0 B5R0.1 C#CCC(=O)N WXVL_AK0084SB3070 [0,0,0,0,0,0|2,0,2]=4 1 B5R0.1 C#CCC(=O)N WXVL_AK0084SB3070 [0,0,0,0,0,0|2,0,2]=4 2 B5R0.1 C/C=C/C(=O)N WXVL_AK0084SB0340 [0,0,0,0,0,0|2,0,1]=3 3 B5R0.1 C/C=C/C(=O)N WXVL_AK0084SB0340 [0,0,0,0,0,0|2,0,1]=3 4 B5R0.1 C=CCC(=O)N WXVL_AK0084SB2732 [0,0,0,0,0,0|2,0,2]=4 5 B5R0.1 C=CCC(=O)N WXVL_AK0084SB2732 [0,0,0,0,0,0|2,0,2]=4 6 B5R0.1 CC#CC(=O)N WXVL_AK0084SB1240 [0,0,0,0,0,0|2,0,1]=3 7 B5R0.1 CC#CC(=O)N WXVL_AK0084SB1240 [0,0,0,0,0,0|2,0,1]=3 8 B5R0.1 CCCC(=O)N WXVL_AK0084SB0073 [0,0,0,0,0,0|2,0,0]=2 9 B5R0.1 CCCC(=O)N WXVL_AK0084SB0073 [0,0,0,0,0,0|2,0,0]=2 10 B5R0.1 CCNC(=O)C WXVL_AK00476SB0150 [0,0,0,0,0,0|1,0,0]=1 11 B5R0.1 CCNC(=O)C WXVL_AK00476SB0150 [0,0,0,0,0,0|1,0,0]=1 12 B5R0.1 COCC(=O)N WXVL_AK0084SB0090 [0,0,0,0,0,0|3,0,0]=3 13 B5R0.1 COCC(=O)N WXVL_AK0084SB0090 [0,0,0,0,0,0|3,0,0]=3 14 B5R0.1 CSCC(=O)N WXVL_AK0084SB1267 [0,0,0,0,0,0|3,0,0]=3 15 B5R0.1 CSCC(=O)N WXVL_AK0084SB1267 [0,0,0,0,0,0|3,0,0]=3 16 B5R0.1 N#CCC(=O)N WXVL_AK0084SB0057 [0,0,0,0,0,0|3,0,1]=4 17 B5R0.1 N#CCC(=O)N WXVL_AK0084SB0057 [0,0,0,0,0,0|3,0,1]=4 18 B4R0.1 C#CC(=O)N WXVL_AK0084SB0338 [1,0,0,0,0,0|1,0,2]=4 19 B4R0.1 C#CC(=O)N WXVL_AK0084SB0338 [1,0,0,0,0,0|1,0,2]=4 20 B4R0.1 CCC(=O)N WXVL_AK0084SB0064 [1,0,0,0,0,0|1,0,0]=2 21 B4R0.1 CCC(=O)N WXVL_AK0084SB0064 [1,0,0,0,0,0|1,0,0]=2 22 B4R0.1 CNC(=O)C WXVL_AK00442SB0150 [1,0,0,0,0,0|1,0,0]=2 23 B4R0.1 CNC(=O)C WXVL_AK00442SB0150 [1,0,0,0,0,0|1,0,0]=2 24 B4R0.1 NC(=O)CO WXVL_AK0084SB2706 [1,0,0,0,0,0|2,0,0]=3 25 B4R0.1 NC(=O)CO WXVL_AK0084SB2706 [1,0,0,0,0,0|2,0,0]=3 26 B6R0.1 C#CC(=O)NCC WXVL_AK00476SB0338 [0,1,0,0,0,0|1,0,1]=3 27 B6R0.1 C#CC(=O)NCC WXVL_AK00476SB0338 [0,1,0,0,0,0|1,0,1]=3 28 B6R0.1 C#CCC(=O)NC WXVL_AK00442SB3070 [0,1,0,0,0,0|1,0,2]=4 29 B6R0.1 C#CCC(=O)NC WXVL_AK00442SB3070 [0,1,0,0,0,0|1,0,2]=4 30 B6R0.1 C/C=C/C(=O)NC WXVL_AK00442SB0340 [0,1,0,0,0,0|1,0,1]=3 31 B6R0.1 C/C=C/C(=O)NC WXVL_AK00442SB0340 [0,1,0,0,0,0|1,0,1]=3 32 B6R0.1 C=CCC(=O)NC WXVL_AK00442SB2732 [0,1,0,0,0,0|1,0,2]=4 33 B6R0.1 C=CCC(=O)NC WXVL_AK00442SB2732 [0,1,0,0,0,0|1,0,2]=4 34 B6R0.1 CC#CC(=O)NC WXVL_AK00442SB1240 [0,1,0,0,0,0|1,0,1]=3 35 B6R0.1 CC#CC(=O)NC WXVL_AK00442SB1240 [0,1,0,0,0,0|1,0,1]=3 36 B6R0.1 CCCC(=O)NC WXVL_AK00442SB0073 [0,1,0,0,0,0|1,0,0]=2 37 B6R0.1 CCCC(=O)NC WXVL_AK00442SB0073 [0,1,0,0,0,0|1,0,0]=2 38 B6R0.1 CCNC(=O)CC WXVL_AK00476SB0064 [0,1,0,0,0,0|1,0,0]=2 39 B6R0.1 CCNC(=O)CC WXVL_AK00476SB0064 [0,1,0,0,0,0|1,0,0]=2 40 B6R0.1 CCNC(=O)CO WXVL_AK00476SB2706 [0,1,0,0,0,0|1,0,0]=2 41 B6R0.1 CCNC(=O)CO WXVL_AK00476SB2706 [0,1,0,0,0,0|1,0,0]=2 42 B6R0.1 CNC(=O)CC#N WXVL_AK00442SB0057 [0,1,0,0,0,0|2,0,1]=4 43 B6R0.1 CNC(=O)CC#N WXVL_AK00442SB0057 [0,1,0,0,0,0|2,0,1]=4 44 B6R0.1 CNC(=O)COC WXVL_AK00442SB0090 [0,1,0,0,0,0|2,0,0]=3 45 B6R0.1 CNC(=O)COC WXVL_AK00442SB0090 [0,1,0,0,0,0|2,0,0]=3 46 B6R0.1 CNC(=O)CSC WXVL_AK00442SB1267 [0,1,0,0,0,0|2,0,0]=3 47 B6R0.1 