0 B6R0.2 CC(=O)C=C(C)C AMY23356 [0,0,0,0,0,0|1,0,1]=2 1 B6R0.2 CC(=O)CC(C)C AMY11098 [0,0,0,0,0,0|1,0,2]=3 2 B6R0.2 CC(=O)NC(C)C AMY3785 [0,0,0,0,0,0|1,0,2]=3 3 B6R0.2 CC(=O)\C=C(\C)N AMY24718 [0,0,0,0,0,0|2,0,0]=2 4 B6R0.2 CC(=O)\C=C(\C)[O-] AMY11696 [0,0,0,0,0,0|2,0,0]=2 5 B6R0.2 CC(=O)\C=C(\C)[O-] AMY19683 [0,0,0,0,0,0|2,0,0]=2 6 B6R0.2 CC(=O)\C=C(\C)[O-] AMY41912 [0,0,0,0,0,0|2,0,0]=2 7 B6R0.2 CC(C)CC(=O)O AMY40214 [0,0,0,0,0,0|2,0,2]=4 8 B6R0.2 CC(C)OC(=O)Cl AMY3776 [0,0,0,0,0,0|1,0,2]=3 9 B6R0.2 CC(O)CC(=O)[O-] AMY10051 [0,0,0,0,0,0|3,0,1]=4 10 B6R0.2 CC(O)CC(=O)[O-] AMY10054 [0,0,0,0,0,0|3,0,1]=4 11 B6R0.2 CN(C)CC(=O)O AM20080064 [0,0,0,0,0,0|3,0,1]=4 12 B6R0.2 CN(C)CC(=O)O AM81799 [0,0,0,0,0,0|3,0,1]=4 13 B6R0.2 CN(C)CC(=O)[O-] AMY42162 [0,0,0,0,0,0|3,0,1]=4 14 B6R0.2 CN(C)CC(=O)[O-] AMY42163 [0,0,0,0,0,0|3,0,1]=4 15 B6R0.2 C[C@@H](O)CC(=O)O AMY24176 [0,0,0,0,0,0|3,0,1]=4 16 B6R0.2 C[C@H](N)CC(=O)O AM20100008 [0,0,0,0,0,0|3,0,1]=4 17 B6R0.2 C[C@H](N)CC(=O)O AM20100009 [0,0,0,0,0,0|3,0,1]=4 18 B6R0.2 C[C@H](N)CC(=O)O AM20100428 [0,0,0,0,0,0|3,0,1]=4 19 B6R0.2 C[C@H](N)CC(=O)O AM804090 [0,0,0,0,0,0|3,0,1]=4 20 B6R0.2 C[C@H](O)CC(=O)O AMY10050 [0,0,0,0,0,0|3,0,1]=4 21 B6R0.2 C[C@H](O)CC(=O)O AMY24175 [0,0,0,0,0,0|3,0,1]=4 22 B6R0.2 C[C@H](O)CC(=O)[O-] AM86469 [0,0,0,0,0,0|3,0,1]=4 23 B6R0.2 C[C@H](O)CC(=O)[O-] AMY10052 [0,0,0,0,0,0|3,0,1]=4 24 B6R0.2 C[C@H](O)CC(=O)[O-] AMY10055 [0,0,0,0,0,0|3,0,1]=4 25 B6R0.2 C[S+](C)CC(=O)[O-] AM90363 [0,0,0,0,0,0|3,0,1]=4 26 B6R0.2 O=C(Cl)CC(=O)Cl AM10012 [0,0,0,0,0,0|4,0,0]=4 27 B6R0.2 O=C(O)C=C(Cl)Cl AMY14156 [0,0,0,0,0,0|4,0,0]=4 28 B6R0.2 O=C(O)CC(=O)O AMY11201 [0,0,0,0,0,0|4,0,0]=4 29 B5R0.1 C=C(C)CCBr AMY7022 [1,0,0,0,0,0|2,0,1]=4 30 B5R0.1 C=CCC(C)=O AMY31929 [1,0,0,0,0,0|1,0,0]=2 31 B5R0.1 C=CC[C@H](C)N AM9152 [1,0,0,0,0,0|2,0,1]=4 32 B5R0.1 C=CC[C@H](C)O AM804193 [1,0,0,0,0,0|1,0,2]=4 33 B5R0.1 CC#CC(=O)Cl AMY41204 [1,0,0,0,0,0|2,0,1]=4 