digraph G {
	rankdir=LR
	node [shape=box]
	"1 | COC(=O)CC12CCC(c3ccc(-c4ccc(NC(=O)c5nc(C)oc5C(F)(F)F)cc4)cc3)(CC1)CO2" [color=lightblue shape=box style=filled]
	1 [color=lightblue shape=rarrow style=filled]
	"1 | COC(=O)CC12CCC(c3ccc(-c4ccc(NC(=O)c5nc(C)oc5C(F)(F)F)cc4)cc3)(CC1)CO2" -> 1 [label=0.000]
	2 [color=aquamarine shape=rarrow style=filled]
	"1 | COC(=O)CC12CCC(c3ccc(-c4ccc(NC(=O)c5nc(C)oc5C(F)(F)F)cc4)cc3)(CC1)CO2" -> 2 [label=0.000]
	"2 | Cc1nc(C(=O)O)c(C(F)(F)F)o1" [color=lightyellow shape=box style=filled]
	1 -> "2 | Cc1nc(C(=O)O)c(C(F)(F)F)o1" [label=""]
	"3 | COC(=O)CC12CCC(c3ccc(-c4ccc(N)cc4)cc3)(CC1)CO2" [color=lightblue shape=box style=filled]
	1 -> "3 | COC(=O)CC12CCC(c3ccc(-c4ccc(N)cc4)cc3)(CC1)CO2" [label=""]
	"4 | Cc1nc(C(=O)Cl)c(C(F)(F)F)o1" [color=aquamarine shape=box style=filled]
	2 -> "4 | Cc1nc(C(=O)Cl)c(C(F)(F)F)o1" [label=""]
	"5 | COC(=O)C(Cl)C1CCC(CO)(c2ccccc2)CC1" [color=lightblue shape=box style=filled]
	2 -> "5 | COC(=O)C(Cl)C1CCC(CO)(c2ccccc2)CC1" [label=""]
	"6 | OBr" [color=lightblue shape=box style=filled]
	2 -> "6 | OBr" [label=""]
	"7 | Nc1ccc(Br)cc1" [color=lightyellow shape=box style=filled]
	2 -> "7 | Nc1ccc(Br)cc1" [label=""]
	3 [color=lightblue shape=rarrow style=filled]
	"3 | COC(=O)CC12CCC(c3ccc(-c4ccc(N)cc4)cc3)(CC1)CO2" -> 3 [label=0.000]
	4 [color=aquamarine shape=rarrow style=filled]
	"3 | COC(=O)CC12CCC(c3ccc(-c4ccc(N)cc4)cc3)(CC1)CO2" -> 4 [label=0.000]
	5 [color=aquamarine shape=rarrow style=filled]
	"3 | COC(=O)CC12CCC(c3ccc(-c4ccc(N)cc4)cc3)(CC1)CO2" -> 5 [label=0.000]
	6 [color=aquamarine shape=rarrow style=filled]
	"3 | COC(=O)CC12CCC(c3ccc(-c4ccc(N)cc4)cc3)(CC1)CO2" -> 6 [label=0.000]
	7 [color=aquamarine shape=rarrow style=filled]
	"3 | COC(=O)CC12CCC(c3ccc(-c4ccc(N)cc4)cc3)(CC1)CO2" -> 7 [label=0.000]
	8 [color=aquamarine shape=rarrow style=filled]
	"3 | COC(=O)CC12CCC(c3ccc(-c4ccc(N)cc4)cc3)(CC1)CO2" -> 8 [label=0.000]
	9 [color=aquamarine shape=rarrow style=filled]
	"3 | COC(=O)CC12CCC(c3ccc(-c4ccc(N)cc4)cc3)(CC1)CO2" -> 9 [label=0.000]
	10 [color=aquamarine shape=rarrow style=filled]
	"3 | COC(=O)CC12CCC(c3ccc(-c4ccc(N)cc4)cc3)(CC1)CO2" -> 10 [label=0.000]
	11 [color=aquamarine shape=rarrow style=filled]
	"3 | COC(=O)CC12CCC(c3ccc(-c4ccc(N)cc4)cc3)(CC1)CO2" -> 11 [label=0.000]
	12 [color=aquamarine shape=rarrow style=filled]
	"3 | COC(=O)CC12CCC(c3ccc(-c4ccc(N)cc4)cc3)(CC1)CO2" -> 12 [label=0.000]