CNC(=O)CSC WXVL_AK00442SB1267 [0,1,0,0,0,0|2,0,0]=3 48 B6R0.2 CC(=CC(=O)N)C WXVL_AK0084SB0342 [0,1,0,0,0,0|2,0,1]=4 49 B6R0.2 CC(=CC(=O)N)C WXVL_AK0084SB0342 [0,1,0,0,0,0|2,0,1]=4 50 B6R0.2 CC(=O)NC(C)C WXVL_AK0030SB0150 [0,1,0,0,0,0|1,0,0]=2 51 B6R0.2 CC(=O)NC(C)C WXVL_AK0030SB0150 [0,1,0,0,0,0|1,0,0]=2 52 B6R0.2 CC(C)CC(=O)N WXVL_AK0084SB0063 [0,1,0,0,0,0|2,0,0]=3 53 B6R0.2 CC(C)CC(=O)N WXVL_AK0084SB0063 [0,1,0,0,0,0|2,0,0]=3 54 B6R0.2 CC(O)CC(=O)N WXVL_AK0084SB3643 [0,1,0,0,0,0|2,0,0]=3 55 B6R0.2 CC(O)CC(=O)N WXVL_AK0084SB3643 [0,1,0,0,0,0|2,0,0]=3 56 B6R0.2 CN(C)CC(=O)N WXVL_AK0084SB0085 [0,1,0,0,0,0|3,0,0]=4 57 B6R0.2 CN(C)CC(=O)N WXVL_AK0084SB0085 [0,1,0,0,0,0|3,0,0]=4 58 B6R0.3 C/C=C(\C)/C(=O)N WXVL_AK0084SB0343 [0,1,0,0,0,0|2,0,1]=4 59 B6R0.3 C/C=C(\C)/C(=O)N WXVL_AK0084SB0343 [0,1,0,0,0,0|2,0,1]=4 60 B6R0.3 CCC(=O)C(=O)N WXVL_AK0084SB0344 [0,1,0,0,0,0|2,0,0]=3 61 B6R0.3 CCC(=O)C(=O)N WXVL_AK0084SB0344 [0,1,0,0,0,0|2,0,0]=3 62 B6R0.3 CCC(=O)N(C)C WXVL_AN0032SB0064 [0,1,0,0,0,0|3,0,0]=4 63 B6R0.3 CCC(=O)N(C)C WXVL_AN0032SB0064 [0,1,0,0,0,0|3,0,0]=4 64 B6R0.3 CCC(C)C(=O)N WXVL_AK0084SB0054 [0,1,0,0,0,0|2,0,0]=3 65 B6R0.3 CCC(C)C(=O)N WXVL_AK0084SB0054 [0,1,0,0,0,0|2,0,0]=3 66 B6R0.3 CC[C@@H](C)C(=O)N WXVL_AK0084SB00054 [0,1,0,0,0,0|2,0,0]=3 67 B6R0.3 CC[C@@H](C)C(=O)N WXVL_AK0084SB00054 [0,1,0,0,0,0|2,0,0]=3 68 B6R0.3 CC[C@H](O)C(=O)N WXVL_AK0084SB3573 [0,1,0,0,0,0|2,0,0]=3 69 B6R0.3 CC[C@H](O)C(=O)N WXVL_AK0084SB3573 [0,1,0,0,0,0|2,0,0]=3 70 B6R0.3 CNC(=O)C(=O)C WXVL_AK00442SB0051 [0,1,0,0,0,0|2,0,0]=3 71 B6R0.3 CNC(=O)C(=O)C WXVL_AK00442SB0051 [0,1,0,0,0,0|2,0,0]=3 72 B6R0.3 CNC(=O)C(=O)N WXVL_AK00442SB0128 [0,1,0,0,0,0|3,0,0]=4 73 B6R0.3 CNC(=O)C(=O)N WXVL_AK00442SB0128 [0,1,0,0,0,0|3,0,0]=4 74 B6R0.3 CO[C@H](C)C(=O)N WXVL_AK0084SB2926 [0,1,0,0,0,0|3,0,0]=4 75 B6R0.3 CO[C@H](C)C(=O)N WXVL_AK0084SB2926 [0,1,0,0,0,0|3,0,0]=4 76 B6R0.4 C#CCCC(=O)N WXVL_AK0084SB2189 [0,1,0,0,0,0|2,0,1]=4 77 B6R0.4 C#CCCC(=O)N WXVL_AK0084SB2189 [0,1,0,0,0,0|2,0,1]=4 78 B6R0.4 C=CCCC(=O)N WXVL_AK0084SB1035 [0,1,0,0,0,0|2,0,1]=4 79 B6R0.4 C=CCCC(=O)N WXVL_AK0084SB1035 [0,1,0,0,0,0|2,0,1]=4 80 B6R0.4 C=CCNC(=O)C WXVL_AK00561SB0150 [0,1,0,0,0,0|1,0,1]=3 81 B6R0.4 C=CCNC(=O)C WXVL_AK00561SB0150 [0,1,0,0,0,0|1,0,1]=3 82 B6R0.4 CC(=O)NCC#N WXVL_AK0683SB0150 [0,1,0,0,0,0|1,0,1]=3 83 B6R0.4 CC(=O)NCC#N WXVL_AK0683SB0150 [0,1,0,0,0,0|1,0,1]=3 84 B6R0.4 CC(=O)NCCF WXVL_AK00466SB0150 [0,1,0,0,0,0|1,0,0]=2 85 B6R0.4 CC(=O)NCCF WXVL_AK00466SB0150 [0,1,0,0,0,0|1,0,0]=2 86 B6R0.4 CCCNC(=O)C WXVL_AK00504SB0150 [0,1,0,0,0,0|1,0,0]=2 87 B6R0.4 CCCNC(=O)C WXVL_AK00504SB0150 [0,1,0,0,0,0|1,0,0]=2 88 B6R0.4 CCOCC(=O)N WXVL_AK0084SB0091 [0,1,0,0,0,0|1,1,0]=3 89 B6R0.4 CCOCC(=O)N WXVL_AK0084SB0091 [0,1,0,0,0,0|1,1,0]=3 90 B6R0.4 CCSCC(=O)N WXVL_AK0084SB0002 [0,1,0,0,0,0|1,0,0]=2 91 B6R0.4 CCSCC(=O)N WXVL_AK0084SB0002 [0,1,0,0,0,0|1,0,0]=2 92 B6R0.4 COCCC(=O)N WXVL_AK0084SB0156 [0,1,0,0,0,0|2,0,0]=3 93 B6R0.4 COCCC(=O)N WXVL_AK0084SB0156 [0,1,0,0,0,0|2,0,0]=3 94 B6R0.4 CSCCC(=O)N WXVL_AK0084SB0361 [0,1,0,0,0,0|2,0,0]=3 95 B6R0.4 CSCCC(=O)N WXVL_AK0084SB0361 [0,1,0,0,0,0|2,0,0]=3 96 B6R0.4 NC(=O)/C=C/CBr WXVL_AK0084SB0424 [0,1,0,0,0,0|2,0,1]=4 97 B6R0.4 NC(=O)/C=C/CBr WXVL_AK0084SB0424 [0,1,0,0,0,0|2,0,1]=4 98 B6R0.5 CCCS(=O)(=O)N WXVL_AK0084HU0030 [0,1,0,0,0,0|3,0,0]=4 99 B6R0.5 CCCS(=O)(=O)N WXVL_AK0084HU0030 [0,1,0,0,0,0|3,0,0]=4 100 B6R1.11 NC(=O)C1CC1 WXVL_AK0084SB0038 [0,0,0,1,0,0|2,0,0]=3 101 B6R1.11 NC(=O)C1CC1 WXVL_AK0084SB0038 [0,0,0,1,0,0|2,0,0]=3 102 B3R0.2 CC(=O)N WXVL_AK0084SB0150 [2,0,0,0,0,0|1,0,0]=3 103 B3R0.2 CC(=O)N WXVL_AK0084SB0150 [2,0,0,0,0,0|1,0,0]=3 104 B5R0.3 C#CC(=O)NC WXVL_AK00442SB0338 [1,1,0,0,0,0|0,0,2]=4 105 B5R0.3 C#CC(=O)NC WXVL_AK00442SB0338 [1,1,0,0,0,0|0,0,2]=4 106 B5R0.3 CCC(=O)NC WXVL_AK00442SB0064 [1,1,0,0,0,0|0,0,0]=2 107 B5R0.3 CCC(=O)NC WXVL_AK00442SB0064 [1,1,0,0,0,0|0,0,0]=2 108 B5R0.3 CNC(=O)CO WXVL_AK00442SB2706 [1,1,0,0,0,0|1,0,0]=3 109 B5R0.3 CNC(=O)CO WXVL_AK00442SB2706 [1,1,0,0,0,0|1,0,0]=3 110 B5R0.4 CCS(=O)(=O)N WXVL_AK0084HU0028 [1,1,0,0,0,0|2,0,0]=4 111 B5R0.4 CCS(=O)(=O)N WXVL_AK0084HU0028 [1,1,0,0,0,0|2,0,0]=4 112 B5R0.5 CC(=O)C(=O)N WXVL_AK0084SB0051 [1,1,0,0,0,0|1,0,1]=4 113 B5R0.5 CC(=O)C(=O)N WXVL_AK0084SB0051 [1,1,0,0,0,0|1,0,1]=4 114 B5R0.5 CC(=O)N(C)C WXVL_AN0032SB0150 [1,1,0,0,0,0|1,0,0]=3 115 B5R0.5 CC(=O)N(C)C WXVL_AN0032SB0150 [1,1,0,0,0,0|1,0,0]=3 116 B5R0.5 CC(C)C(=O)N WXVL_AK0084SB0052 [1,1,0,0,0,0|1,0,0]=3 117 B5R0.5 CC(C)C(=O)N WXVL_AK0084SB0052 [1,1,0,0,0,0|1,0,0]=3 118 B5R0.5 CC(S)C(=O)N WXVL_AK0084SB2708 [1,1,0,0,0,0|1,0,0]=3 119 B5R0.5 CC(S)C(=O)N WXVL_AK0084SB2708 [1,1,0,0,0,0|1,0,0]=3 120 B5R0.5 C[C@@H](O)C(=O)N WXVL_AK0084SB1085 [1,1,0,0,0,0|1,0,0]=3 121 B5R0.5 C[C@@H](O)C(=O)N WXVL_AK0084SB1085 [1,1,0,0,0,0|1,0,0]=3 122 B5R0.5 NC(=O)C(F)F WXVL_AK0084SB0079 [1,1,0,0,0,0|2,0,0]=4 123 B5R0.5 NC(=O)C(F)F WXVL_AK0084SB0079 [1,1,0,0,0,0|2,0,0]=4 124 B7R0.2 C#CC(=O)NC(C)C WXVL_AK0030SB0338 [0,2,0,0,0,0|1,0,1]=4 125 B7R0.2 C#CC(=O)NC(C)C WXVL_AK0030SB0338 [0,2,0,0,0,0|1,0,1]=4 126 B7R0.2 C#C[C@@H](C)NC(=O)C WXVL_AK00735SB0150 [0,2,0,0,0,0|1,0,0]=3 127 B7R0.2 C#C[C@@H](C)NC(=O)C WXVL_AK00735SB0150 [0,2,0,0,0,0|1,0,0]=3 128 B7R0.2 C=CC(C)NC(=O)C WXVL_AK00769SB0150 [0,2,0,0,0,0|1,0,0]=3 129 B7R0.2 C=CC(C)NC(=O)C WXVL_AK00769SB0150 [0,2,0,0,0,0|1,0,0]=3 130 B7R0.2 CC(=O)NC(C)C#N WXVL_AK00810SB0150 [0,2,0,0,0,0|1,0,0]=3 131 B7R0.2 CC(=O)NC(C)C#N WXVL_AK00810SB0150 [0,2,0,0,0,0|1,0,0]=3 132 B7R0.2 CC(=O)N[C@@H](C)CF WXVL_AK00558SB0150 [0,2,0,0,0,0|1,0,0]=3 133 B7R0.2 CC(=O)N[C@@H](C)CF WXVL_AK00558SB0150 [0,2,0,0,0,0|1,0,0]=3 134 B7R0.2 CC(=O)N[C@@H](C)CO WXVL_AK0109SB0150 [0,2,0,0,0,0|1,0,0]=3 135 B7R0.2 CC(=O)N[C@@H](C)CO WXVL_AK0109SB0150 [0,2,0,0,0,0|1,0,0]=3 136 B7R0.2 CC(C)NC(=O)CO WXVL_AK0030SB2706 [0,2,0,0,0,0|1,0,0]=3 137 B7R0.2 CC(C)NC(=O)CO