34 B5R0.1 CC#CC(=O)O AM90222 [1,0,0,0,0,0|2,0,1]=4 35 B5R0.1 CC(=O)CC#N AM86800 [1,0,0,0,0,0|2,0,1]=4 36 B5R0.1 CC(=O)CC#N AMY7035 [1,0,0,0,0,0|2,0,1]=4 37 B5R0.1 CC(=O)CCO AMY31061 [1,0,0,0,0,0|2,0,1]=4 38 B5R0.1 CC(=O)OCCl AMY28690 [1,0,0,0,0,0|1,0,1]=3 39 B5R0.1 CC(=O)\C=N\O AM806560 [1,0,0,0,0,0|3,0,0]=4 40 B5R0.1 CC(C)=CC=O AMY42093 [1,0,0,0,0,0|1,0,1]=3 41 B5R0.1 CCCC(C)=O AMY25524 [1,0,0,0,0,0|1,0,1]=3 42 B5R0.1 CCOC(=S)[S-] AM20080300 [1,0,0,0,0,0|1,1,1]=4 43 B5R0.1 CCOC(C)=N AM90190 [1,0,0,0,0,0|1,0,1]=3 44 B5R0.1 CCOC(N)=O AM20100253 [1,0,0,0,0,0|1,0,1]=3 45 B5R0.1 CCO[PH](=O)[O-] AMY22458 [1,0,0,0,0,0|2,0,1]=4 46 B5R0.1 CCSC(C)=S AM90236 [1,0,0,0,0,0|0,2,1]=4 47 B5R0.1 CNCC(=O)O AM20080021 [1,0,0,0,0,0|3,0,0]=4 48 B5R0.1 CNCC(C)=O AM806508 [1,0,0,0,0,0|2,0,0]=3 49 B5R0.1 CNCC(N)=O AM82642 [1,0,0,0,0,0|3,0,0]=4 50 B5R0.1 COCC(=O)Cl AMY40728 [1,0,0,0,0,0|3,0,0]=4 51 B5R0.1 COCC(=O)O AMY4059 [1,0,0,0,0,0|3,0,0]=4 52 B5R0.1 CSCC(N)=O AMY10906 [1,0,0,0,0,0|3,0,0]=4 53 B5R0.1 C\C=C\C(=O)O AMY11255 [1,0,0,0,0,0|2,0,0]=3 54 B5R0.1 C\C=C\C(C)=O AMY31928 [1,0,0,0,0,0|1,0,0]=2 55 B5R0.1 C\C=C\[N+](=O)[O-] AMY23936 [1,0,0,0,0,0|3,0,0]=4 56 B5R0.1 O=C(O)\C=C/I AMY22685 [1,0,0,0,0,0|3,0,0]=4 57 B5R0.1 O=C(O)\C=C\I AM806037 [1,0,0,0,0,0|3,0,0]=4 58 B7R0.2 C#CC(=O)OC(C)C AMY7054 [0,1,0,0,0,0|0,0,3]=4 59 B7R0.2 C=CC(=O)C=C(C)C AM806643 [0,1,0,0,0,0|1,0,2]=4 60 B7R0.2 CC(C)OC(=O)CN AM81795 [0,1,0,0,0,0|0,0,2]=3 61 B7R0.2 CC(C)OC(=O)CO AM20100526 [0,1,0,0,0,0|0,0,2]=3 62 B7R0.2 CCC(=O)CC(=O)O AM85448 [0,1,0,0,0,0|3,0,0]=4 63 B7R0.2 CCC(=O)CC(=O)[O-] AM88443 [0,1,0,0,0,0|3,0,0]=4 64 B7R0.2 CCC(=O)CC(C)=O AMY2701 [0,1,0,0,0,0|2,0,0]=3 65 B7R0.2 COC(=O)CC(=O)Cl AM90205 [0,1,0,0,0,0|3,0,0]=4 66 B7R0.2 COC(=O)CC(=O)[O-] AMY3708 [0,1,0,0,0,0|3,0,0]=4 67 B7R0.2 COC(=O)CC(=O)[O-] AMY3965 [0,1,0,0,0,0|3,0,0]=4 68 B7R0.2 COC(=O)C[C@H](C)O AM20090811 [0,1,0,0,0,0|2,0,1]=4 69 B7R0.2 