	13 [color=aquamarine shape=rarrow style=filled]
	"4 | Cc1nc(C(=O)Cl)c(C(F)(F)F)o1" -> 13 [label=0.000]
	14 [color=aquamarine shape=rarrow style=filled]
	"4 | Cc1nc(C(=O)Cl)c(C(F)(F)F)o1" -> 14 [label=0.000]
	15 [color=aquamarine shape=rarrow style=filled]
	"5 | COC(=O)C(Cl)C1CCC(CO)(c2ccccc2)CC1" -> 15 [label=0.000]
	16 [color=lightblue shape=rarrow style=filled]
	"5 | COC(=O)C(Cl)C1CCC(CO)(c2ccccc2)CC1" -> 16 [label=0.000]
	17 [color=aquamarine shape=rarrow style=filled]
	"5 | COC(=O)C(Cl)C1CCC(CO)(c2ccccc2)CC1" -> 17 [label=0.000]
	18 [color=aquamarine shape=rarrow style=filled]
	"5 | COC(=O)C(Cl)C1CCC(CO)(c2ccccc2)CC1" -> 18 [label=0.000]
	19 [color=aquamarine shape=rarrow style=filled]
	"5 | COC(=O)C(Cl)C1CCC(CO)(c2ccccc2)CC1" -> 19 [label=0.000]
	20 [color=aquamarine shape=rarrow style=filled]
	"5 | COC(=O)C(Cl)C1CCC(CO)(c2ccccc2)CC1" -> 20 [label=0.000]
	21 [color=lightblue shape=rarrow style=filled]
	"5 | COC(=O)C(Cl)C1CCC(CO)(c2ccccc2)CC1" -> 21 [label=0.000]
	22 [color=lightblue shape=rarrow style=filled]
	"5 | COC(=O)C(Cl)C1CCC(CO)(c2ccccc2)CC1" -> 22 [label=0.000]
	23 [color=aquamarine shape=rarrow style=filled]
	"5 | COC(=O)C(Cl)C1CCC(CO)(c2ccccc2)CC1" -> 23 [label=0.000]
	24 [color=aquamarine shape=rarrow style=filled]
	"5 | COC(=O)C(Cl)C1CCC(CO)(c2ccccc2)CC1" -> 24 [label=0.000]
	25 [color=lightblue shape=rarrow style=filled]
	"6 | OBr" -> 25 [label=0.000]
	"8 | COC(=O)CC12CCC(CC1)CO2" [color=lightblue shape=box style=filled]
	3 -> "8 | COC(=O)CC12CCC(CC1)CO2" [label=""]
	"9 | Nc1ccc(-c2ccc(Br)cc2)cc1" [color=lightyellow shape=box style=filled]
	3 -> "9 | Nc1ccc(-c2ccc(Br)cc2)cc1" [label=""]
	"10 | COC(=O)CC12CCC(c3ccc(Br)cc3)(CC1)CO2" [color=lightgrey shape=box style=filled]
	4 -> "10 | COC(=O)CC12CCC(c3ccc(Br)cc3)(CC1)CO2" [label=""]
	"11 | Nc1ccc(Br)cc1" [color=lightyellow shape=box style=filled]
	4 -> "11 | Nc1ccc(Br)cc1" [label=""]
	"12 | COC(=O)CC12CCC(CC1)CO2" [color=lightgrey shape=box style=filled]
	5 -> "12 | COC(=O)CC12CCC(CC1)CO2" [label=""]
	"13 | CC1(C)OB(c2ccc(-c3ccc(N)cc3)cc2)OC1(C)C" [color=lightgrey shape=box style=filled]
	5 -> "13 | CC1(C)OB(c2ccc(-c3ccc(N)cc3)cc2)OC1(C)C" [label=""]
	"14 | Nc1ccccc1" [color=lightyellow shape=box style=filled]
	6 -> "14 | Nc1ccccc1" [label=""]
	"15 | COC(=O)CC12CCC(c3ccc(Br)cc3)(CC1)CO2" [color=lightgrey shape=box style=filled]