WXVL_AK0030SB2706 [0,2,0,0,0,0|1,0,0]=3 138 B7R0.2 CCC(=O)NC(C)C WXVL_AK0030SB0064 [0,2,0,0,0,0|1,0,0]=3 139 B7R0.2 CCC(=O)NC(C)C WXVL_AK0030SB0064 [0,2,0,0,0,0|1,0,0]=3 140 B7R0.2 CCC(C)CC(=O)N WXVL_AK0084SB0353 [0,2,0,0,0,0|2,0,0]=4 141 B7R0.2 CCC(C)CC(=O)N WXVL_AK0084SB0353 [0,2,0,0,0,0|2,0,0]=4 142 B7R0.2 CCC(O)CC(=O)N WXVL_AK0084SB4092 [0,2,0,0,0,0|2,0,0]=4 143 B7R0.2 CCC(O)CC(=O)N WXVL_AK0084SB4092 [0,2,0,0,0,0|2,0,0]=4 144 B7R0.2 CC[C@@H](C)CC(=O)N WXVL_AK0084SB8650 [0,2,0,0,0,0|2,0,0]=4 145 B7R0.2 CC[C@@H](C)CC(=O)N WXVL_AK0084SB8650 [0,2,0,0,0,0|2,0,0]=4 146 B7R0.2 CC[C@H](C)NC(=O)C WXVL_AK00678SB0150 [0,2,0,0,0,0|1,0,0]=3 147 B7R0.2 CC[C@H](C)NC(=O)C WXVL_AK00678SB0150 [0,2,0,0,0,0|1,0,0]=3 148 B7R0.2 CNC(=O)C=C(C)C WXVL_AK00442SB0342 [0,2,0,0,0,0|1,0,1]=4 149 B7R0.2 CNC(=O)C=C(C)C WXVL_AK00442SB0342 [0,2,0,0,0,0|1,0,1]=4 150 B7R0.2 CNC(=O)CC(C)C WXVL_AK00442SB0063 [0,2,0,0,0,0|1,0,0]=3 151 B7R0.2 CNC(=O)CC(C)C WXVL_AK00442SB0063 [0,2,0,0,0,0|1,0,0]=3 152 B7R0.2 CNC(=O)CC(C)O WXVL_AK00442SB3643 [0,2,0,0,0,0|1,0,0]=3 153 B7R0.2 CNC(=O)CC(C)O WXVL_AK00442SB3643 [0,2,0,0,0,0|1,0,0]=3 154 B7R0.2 CNC(=O)CN(C)C WXVL_AK00442SB0085 [0,2,0,0,0,0|2,0,0]=4 155 B7R0.2 CNC(=O)CN(C)C WXVL_AK00442SB0085 [0,2,0,0,0,0|2,0,0]=4 156 B7R0.3 C#CC(=O)NCCC WXVL_AK00504SB0338 [0,2,0,0,0,0|1,0,1]=4 157 B7R0.3 C#CC(=O)NCCC WXVL_AK00504SB0338 [0,2,0,0,0,0|1,0,1]=4 158 B7R0.3 C#CC(=O)NCCF WXVL_AK00466SB0338 [0,2,0,0,0,0|1,0,1]=4 159 B7R0.3 C#CC(=O)NCCF WXVL_AK00466SB0338 [0,2,0,0,0,0|1,0,1]=4 160 B7R0.3 C#CCCC(=O)NC WXVL_AK00442SB2189 [0,2,0,0,0,0|1,0,1]=4 161 B7R0.3 C#CCCC(=O)NC WXVL_AK00442SB2189 [0,2,0,0,0,0|1,0,1]=4 162 B7R0.3 C=CCCC(=O)NC WXVL_AK00442SB1035 [0,2,0,0,0,0|1,0,1]=4 163 B7R0.3 C=CCCC(=O)NC WXVL_AK00442SB1035 [0,2,0,0,0,0|1,0,1]=4 164 B7R0.3 C=CCNC(=O)CC WXVL_AK00561SB0064 [0,2,0,0,0,0|1,0,1]=4 165 B7R0.3 C=CCNC(=O)CC WXVL_AK00561SB0064 [0,2,0,0,0,0|1,0,1]=4 166 B7R0.3 C=CCNC(=O)CO WXVL_AK00561SB2706 [0,2,0,0,0,0|1,0,1]=4 167 B7R0.3 C=CCNC(=O)CO WXVL_AK00561SB2706 [0,2,0,0,0,0|1,0,1]=4 168 B7R0.3 CCC(=O)NCC#N WXVL_AK0683SB0064 [0,2,0,0,0,0|1,0,1]=4 169 B7R0.3 CCC(=O)NCC#N WXVL_AK0683SB0064 [0,2,0,0,0,0|1,0,1]=4 170 B7R0.3 CCC(=O)NCCF WXVL_AK00466SB0064 [0,2,0,0,0,0|1,0,0]=3 171 B7R0.3 CCC(=O)NCCF WXVL_AK00466SB0064 [0,2,0,0,0,0|1,0,0]=3 172 B7R0.3 CCCNC(=O)CC WXVL_AK00504SB0064 [0,2,0,0,0,0|1,0,0]=3 173 B7R0.3 CCCNC(=O)CC WXVL_AK00504SB0064 [0,2,0,0,0,0|1,0,0]=3 174 B7R0.3 CCCNC(=O)CO WXVL_AK00504SB2706 [0,2,0,0,0,0|1,0,0]=3 175 B7R0.3 CCCNC(=O)CO WXVL_AK00504SB2706 [0,2,0,0,0,0|1,0,0]=3 176 B7R0.3 CCOCC(=O)NC WXVL_AK00442SB0091 [0,2,0,0,0,0|0,1,0]=3 177 B7R0.3 CCOCC(=O)NC WXVL_AK00442SB0091 [0,2,0,0,0,0|0,1,0]=3 178 B7R0.3 CCSCC(=O)NC WXVL_AK00442SB0002 [0,2,0,0,0,0|0,0,0]=2 179 B7R0.3 CCSCC(=O)NC WXVL_AK00442SB0002 [0,2,0,0,0,0|0,0,0]=2 180 B7R0.3 CNC(=O)/C=C/CBr WXVL_AK00442SB0424 [0,2,0,0,0,0|1,0,1]=4 181 B7R0.3 CNC(=O)/C=C/CBr WXVL_AK00442SB0424 [0,2,0,0,0,0|1,0,1]=4 182 B7R0.3 CNC(=O)CCOC WXVL_AK00442SB0156 [0,2,0,0,0,0|1,0,0]=3 183 B7R0.3 CNC(=O)CCOC WXVL_AK00442SB0156 [0,2,0,0,0,0|1,0,0]=3 184 B7R0.3 CNC(=O)CCSC WXVL_AK00442SB0361 [0,2,0,0,0,0|1,0,0]=3 185 B7R0.3 CNC(=O)CCSC WXVL_AK00442SB0361 [0,2,0,0,0,0|1,0,0]=3 186 B7R0.3 CNC(=O)NCCCl WXVL_AK00442YV0092 [0,2,0,0,0,0|1,0,0]=3 187 B7R0.3 CNC(=O)NCCCl WXVL_AK00442YV0092 [0,2,0,0,0,0|1,0,0]=3 188 B7R0.3 N#CCNC(=O)CO WXVL_AK0683SB2706 [0,2,0,0,0,0|1,0,1]=4 189 B7R0.3 N#CCNC(=O)CO WXVL_AK0683SB2706 [0,2,0,0,0,0|1,0,1]=4 190 B7R0.3 O=C(CO)NCCF WXVL_AK00466SB2706 [0,2,0,0,0,0|1,0,0]=3 191 B7R0.3 O=C(CO)NCCF WXVL_AK00466SB2706 [0,2,0,0,0,0|1,0,0]=3 192 B7R0.5 C/C=C/C(=O)N(C)C WXVL_AN0032SB0340 [0,2,0,0,0,0|1,0,1]=4 193 B7R0.5 C/C=C/C(=O)N(C)C WXVL_AN0032SB0340 [0,2,0,0,0,0|1,0,1]=4 194 B7R0.5 C=C(F)C(=O)NCC WXVL_AK00476SB1376 [0,2,0,0,0,0|1,0,1]=4 195 B7R0.5 C=C(F)C(=O)NCC WXVL_AK00476SB1376 [0,2,0,0,0,0|1,0,1]=4 196 B7R0.5 CC#CC(=O)N(C)C WXVL_AN0032SB1240 [0,2,0,0,0,0|1,0,1]=4 197 B7R0.5 CC#CC(=O)N(C)C WXVL_AN0032SB1240 [0,2,0,0,0,0|1,0,1]=4 198 B7R0.5 CC(=O)N(C)CC#N WXVL_AN2942SB0150 [0,2,0,0,0,0|1,0,1]=4 199 B7R0.5 CC(=O)N(C)CC#N WXVL_AN2942SB0150 [0,2,0,0,0,0|1,0,1]=4 200 B7R0.5 CC(=O)N(C)CCO WXVL_AN2670SB0150 [0,2,0,0,0,0|1,0,0]=3 201 B7R0.5 CC(=O)N(C)CCO WXVL_AN2670SB0150 [0,2,0,0,0,0|1,0,0]=3 202 B7R0.5 CC/C=C(\C)/C(=O)N WXVL_AK0084SB0037 [0,2,0,0,0,0|1,0,0]=3 203 B7R0.5 CC/C=C(\C)/C(=O)N WXVL_AK0084SB0037 [0,2,0,0,0,0|1,0,0]=3 204 B7R0.5 CCCC(=O)N(C)C WXVL_AN0032SB0073 [0,2,0,0,0,0|1,0,0]=3 205 B7R0.5 CCCC(=O)N(C)C WXVL_AN0032SB0073 [0,2,0,0,0,0|1,0,0]=3 206 B7R0.5 CCCC(C)C(=O)N WXVL_AK0084SB0352 [0,2,0,0,0,0|1,0,1]=4 207 B7R0.5 CCCC(C)C(=O)N WXVL_AK0084SB0352 [0,2,0,0,0,0|1,0,1]=4 208 B7R0.5 CCC[C@H](O)C(=O)N WXVL_AK0084SB3627 [0,2,0,0,0,0|2,0,0]=4 209 B7R0.5 CCC[C@H](O)C(=O)N WXVL_AK0084SB3627 [0,2,0,0,0,0|2,0,0]=4 210 B7R0.5 CCNC(=O)C(=O)C WXVL_AK00476SB0051 [0,2,0,0,0,0|1,0,0]=3 211 B7R0.5 CCNC(=O)C(=O)C WXVL_AK00476SB0051 [0,2,0,0,0,0|1,0,0]=3 212 B7R0.5 CCNC(=O)C(=O)N WXVL_AK00476SB0128 [0,2,0,0,0,0|1,0,1]=4 213 B7R0.5 CCNC(=O)C(=O)N WXVL_AK00476SB0128 [0,2,0,0,0,0|1,0,1]=4 214 B7R0.5 CCNC(=O)C(C)C WXVL_AK00476SB0052 [0,2,0,0,0,0|1,0,0]=3 215 B7R0.5 CCNC(=O)C(C)C WXVL_AK00476SB0052 [0,2,0,0,0,0|1,0,0]=3 216 B7R0.5 CCNC(=O)C(C)S WXVL_AK00476SB2708 [0,2,0,0,0,0|1,0,0]=3 217 B7R0.5 CCNC(=O)C(C)S WXVL_AK00476SB2708 [0,2,0,0,0,0|1,0,0]=3 218 B7R0.5 CCNC(=O)C(F)F WXVL_AK00476SB0079 [0,2,0,0,0,0|1,0,0]=3 219 B7R0.5 CCNC(=O)C(F)F WXVL_AK00476SB0079 [0,2,0,0,0,0|1,0,0]=3 220 B7R0.5 CCNC(=O)[C@@H](C)O WXVL_AK00476SB1085 [0,2,0,0,0,0|1,0,0]=3 221 B7R0.5 CCNC(=O)[C@@H](C)O WXVL_AK00476SB1085 [0,2,0,0,0,0|1,0,0]=3 222 B7R0.5 CCOC(=O)C(=O)N WXVL_AK0084SB4144 [0,2,0,0,0,0|0,1,1]=4 223 B7R0.5 CCOC(=O)C(=O)N WXVL_AK0084SB4144 [0,2,0,0,0,0|0,1,1]=4 224 B7R0.5 COCC(=O)N(C)C WXVL_AN0032SB0090 [0,2,0,0,0,0|2,0,0]=4 225 B7R0.5 COCC(=O)N(C)C