COC(=O)C[C@H](C)O AM20100049 [0,1,0,0,0,0|2,0,1]=4 70 B7R0.2 COC(=O)C[C@H](C)O AMY3321 [0,1,0,0,0,0|2,0,1]=4 71 B7R0.2 COC(=O)\C=C(\C)F AMY36917 [0,1,0,0,0,0|2,0,0]=3 72 B7R0.2 COC(=O)\C=C(\C)N AM20080319 [0,1,0,0,0,0|2,0,0]=3 73 B7R0.2 C\C(C=O)=C/N(C)C AMY28718 [0,1,0,0,0,0|2,0,1]=4 74 B7R0.9 CC(=O)N[Si](C)(C)C AMY42260 [0,1,0,0,0,0|1,1,1]=4 75 B7R0.9 CC(=O)OC(C)(C)C AMY11033 [0,1,0,0,0,0|0,0,2]=3 76 B7R0.9 CC(C)(C)OC(N)=O AM20100123 [0,1,0,0,0,0|1,0,2]=4 77 B7R0.16 C=C(C)C(=O)N(C)C AM85878 [0,1,0,0,0,0|3,0,0]=4 78 B7R0.16 C=C(C)[C@@H](N)C(=O)O AMY23937 [0,1,0,0,0,0|2,0,0]=3 79 B7R0.16 CC(=O)C(Cl)C(C)=O AMY3866 [0,1,0,0,0,0|2,0,0]=3 80 B7R0.16 CC(=O)N(C)C(C)=O AM20080061 [0,1,0,0,0,0|2,0,0]=3 81 B7R1.2 BrC1=CC=C(Br)O1 AM20090471 [0,0,0,1,0,0|2,0,1]=4 82 B7R1.2 CC1=CC(=O)NO1 AMY22453 [0,0,0,1,0,0|3,0,0]=4 83 B7R1.2 CC1=CC(Br)=CS1 AM20090389 [0,0,0,1,0,0|2,1,0]=4 84 B7R1.2 CC1=CC(C)=NN1 AMY40839 [0,0,0,1,0,0|3,0,0]=4 85 B7R1.2 CC1=CC(C)=NO1 AM20090405 [0,0,0,1,0,0|2,0,1]=4 86 B7R1.2 CC1=CC=C(Br)O1 AM806617 [0,0,0,1,0,0|1,0,1]=3 87 B7R1.2 CC1=CC=C(Br)S1 AM20100755 [0,0,0,1,0,0|1,1,1]=4 88 B7R1.2 CC1=CC=C(C)O1 AM81813 [0,0,0,1,0,0|1,0,0]=2 89 B7R1.2 CC1=CC=C(Cl)S1 AMY31416 [0,0,0,1,0,0|1,1,1]=4 90 B7R1.2 CC1=CC=C(I)S1 AMY31922 [0,0,0,1,0,0|1,1,1]=4 91 B7R1.2 CC1=CN(C)C=N1 AM804171 [0,0,0,1,0,0|3,0,0]=4 92 B7R1.2 CC1=CN(C)N=C1 AMY25522 [0,0,0,1,0,0|3,0,0]=4 93 B7R1.2 CC1=CN=C(Br)S1 AM20100103 [0,0,0,1,0,0|2,1,0]=4 94 B7R1.2 CC1=CN=C(I)N1 AM805967 [0,0,0,1,0,0|3,0,0]=4 95 B7R1.2 CC1=CN=C(N)O1 AM803709 [0,0,0,1,0,0|2,0,0]=3 96 B7R1.2 CC1=CN=C(N)S1 AM20100697 [0,0,0,1,0,0|2,1,0]=4 97 B7R1.2 CC1=CNC(C)=C1 AMY3543 [0,0,0,1,0,0|2,0,0]=3 98 B7R1.2 CC1=CNC(C)=N1 AM20120338 [0,0,0,1,0,0|2,0,0]=3 99 B7R1.2 CC1=COC(Br)=N1 AMY23967 [0,0,0,1,0,0|2,0,1]=4 100 B7R1.2 CC1=COC(N)=N1 AM20090562 [0,0,0,1,0,0|2,0,1]=4 101 B7R1.2 CC1=CSC(Br)=N1 AM20100691 [0,0,0,1,0,0|2,1,0]=4 102 B7R1.2 CC1=CSC(C)=N1 AM20100334 [0,0,0,1,0,0|1,1,0]=3 103 B7R1.2 CC1=CSC(Cl)=N1 AM803610 [0,0,0,1,0,0|2,1,0]=4 104 B7R1.2 CC1=CSC(N)=C1 AM20080364 [0,0,0,1,0,0|2,1,0]=4 105 B7R1.2 CC1=CSC(N)=N1 AM20080431 [0,0,0,1,0,0|2,1,0]=4 106 B7R1.2 CC1=NC(=O)ON1 AM20080700 [0,0,0,1,0,0|3,0,0]=4 107 B7R1.2 CC1=NC(Br)=CN1 AM803290 [0,0,0,1,0,0|3,0,0]=4 108 B7R1.2 CC1=NC(Br)=CS1 AMY34939 [0,0,0,1,0,0|2,1,0]=4 109 B7R1.2 CC1=NC(I)=CN1 AM807433 [0,0,0,1,0,0|3,0,0]=4 110 B7R1.2 CC1=NC=C(N)S1 AMY26047 [0,0,0,1,0,0|2,1,0]=4 111 B7R1.2 CC1=NN(C)C=C1 AM20100648 [0,0,0,1,0,0|3,0,0]=4 112 B7R1.2 CC1=NN=C(Br)O1 AMY41069 [0,0,0,1,0,0|3,0,0]=4 113 B7R1.2 CC1=NN=C(N)O1 AMY10288 [0,0,0,1,0,0|3,0,0]=4 114 B7R1.2 CC1=NSC(=O)O1 AMY14827 [0,0,0,1,0,0|2,0,0]=3 115 B7R1.2 CN1C=CC(=O)N1 AMY281 [0,0,0,1,0,0|2,0,1]=4 116 B7R1.2 CN1CCC(=O)C1 AM20100632 [0,0,0,1,0,0|2,0,1]=4 117 B7R1.2 CN1CCC(=O)C1 AMY25051 [0,0,0,1,0,0|2,0,1]=4 118 B7R1.2 C[C@@H]1CCC(=O)N1 AMY37338 [0,0,0,1,0,0|1,0,2]=4 119 B7R1.2 C[C@H]1CCC(=O)C1 AMY3874 [0,0,0,1,0,0|1,0,2]=4 120 B7R1.2 C[C@H]1CCC(=O)N1 AMY23794 [0,0,0,1,0,0|1,0,2]=4 121 B7R1.2 C[C@H]1CNC(=O)O1 AMY3772 [0,0,0,1,0,0|1,0,2]=4 122 B7R1.2 NC1=NC(=O)CS1 AMY31386 [0,0,0,1,0,0|3,0,0]=4 123 B7R1.2 O=C1C=C(Br)CN1 AMY36765 [0,0,0,1,0,0|3,0,0]=4 124 B7R1.2 O=C1C=CC(=O)N1 AMY236 [0,0,0,1,0,0|2,0,1]=4 125 B7R1.2 O=C1CCC(=O)C1 AM20100026 [0,0,0,1,0,0|2,0,0]=3 126 B7R1.2 O=C1CC[C@H](O)C1 AMY33737 [0,0,0,1,0,0|2,0,1]=4 127 B7R1.2 O=C1CNC(=O)C1 AM20120511 [0,0,0,1,0,0|3,0,0]=4 128 B7R1.2 O=C1CSC(=O)N1 AM20090236 [0,0,0,1,0,0|3,0,0]=4 129 B7R1.2 O=C1CSC(=S)N1 AMY21863 [0,0,0,1,0,0|3,0,0]=4 130 B7R1.2 O=C1OC[C@H](Cl)O1 AMY19473 [0,0,0,1,0,0|2,0,1]=4 131 B7R1.20 CC(=O)CC1CC1 AM20100099 [0,0,0,1,0,0|1,0,2]=4 132 B5R0.5 C=C(C)C(=O)Cl AMY25816 [0,0,0,0,1,0|1,0,0]=2 133 B5R0.5 C=C(C)C(N)=O AMY13351 [0,0,0,0,1,0|1,0,0]=2 134 B5R0.5 C=C(F)C(=O)O AM84938 [0,0,0,0,1,0|2,0,0]=3 135 B5R0.5 CC(=O)C(=O)O AMY6082 [0,0,0,0,1,0|2,0,0]=3 136 