	6 -> "15 | COC(=O)CC12CCC(c3ccc(Br)cc3)(CC1)CO2" [label=""]
	"16 | COC(=O)C(Br)C12CCC(CC1)CO2" [color=lightgrey shape=box style=filled]
	7 -> "16 | COC(=O)C(Br)C12CCC(CC1)CO2" [label=""]
	"17 | Nc1ccc(-c2ccc(Br)cc2)cc1" [color=lightyellow shape=box style=filled]
	7 -> "17 | Nc1ccc(-c2ccc(Br)cc2)cc1" [label=""]
	"18 | COC(=O)CC12CCC(c3ccc(Br)cc3)(CC1)CO2" [color=lightgrey shape=box style=filled]
	8 -> "18 | COC(=O)CC12CCC(c3ccc(Br)cc3)(CC1)CO2" [label=""]
	"19 | Nc1ccc(Br)cc1" [color=lightyellow shape=box style=filled]
	8 -> "19 | Nc1ccc(Br)cc1" [label=""]
	"20 | COC(=O)CC12CCC(CC1)CO2" [color=lightgrey shape=box style=filled]
	9 -> "20 | COC(=O)CC12CCC(CC1)CO2" [label=""]
	"21 | Nc1ccc(-c2ccccc2)cc1" [color=lightyellow shape=box style=filled]
	9 -> "21 | Nc1ccc(-c2ccccc2)cc1" [label=""]
	"22 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	9 -> "22 | O=C1CCC(=O)N1Br" [label=""]
	"23 | COC(=O)CC12CCC(CC1)CO2" [color=lightgrey shape=box style=filled]
	10 -> "23 | COC(=O)CC12CCC(CC1)CO2" [label=""]
	"24 | Nc1ccc(-c2ccc(B(O)O)cc2)cc1" [color=lightgrey shape=box style=filled]
	10 -> "24 | Nc1ccc(-c2ccc(B(O)O)cc2)cc1" [label=""]
	"25 | COC(=O)CC12CCC(c3ccc(Br)cc3)(CC1)CO2" [color=lightgrey shape=box style=filled]
	11 -> "25 | COC(=O)CC12CCC(c3ccc(Br)cc3)(CC1)CO2" [label=""]
	"26 | Nc1ccc(B(O)O)cc1" [color=lightyellow shape=box style=filled]
	11 -> "26 | Nc1ccc(B(O)O)cc1" [label=""]
	"27 | Nc1ccc(-c2ccccc2)cc1" [color=lightyellow shape=box style=filled]
	12 -> "27 | Nc1ccc(-c2ccccc2)cc1" [label=""]
	"28 | COC(=O)C(Br)C12CCC(CC1)CO2" [color=lightgrey shape=box style=filled]
	12 -> "28 | COC(=O)C(Br)C12CCC(CC1)CO2" [label=""]
	"29 | O=C(Cl)Cl" [color=lightyellow shape=box style=filled]
	13 -> "29 | O=C(Cl)Cl" [label=""]
	"30 | Cc1ncc(C(F)(F)F)o1" [color=lightgrey shape=box style=filled]
	13 -> "30 | Cc1ncc(C(F)(F)F)o1" [label=""]
	"31 | O=C(Cl)CNC(=O)C(=O)Cl" [color=lightgrey shape=box style=filled]
	14 -> "31 | O=C(Cl)CNC(=O)C(=O)Cl" [label=""]
	"32 | O=C(O)C(F)([F+]Cl)[F+]Cl" [color=lightgrey shape=box style=filled]
	14 -> "32 | O=C(O)C(F)([F+]Cl)[F+]Cl" [label=""]
	"33 | COC(=O)C(Cl)C1CCC(CO)CC1" [color=lightgrey shape=box style=filled]
	15 -> "33 | COC(=O)C(Cl)C1CCC(CO)CC1" [label=""]
	"34 | Brc1ccccc1" [color=lightyellow shape=box style=filled]
	15 -> "34 | Brc1ccccc1" [label=""]
	"35 | O=C1CCC(CO)(c2ccccc2)CC1" [color=lightyellow shape=box style=filled]