WXVL_AN0032SB0090 [0,2,0,0,0,0|2,0,0]=4 226 B7R0.5 CSCC(=O)N(C)C WXVL_AN0032SB1267 [0,2,0,0,0,0|2,0,0]=4 227 B7R0.5 CSCC(=O)N(C)C WXVL_AN0032SB1267 [0,2,0,0,0,0|2,0,0]=4 228 B7R0.7 C#CCC(=O)NCC WXVL_AK00476SB3070 [0,2,0,0,0,0|1,0,0]=3 229 B7R0.7 C#CCC(=O)NCC WXVL_AK00476SB3070 [0,2,0,0,0,0|1,0,0]=3 230 B7R0.7 C/C=C/C(=O)NCC WXVL_AK00476SB0340 [0,2,0,0,0,0|1,0,0]=3 231 B7R0.7 C/C=C/C(=O)NCC WXVL_AK00476SB0340 [0,2,0,0,0,0|1,0,0]=3 232 B7R0.7 C=CCC(=O)NCC WXVL_AK00476SB2732 [0,2,0,0,0,0|1,0,0]=3 233 B7R0.7 C=CCC(=O)NCC WXVL_AK00476SB2732 [0,2,0,0,0,0|1,0,0]=3 234 B7R0.7 CC#CC(=O)NCC WXVL_AK00476SB1240 [0,2,0,0,0,0|1,0,0]=3 235 B7R0.7 CC#CC(=O)NCC WXVL_AK00476SB1240 [0,2,0,0,0,0|1,0,0]=3 236 B7R0.7 CCCC(=O)NCC WXVL_AK00476SB0073 [0,2,0,0,0,0|1,0,0]=3 237 B7R0.7 CCCC(=O)NCC WXVL_AK00476SB0073 [0,2,0,0,0,0|1,0,0]=3 238 B7R0.7 CCNC(=O)CC#N WXVL_AK00476SB0057 [0,2,0,0,0,0|1,0,0]=3 239 B7R0.7 CCNC(=O)CC#N WXVL_AK00476SB0057 [0,2,0,0,0,0|1,0,0]=3 240 B7R0.7 CCNC(=O)COC WXVL_AK00476SB0090 [0,2,0,0,0,0|1,0,0]=3 241 B7R0.7 CCNC(=O)COC WXVL_AK00476SB0090 [0,2,0,0,0,0|1,0,0]=3 242 B7R0.7 CCNC(=O)CSC WXVL_AK00476SB1267 [0,2,0,0,0,0|1,0,0]=3 243 B7R0.7 CCNC(=O)CSC WXVL_AK00476SB1267 [0,2,0,0,0,0|1,0,0]=3 244 B7R0.10 C/C=C(\C)/C(=O)NC WXVL_AK00442SB0343 [0,2,0,0,0,0|1,0,1]=4 245 B7R0.10 C/C=C(\C)/C(=O)NC WXVL_AK00442SB0343 [0,2,0,0,0,0|1,0,1]=4 246 B7R0.10 CCC(=O)C(=O)NC WXVL_AK00442SB0344 [0,2,0,0,0,0|1,0,0]=3 247 B7R0.10 CCC(=O)C(=O)NC WXVL_AK00442SB0344 [0,2,0,0,0,0|1,0,0]=3 248 B7R0.10 CCC(C)C(=O)NC WXVL_AK00442SB0054 [0,2,0,0,0,0|1,0,0]=3 249 B7R0.10 CCC(C)C(=O)NC WXVL_AK00442SB0054 [0,2,0,0,0,0|1,0,0]=3 250 B7R0.10 CC[C@@H](C)C(=O)NC WXVL_AK00442SB00054 [0,2,0,0,0,0|1,0,0]=3 251 B7R0.10 CC[C@@H](C)C(=O)NC WXVL_AK00442SB00054 [0,2,0,0,0,0|1,0,0]=3 252 B7R0.10 CC[C@H](O)C(=O)NC WXVL_AK00442SB3573 [0,2,0,0,0,0|1,0,0]=3 253 B7R0.10 CC[C@H](O)C(=O)NC WXVL_AK00442SB3573 [0,2,0,0,0,0|1,0,0]=3 254 B7R0.10 CNC(=O)[C@@H](C)OC WXVL_AK00442SB2926 [0,2,0,0,0,0|2,0,0]=4 255 B7R0.10 CNC(=O)[C@@H](C)OC WXVL_AK00442SB2926 [0,2,0,0,0,0|2,0,0]=4 256 B7R0.11 CCCS(=O)(=O)NC WXVL_AK00442HU0030 [0,2,0,0,0,0|2,0,0]=4 257 B7R0.11 CCCS(=O)(=O)NC WXVL_AK00442HU0030 [0,2,0,0,0,0|2,0,0]=4 258 B7R0.11 CCNS(=O)(=O)CC WXVL_AK00476HU0028 [0,2,0,0,0,0|2,0,0]=4 259 B7R0.11 CCNS(=O)(=O)CC WXVL_AK00476HU0028 [0,2,0,0,0,0|2,0,0]=4 260 B7R0.9 CC(=O)NC(C)(C)C WXVL_AK0024SB0150 [0,2,0,0,0,0|1,0,0]=3 261 B7R0.9 CC(=O)NC(C)(C)C WXVL_AK0024SB0150 [0,2,0,0,0,0|1,0,0]=3 262 B7R0.9 CC(C)(C)CC(=O)N WXVL_AK0084SB0062 [0,2,0,0,0,0|2,0,0]=4 263 B7R0.9 CC(C)(C)CC(=O)N WXVL_AK0084SB0062 [0,2,0,0,0,0|2,0,0]=4 264 B7R0.9 CC(C)(O)CC(=O)N WXVL_AK0084SB0163 [0,2,0,0,0,0|2,0,0]=4 265 B7R0.9 CC(C)(O)CC(=O)N WXVL_AK0084SB0163 [0,2,0,0,0,0|2,0,0]=4 266 B7R0.16 CC(=O)C(=O)N(C)C WXVL_AN0032SB0051 [0,2,0,0,0,0|2,0,0]=4 267 B7R0.16 CC(=O)C(=O)N(C)C WXVL_AN0032SB0051 [0,2,0,0,0,0|2,0,0]=4 268 B7R0.16 CC(=O)N(C)C(C)C