B5R0.5 CC(=O)C(=O)[O-] AMY25534 [0,0,0,0,1,0|2,0,0]=3 137 B5R0.5 CC(=O)C(=O)[O-] AMY25673 [0,0,0,0,1,0|2,0,0]=3 138 B5R0.5 CC(=O)C(=O)[O-] AMY25702 [0,0,0,0,1,0|2,0,0]=3 139 B5R0.5 CC(=O)C(C)C AMY11021 [0,0,0,0,1,0|0,0,2]=3 140 B5R0.5 CC(=O)C(F)F AMY6800 [0,0,0,0,1,0|2,0,1]=4 141 B5R0.5 CC(=O)C(O)O AMY25827 [0,0,0,0,1,0|2,0,1]=4 142 B5R0.5 CC(=O)[C@H](C)F AMY5968 [0,0,0,0,1,0|1,0,1]=3 143 B5R0.5 CC(F)=C(F)F AMY37198 [0,0,0,0,1,0|3,0,0]=4 144 B5R0.5 CC(O)C(=O)[O-] AMY37027 [0,0,0,0,1,0|2,0,1]=4 145 B5R0.5 C[C@H](Br)C(=O)O AM81431 [0,0,0,0,1,0|2,0,1]=4 146 B5R0.5 C[C@H](Br)C(=O)O AM81432 [0,0,0,0,1,0|2,0,1]=4 147 B5R0.5 C[C@H](Br)C(=O)O AMY21881 [0,0,0,0,1,0|2,0,1]=4 148 B5R0.5 C[C@H](Br)C(N)=O AMY7273 [0,0,0,0,1,0|2,0,1]=4 149 B5R0.5 C[C@H](Cl)C(=O)Cl AMY40167 [0,0,0,0,1,0|2,0,1]=4 150 B5R0.5 C[C@H](Cl)C(=O)O AM81429 [0,0,0,0,1,0|2,0,1]=4 151 B5R0.5 C[C@H](Cl)C(=O)O AM81430 [0,0,0,0,1,0|2,0,1]=4 152 B5R0.5 C[C@H](Cl)C(=O)O AMY4045 [0,0,0,0,1,0|2,0,1]=4 153 B5R0.5 C[C@H](F)C(=O)O AMY5967 [0,0,0,0,1,0|2,0,1]=4 154 B5R0.5 C[C@H](N)C(=O)O AM20090411 [0,0,0,0,1,0|2,0,1]=4 155 B5R0.5 C[C@H](N)C(=O)O AM20090517 [0,0,0,0,1,0|2,0,1]=4 156 B5R0.5 C[C@H](N)C(=O)O AM20100374 [0,0,0,0,1,0|2,0,1]=4 157 B5R0.5 C[C@H](N)C(N)=O AM20090503 [0,0,0,0,1,0|2,0,1]=4 158 B5R0.5 C[C@H](N)C(N)=O AM81484 [0,0,0,0,1,0|2,0,1]=4 159 B5R0.5 C[C@H](O)C(=O)O AM87208 [0,0,0,0,1,0|2,0,1]=4 160 B5R0.5 C[C@H](O)C(=O)[O-] AMY22237 [0,0,0,0,1,0|2,0,1]=4 161 B5R0.5 NC(=O)C(N)=O AMY23583 [0,0,0,0,1,0|3,0,0]=4 162 B5R0.5 O=C(O)C(=O)O AMY514 [0,0,0,0,1,0|3,0,0]=4 163 B5R0.5 O=C(O)C(=O)O AMY6125 [0,0,0,0,1,0|3,0,0]=4 164 B7R0.6 CC(=O)CCC(=O)O AM20080171 [0,0,0,0,0,1|3,0,0]=4 165 B7R0.6 CC(=O)CCC(C)=O AMY25528 [0,0,0,0,0,1|2,0,0]=3 166 B7R0.6 CC(=O)CNC(C)=O AMY32031 [0,0,0,0,0,1|2,0,0]=3 167 B7R0.6 CC(=O)NCC(=O)O AM81782 [0,0,0,0,0,1|3,0,0]=4 168 B7R0.6 CC(=O)OCC(=O)Cl AMY39424 [0,0,0,0,0,1|2,0,0]=3 169 B7R0.6 CC(=O)OCC(=O)O