	16 -> "35 | O=C1CCC(CO)(c2ccccc2)CC1" [label=""]
	"36 | COC(=O)CCl" [color=lightyellow shape=box style=filled]
	16 -> "36 | COC(=O)CCl" [label=""]
	"37 | COC(=O)CCl" [color=lightyellow shape=box style=filled]
	17 -> "37 | COC(=O)CCl" [label=""]
	"38 | OCC1(c2ccccc2)CCC(Br)CC1" [color=lightgrey shape=box style=filled]
	17 -> "38 | OCC1(c2ccccc2)CCC(Br)CC1" [label=""]
	"39 | OB(O)c1ccccc1" [color=lightyellow shape=box style=filled]
	18 -> "39 | OB(O)c1ccccc1" [label=""]
	"40 | COC(=O)C(Cl)C1CCC(CO)CC1" [color=lightgrey shape=box style=filled]
	18 -> "40 | COC(=O)C(Cl)C1CCC(CO)CC1" [label=""]
	"41 | COC(=O)C(Cl)C1CCC(CO)CC1" [color=lightgrey shape=box style=filled]
	19 -> "41 | COC(=O)C(Cl)C1CCC(CO)CC1" [label=""]
	"42 | Ic1ccccc1" [color=lightyellow shape=box style=filled]
	19 -> "42 | Ic1ccccc1" [label=""]
	"43 | ClC(Cl)(Cl)Cl" [color=lightyellow shape=box style=filled]
	20 -> "43 | ClC(Cl)(Cl)Cl" [label=""]
	"44 | COC(=O)CC1CCC(CO)(c2ccccc2)CC1" [color=lightgrey shape=box style=filled]
	20 -> "44 | COC(=O)CC1CCC(CO)(c2ccccc2)CC1" [label=""]
	"45 | COC(=O)C(=O)Cl" [color=lightyellow shape=box style=filled]
	21 -> "45 | COC(=O)C(=O)Cl" [label=""]
	"46 | OCC1(c2ccccc2)CCCCC1" [color=lightyellow shape=box style=filled]
	21 -> "46 | OCC1(c2ccccc2)CCCCC1" [label=""]
	"47 | COC(=O)C(Cl)Cl" [color=lightyellow shape=box style=filled]
	22 -> "47 | COC(=O)C(Cl)Cl" [label=""]
	"48 | OCC1(c2ccccc2)CCCCC1" [color=lightyellow shape=box style=filled]
	22 -> "48 | OCC1(c2ccccc2)CCCCC1" [label=""]
	"49 | O=C1CCC(=O)N1Cl" [color=lightyellow shape=box style=filled]
	23 -> "49 | O=C1CCC(=O)N1Cl" [label=""]
	"50 | COC(=O)CC1CCC(CO)(c2ccccc2)CC1" [color=lightgrey shape=box style=filled]
	23 -> "50 | COC(=O)CC1CCC(CO)(c2ccccc2)CC1" [label=""]
	"51 | COC(=O)C(Cl)C1CCC(c2ccccc2)CC1" [color=lightgrey shape=box style=filled]
	24 -> "51 | COC(=O)C(Cl)C1CCC(c2ccccc2)CC1" [label=""]
	"52 | C=O" [color=lightyellow shape=box style=filled]
	24 -> "52 | C=O" [label=""]
	"53 | O=C1CCC(=O)N1Br" [color=lightyellow shape=box style=filled]
	25 -> "53 | O=C1CCC(=O)N1Br" [label=""]
	"54 | O" [color=lightyellow shape=box style=filled]
	25 -> "54 | O" [label=""]
	26 [color=aquamarine shape=rarrow style=filled]
	"8 | COC(=O)CC12CCC(CC1)CO2" -> 26 [label=0.000]
	27 [color=aquamarine shape=rarrow style=filled]
	"8 | COC(=O)CC12CCC(CC1)CO2" -> 27 [label=0.000]
	28 [color=lightblue shape=rarrow style=filled]
