S(=O)(O)c1ccc2c(Br)nncc2c1" -> 85 [label=0.000]
	"151 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	71 -> "151 | O=C1CCC(=O)N1Br" [label=""]
	"152 | O=S(=O)(Cl)c1ccc2cnncc2c1" [color=lightgrey shape=box style=filled]
	71 -> "152 | O=S(=O)(Cl)c1ccc2cnncc2c1" [label=""]
	"153 | O=C1CCC(=O)N1Cl" [color=lightyellow shape=box style=filled]
	72 -> "153 | O=C1CCC(=O)N1Cl" [label=""]
	"154 | O=[S](=O)c1ccc2c(Br)nncc2c1" [color=lightgrey shape=box style=filled]
	72 -> "154 | O=[S](=O)c1ccc2c(Br)nncc2c1" [label=""]
	"155 | O=[S](=O)c1ccc2c(Br)nncc2c1" [color=lightgrey shape=box style=filled]
	73 -> "155 | O=[S](=O)c1ccc2c(Br)nncc2c1" [label=""]
	"156 | ClC(Cl)(Cl)Cl" [color=lightyellow shape=box style=filled]
	73 -> "156 | ClC(Cl)(Cl)Cl" [label=""]
	"157 | Brc1nncc2ccccc12" [color=lightyellow shape=box style=filled]
	74 -> "157 | Brc1nncc2ccccc12" [label=""]
	"158 | O=S(=O)(Cl)Cl" [color=lightgrey shape=box style=filled]
	74 -> "158 | O=S(=O)(Cl)Cl" [label=""]
	"159 | O=S(=O)(O)c1ccc2c(Br)nncc2c1" [color=lightgrey shape=box style=filled]
	75 -> "159 | O=S(=O)(O)c1ccc2c(Br)nncc2c1" [label=""]
	"160 | Cl" [color=lightyellow shape=box style=filled]
	75 -> "160 | Cl" [label=""]
	"161 | O=S(=O)(O)c1ccc2c(Br)nncc2c1" [color=lightgrey shape=box style=filled]
	76 -> "161 | O=S(=O)(O)c1ccc2c(Br)nncc2c1" [label=""]
	"162 | ClC(Cl)(Cl)Cl" [color=lightyellow shape=box style=filled]
	76 -> "162 | ClC(Cl)(Cl)Cl" [label=""]
	"163 | O=S(=O)(O)c1ccc2c(Br)nncc2c1" [color=lightgrey shape=box style=filled]
	77 -> "163 | O=S(=O)(O)c1ccc2c(Br)nncc2c1" [label=""]
	"164 | O=C1CCC(=O)N1Cl" [color=lightyellow shape=box style=filled]
	77 -> "164 | O=C1CCC(=O)N1Cl" [label=""]
	"165 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	78 -> "165 | O=C1CCC(=O)N1Br" [label=""]
	"166 | O=S(=O)(O)c1ccc2cnncc2c1" [color=lightgrey shape=box style=filled]
	78 -> "166 | O=S(=O)(O)c1ccc2cnncc2c1" [label=""]
	"167 | Brc1nncc2ccccc12" [color=lightyellow shape=box style=filled]
	79 -> "167 | Brc1nncc2ccccc12" [label=""]
	"168 | O=S(=O)=O" [color=lightyellow shape=box style=filled]
	79 -> "168 | O=S(=O)=O" [label=""]
	"169 | Brc1nncc2ccccc12" [color=lightyellow shape=box style=filled]
	80 -> "169 | Brc1nncc2ccccc12" [label=""]
	"170 | O=S(=O)(O)Cl" [color=lightgrey shape=box style=filled]
	80 -> "170 | O=S(=O)(O)Cl" [label=""]
	"171 | O=[S](=O)O" [color=lightgrey shape=box style=filled]
	81 -> "171 | O=[S](=O)O" [label=""]
	"172 | Brc1ccc2c(Br)nncc2c1" [color=lightgrey shape=box style=filled]
	81 -> "172 | Brc1ccc2c(Br)nncc2c1" [label=""]
	"173 | O=C(OO)c1cccc(Cl)c1" [color=lightyellow shape=box style=filled]
	82 -> "173 | O=C(OO)c1cccc(Cl)c1" [label=""]
	"174 | O=S(O)c1ccc2c(Br)nncc2c1" [color=lightgrey shape=box style=filled]
	82 -> "174 | O=S(O)c1ccc2c(Br)nncc2c1" [label=""]
	"175 | Brc1nncc2ccccc12" [color=lightyellow shape=box style=filled]
	83 -> "175 | Brc1nncc2ccccc12" [label=""]
	"176 | O=S(=O)(O)O" [color=lightyellow shape=box style=filled]
	83 -> "176 | O=S(=O)(O)O" [label=""]
	"177 | Brc1nncc2ccccc12" [color=lightyellow shape=box style=filled]
	84 -> "177 | Brc1nncc2ccccc12" [label=""]
	"178 | O=S(=O)(O)Br" [color=lightgrey shape=box style=filled]
	84 -> "178 | O=S(=O)(O)Br" [label=""]
	"179 | O=S(=O)(Cl)c1ccc2c(Br)nncc2c1" [color=lightgrey shape=box style=filled]
	85 -> "179 | O=S(=O)(Cl)c1ccc2c(Br)nncc2c1" [label=""]
	"180 | O" [color=lightyellow shape=box style=filled]
	85 -> "180 | O" [label=""]
}