WXVL_AN0073SB0150 [0,2,0,0,0,0|1,0,0]=3 269 B7R0.16 CC(=O)N(C)C(C)C WXVL_AN0073SB0150 [0,2,0,0,0,0|1,0,0]=3 270 B7R0.16 CC(C)C(=O)C(=O)N WXVL_AK0084SB2578 [0,2,0,0,0,0|2,0,0]=4 271 B7R0.16 CC(C)C(=O)C(=O)N WXVL_AK0084SB2578 [0,2,0,0,0,0|2,0,0]=4 272 B7R0.16 CC(C)C(O)C(=O)N WXVL_AK0084SB1147 [0,2,0,0,0,0|2,0,0]=4 273 B7R0.16 CC(C)C(O)C(=O)N WXVL_AK0084SB1147 [0,2,0,0,0,0|2,0,0]=4 274 B7R0.13 CCC(C)(C)C(=O)N WXVL_AK0084SB0355 [0,2,0,0,0,0|2,0,0]=4 275 B7R0.13 CCC(C)(C)C(=O)N WXVL_AK0084SB0355 [0,2,0,0,0,0|2,0,0]=4 276 B7R0.13 CCC(C)(O)C(=O)N WXVL_AK0084SB3009 [0,2,0,0,0,0|2,0,0]=4 277 B7R0.13 CCC(C)(O)C(=O)N WXVL_AK0084SB3009 [0,2,0,0,0,0|2,0,0]=4 278 B7R0.15 CCC(CC)C(=O)N WXVL_AK0084SB0055 [0,2,0,0,0,0|2,0,0]=4 279 B7R0.15 CCC(CC)C(=O)N WXVL_AK0084SB0055 [0,2,0,0,0,0|2,0,0]=4 280 B7R0.15 CCN(CC)C(=O)C WXVL_AN0042SB0150 [0,2,0,0,0,0|1,0,0]=3 281 B7R0.15 CCN(CC)C(=O)C WXVL_AN0042SB0150 [0,2,0,0,0,0|1,0,0]=3 282 B7R0.4 C#CCCCC(=O)N WXVL_AK0084SB2709 [0,2,0,0,0,0|2,0,0]=4 283 B7R0.4 C#CCCCC(=O)N WXVL_AK0084SB2709 [0,2,0,0,0,0|2,0,0]=4 284 B7R0.4 C#CCCNC(=O)C WXVL_AK3109SB0150 [0,2,0,0,0,0|1,0,0]=3 285 B7R0.4 C#CCCNC(=O)C WXVL_AK3109SB0150 [0,2,0,0,0,0|1,0,0]=3 286 B7R0.4 C=CCCCC(=O)N WXVL_AK0084SB2920 [0,2,0,0,0,0|2,0,0]=4 287 B7R0.4 C=CCCCC(=O)N WXVL_AK0084SB2920 [0,2,0,0,0,0|2,0,0]=4 288 B7R0.4 C=CCCNC(=O)C WXVL_AK00138SB0150 [0,2,0,0,0,0|1,0,0]=3 289 B7R0.4 C=CCCNC(=O)C WXVL_AK00138SB0150 [0,2,0,0,0,0|1,0,0]=3 290 B7R0.4 CC(=O)NCCC#N WXVL_AK0087SB0150 [0,2,0,0,0,0|1,0,0]=3 291 B7R0.4 CC(=O)NCCC#N WXVL_AK0087SB0150 [0,2,0,0,0,0|1,0,0]=3 292 B7R0.4 CC(=O)NCCCO WXVL_AK0073SB0150 [0,2,0,0,0,0|1,0,0]=3 293 B7R0.4 CC(=O)NCCCO WXVL_AK0073SB0150 [0,2,0,0,0,0|1,0,0]=3 294 B7R0.4 CC/C=C/CC(=O)N WXVL_AK0084SB0349 [0,2,0,0,0,0|2,0,0]=4 295 B7R0.4 CC/C=C/CC(=O)N WXVL_AK0084SB0349 [0,2,0,0,0,0|2,0,0]=4 296 B7R0.4 CCCCNC(=O)C WXVL_AK00588SB0150 [0,2,0,0,0,0|1,0,0]=3 297 B7R0.4 CCCCNC(=O)C WXVL_AK00588SB0150 [0,2,0,0,0,0|1,0,0]=3 298 B7R0.4 CCO/C=C/C(=O)N WXVL_AK0084SB3226 [0,2,0,0,0,0|1,1,0]=4 299 B7R0.4 CCO/C=C/C(=O)N WXVL_AK0084SB3226 [0,2,0,0,0,0|1,1,0]=4 300 B7R0.4 CSCCNC(=O)C WXVL_AK00440SB0150 [0,2,0,0,0,0|1,0,0]=3 301 B7R0.4 CSCCNC(=O)C WXVL_AK00440SB0150 [0,2,0,0,0,0|1,0,0]=3 302 B7R0.4 NC(=O)CCCCBr WXVL_AK0084SB3153 [0,2,0,0,0,0|2,0,0]=4 303 B7R0.4 NC(=O)CCCCBr WXVL_AK0084SB3153 [0,2,0,0,0,0|2,0,0]=4 304 B7R0.4 NC(=O)CCCCCl WXVL_AK0084SB0379 [0,2,0,0,0,0|2,0,0]=4 305 B7R0.4 NC(=O)CCCCCl WXVL_AK0084SB0379 [0,2,0,0,0,0|2,0,0]=4 306 B7R0.6 C=C(C)CNC(=O)C WXVL_AK0761SB0150 [0,2,0,0,0,0|1,0,0]=3 307 B7R0.6 C=C(C)CNC(=O)C WXVL_AK0761SB0150 [0,2,0,0,0,0|1,0,0]=3 308 B7R0.6 CC(=O)CCC(=O)N WXVL_AK0084SB0072 [0,2,0,0,0,0|1,0,1]=4 309 B7R0.6 CC(=O)CCC(=O)N WXVL_AK0084SB0072 [0,2,0,0,0,0|1,0,1]=4 310 B7R0.6 CC(=O)NCC(=O)N WXVL_AK0084SB0357 [0,2,0,0,0,0|1,0,1]=4 311 B7R0.6 CC(=O)NCC(=O)N WXVL_AK0084SB0357 [0,2,0,0,0,0|1,0,1]=4 312 B7R0.6 CC(=O)NCC(=O)N WXVL_AK0147SB0150 [0,2,0,0,0,0|1,0,1]=4 313 B7R0.6 CC(=O)NCC(=O)N WXVL_AK0147SB0150 [0,2,0,0,0,0|1,0,1]=4 314 B7R0.6 CC(=O)NCC(C)C WXVL_AK00544SB0150 [0,2,0,0,0,0|1,0,0]=3 315 B7R0.6 CC(=O)NCC(C)C WXVL_AK00544SB0150 [0,2,0,0,0,0|1,0,0]=3 316 B7R0.6 CC(=O)NCC(C)O WXVL_AK0052SB0150 [0,2,0,0,0,0|1,0,0]=3 317 B7R0.6 CC(=O)NCC(C)O WXVL_AK0052SB0150 [0,2,0,0,0,0|1,0,0]=3 318 B7R0.6 CC(=O)NCC(F)F WXVL_AK0136SB0150 [0,2,0,0,0,0|1,0,0]=3 319 B7R0.6 CC(=O)NCC(F)F WXVL_AK0136SB0150 [0,2,0,0,0,0|1,0,0]=3 320 B7R0.6 CC(=O)NC[C@H](C)O WXVL_AK0113SB0150 [0,2,0,0,0,0|1,0,0]=3 321 B7R0.6 CC(=O)NC[C@H](C)O WXVL_AK0113SB0150 [0,2,0,0,0,0|1,0,0]=3 322 B7R0.6 CC(=O)OCC(=O)N WXVL_AK0084SB2824 [0,2,0,0,0,0|0,1,1]=4 323 B7R0.6 CC(=O)OCC(=O)N WXVL_AK0084SB2824 [0,2,0,0,0,0|0,1,1]=4 324 B7R0.6 CC(=O)SCC(=O)N WXVL_AK0084SB3992 [0,2,0,0,0,0|0,0,1]=3 325 B7R0.6 CC(=O)SCC(=O)N WXVL_AK0084SB3992 [0,2,0,0,0,0|0,0,1]=3 326 B7R0.6 CC(C)/C=C/C(=O)N WXVL_AK0084SB0036 [0,2,0,0,0,0|2,0,0]=4 327 B7R0.6 CC(C)/C=C/C(=O)N WXVL_AK0084SB0036 [0,2,0,0,0,0|2,0,0]=4 328 B7R0.6 CC(C)CCC(=O)N WXVL_AK0084SB0354 [0,2,0,0,0,0|2,0,0]=4 329 B7R0.6 CC(C)CCC(=O)N WXVL_AK0084SB0354 [0,2,0,0,0,0|2,0,0]=4 330 B7R0.6 CC(C)OCC(=O)N WXVL_AK0084SB0213 [0,2,0,0,0,0|1,1,0]=4 331 B7R0.6 CC(C)OCC(=O)N WXVL_AK0084SB0213 [0,2,0,0,0,0|1,1,0]=4 332 B7R0.6 CN(C)CCC(=O)N WXVL_AK0084SB00052 [0,2,0,0,0,0|2,0,0]=4 333 B7R0.6 CN(C)CCC(=O)N WXVL_AK0084SB00052 [0,2,0,0,0,0|2,0,0]=4 334 B7R1.22 CNC(=O)C1CC1 WXVL_AK00442SB0038 [0,1,0,1,0,0|1,0,0]=3 335 B7R1.22 CNC(=O)C1CC1 WXVL_AK00442SB0038 [0,1,0,1,0,0|1,0,0]=3 336 B7R1.12 CC1CC1C(=O)N WXVL_AK0084SB0041 [0,1,0,1,0,0|2,0,0]=4 337 B7R1.12 CC1CC1C(=O)N WXVL_AK0084SB0041 [0,1,0,1,0,0|2,0,0]=4 338 B7R1.12 NC(=O)[C@@H]1C[C@@H]1F WXVL_AK0084SB1245 [0,1,0,1,0,0|2,0,0]=4 339 B7R1.12 NC(=O)[C@@H]1C[C@@H]1F WXVL_AK0084SB1245 [0,1,0,1,0,0|2,0,0]=4 340 B7R1.12 NC(=O)[C@H]1C[C@H]1F WXVL_AK0084SB00019 [0,1,0,1,0,0|2,0,0]=4 341 B7R1.12 NC(=O)[C@H]1C[C@H]1F WXVL_AK0084SB00019 [0,1,0,1,0,0|2,0,0]=4 342 B7R1.20 CC(=O)NC1CC1 WXVL_AK0001SB0150 [0,1,0,1,0,0|1,0,0]=3 343 B7R1.20 CC(=O)NC1CC1 WXVL_AK0001SB0150 [0,1,0,1,0,0|1,0,0]=3 344 B7R1.20 NC(=O)CC1CC1 WXVL_AK0084SB0155 [0,1,0,1,0,0|2,0,0]=4 345 B7R1.20 NC(=O)CC1CC1 WXVL_AK0084SB0155 [0,1,0,1,0,0|2,0,0]=4 346 B7R1.18 NC(=O)C1CCC1 WXVL_AK0084SB0042 [0,1,0,1,0,0|2,0,0]=4 347 B7R1.18 NC(=O)C1CCC1 WXVL_AK0084SB0042 [0,1,0,1,0,0|2,0,0]=4 348 B7R1.19 CC1(CC1)C(=O)N WXVL_AK0084SB0040 [0,1,0,1,0,0|2,0,0]=4 349 B7R1.19 CC1(CC1)C(=O)N WXVL_AK0084SB0040 [0,1,0,1,0,0|2,0,0]=4 350 B7R1.19 NC(=O)C1(CC1)Br WXVL_AK0084SB5517 [0,1,0,1,0,0|2,0,0]=4 351 B7R1.19 NC(=O)C1(CC1)Br WXVL_AK0084SB5517 [0,1,0,1,0,0|2,0,0]=4 352 B7R1.19 NC(=O)C1(CC1)F WXVL_AK0084SB0218 [0,1,0,1,0,0|2,0,0]=4 353 B7R1.19 NC(=O)C1(CC1)F WXVL_AK0084SB0218 [0,1,0,1,0,0|2,0,0]=4 354 B7R1.19 NC(=O)C1(CC1)O WXVL_AK0084SB2965 [0,1,0,1,0,0|2,0,0]=4 355 B7R1.19 NC(=O)C1(CC1)O WXVL_AK0084SB2965 [0,1,0,1,0,0|2,0,0]=4