	"8 | COC(=O)CC12CCC(CC1)CO2" -> 28 [label=0.000]
	29 [color=aquamarine shape=rarrow style=filled]
	"8 | COC(=O)CC12CCC(CC1)CO2" -> 29 [label=0.000]
	30 [color=aquamarine shape=rarrow style=filled]
	"8 | COC(=O)CC12CCC(CC1)CO2" -> 30 [label=0.000]
	31 [color=aquamarine shape=rarrow style=filled]
	"8 | COC(=O)CC12CCC(CC1)CO2" -> 31 [label=0.000]
	32 [color=aquamarine shape=rarrow style=filled]
	"8 | COC(=O)CC12CCC(CC1)CO2" -> 32 [label=0.000]
	33 [color=aquamarine shape=rarrow style=filled]
	"8 | COC(=O)CC12CCC(CC1)CO2" -> 33 [label=0.000]
	34 [color=lightblue shape=rarrow style=filled]
	"8 | COC(=O)CC12CCC(CC1)CO2" -> 34 [label=0.000]
	35 [color=aquamarine shape=rarrow style=filled]
	"8 | COC(=O)CC12CCC(CC1)CO2" -> 35 [label=0.000]
	"55 | C1CC2CCC1CO2" [color=lightgrey shape=box style=filled]
	26 -> "55 | C1CC2CCC1CO2" [label=""]
	"56 | COC(=O)CBr" [color=lightyellow shape=box style=filled]
	26 -> "56 | COC(=O)CBr" [label=""]
	"57 | C1CC2CCC1CO2" [color=lightgrey shape=box style=filled]
	27 -> "57 | C1CC2CCC1CO2" [label=""]
	"58 | COC(=O)CCl" [color=lightyellow shape=box style=filled]
	27 -> "58 | COC(=O)CCl" [label=""]
	"59 | COC(=O)CBr" [color=lightyellow shape=box style=filled]
	28 -> "59 | COC(=O)CBr" [label=""]
	"60 | OCC1CCCCC1" [color=lightyellow shape=box style=filled]
	28 -> "60 | OCC1CCCCC1" [label=""]
	"61 | [O]CC1CC[C]CC1" [color=lightgrey shape=box style=filled]
	29 -> "61 | [O]CC1CC[C]CC1" [label=""]
	"62 | [CH2]C(=O)OC" [color=lightgrey shape=box style=filled]
	29 -> "62 | [CH2]C(=O)OC" [label=""]
	"63 | COC(=O)CC1CCC(C(O)Br)CC1" [color=lightgrey shape=box style=filled]
	30 -> "63 | COC(=O)CC1CCC(C(O)Br)CC1" [label=""]
	"64 | COC(=O)C(Br)C1CCC(CO)CC1" [color=lightgrey shape=box style=filled]
	31 -> "64 | COC(=O)C(Br)C1CCC(CO)CC1" [label=""]
	"65 | COC(=O)CC1CCC(C(=O)O)CC1" [color=lightgrey shape=box style=filled]
	32 -> "65 | COC(=O)CC1CCC(C(=O)O)CC1" [label=""]
	"66 | COC(=O)CC1CCC(C(=O)O)CC1" [color=lightgrey shape=box style=filled]
	33 -> "66 | COC(=O)CC1CCC(C(=O)O)CC1" [label=""]
	"67 | COC(C)=O" [color=lightyellow shape=box style=filled]
	34 -> "67 | COC(C)=O" [label=""]
	"68 | O=C1CCC(CO)CC1" [color=lightyellow shape=box style=filled]
	34 -> "68 | O=C1CCC(CO)CC1" [label=""]
	"69 | COC(=O)C[C]1CCC([C][O])CC1" [color=lightgrey shape=box style=filled]
	35 -> "69 | COC(=O)C[C]1CCC([C][O])CC1" [label=""]
}