AMY3826 [0,0,0,0,0,1|2,0,0]=3 170 B7R0.6 CC(=O)\C=C\N(C)C AMY31395 [0,0,0,0,0,1|2,0,1]=4 171 B7R0.6 CC(C)OCC(=O)O AMY4704 [0,0,0,0,0,1|1,0,2]=4 172 B4R0.1 C=C(Br)C=O AMY19362 [2,0,0,0,0,0|1,0,0]=3 173 B4R0.1 C=C(C)C=O AMY28760 [2,0,0,0,0,0|0,0,0]=2 174 B4R0.1 C=C(C)CBr AM85592 [2,0,0,0,0,0|1,0,1]=4 175 B4R0.1 C=C(C)CN AMY13356 [2,0,0,0,0,0|1,0,1]=4 176 B4R0.1 C=C=C(C)C AMY42296 [2,0,0,0,0,0|1,0,1]=4 177 B4R0.1 C=CC(=C)C AMY37001 [2,0,0,0,0,0|0,0,1]=3 178 B4R0.1 C=CC(=O)Cl AMY18873 [2,0,0,0,0,0|1,0,0]=3 179 B4R0.1 C=CC(=O)[O-] AMY3817 [2,0,0,0,0,0|1,0,0]=3 180 B4R0.1 C=C[C@H](C)Cl AMY617 [2,0,0,0,0,0|1,0,1]=4 181 B4R0.1 C=C[C@H](C)O AMY1257 [2,0,0,0,0,0|0,0,2]=4 182 B4R0.1 C=C[N+](=O)[O-] AMY36706 [2,0,0,0,0,0|2,0,0]=4 183 B4R0.1 CC(=O)C#N AMY39183 [2,0,0,0,0,0|1,0,1]=4 184 B4R0.1 CC(=O)CBr AM85840 [2,0,0,0,0,0|1,0,1]=4 185 B4R0.1 CC(=O)CN AMY15017 [2,0,0,0,0,0|1,0,1]=4 186 B4R0.1 CC(=O)CN AMY25062 [2,0,0,0,0,0|1,0,1]=4 187 B4R0.1 CC(=O)NN AM20080014 [2,0,0,0,0,0|2,0,0]=4 188 B4R0.1 CC(=O)NO AM20100343 [2,0,0,0,0,0|2,0,0]=4 189 B4R0.1 CC(C)=CBr AM85707 [2,0,0,0,0,0|1,0,1]=4 190 B4R0.1 CCC(=O)Cl AMY4112 [2,0,0,0,0,0|1,0,1]=4 191 B4R0.1 CCC(=O)O AMY4114 [2,0,0,0,0,0|1,0,1]=4 192 B4R0.1 CCC(=O)[O-] AMY22300 [2,0,0,0,0,0|1,0,1]=4 193 B4R0.1 CCC(=O)[O-] AMY37013 [2,0,0,0,0,0|1,0,1]=4 194 B4R0.1 CNC(C)=O AMY4115 [2,0,0,0,0,0|1,0,0]=3 195 B4R0.1 CNC(N)=O AMY40217 [2,0,0,0,0,0|2,0,0]=4 196 B4R0.1 COC(=N)N AM85805 [2,0,0,0,0,0|2,0,0]=4 197 B4R0.1 COC(=N)N AMY8981 [2,0,0,0,0,0|2,0,0]=4 198 B4R0.1 COC(N)=O AMY4044 [2,0,0,0,0,0|1,0,0]=3 199 B4R0.1 O=CC(=O)O AMY40947 [2,0,0,0,0,0|2,0,0]=4 200 B4R0.2 C=CCNC AMY13350 [2,0,0,0,0,0|2,0,0]=4 201 B4R0.2 C=CCOC AM20100534 [2,0,0,0,0,0|2,0,0]=4 202 B6R0.1 C#CC(=O)OCC AM20100525 [1,1,0,0,0,0|0,0,2]=4 203 B6R0.1 C=CC(=O)OCC AMY40211 [1,1,0,0,0,0|0,0,2]=4 204 B6R0.1 CC#CC(=O)OC AMY1234 [1,1,0,0,0,0|1,0,1]=4 205 B6R0.1 CCNC(=O)CCl AM802871 [1,1,0,0,0,0|1,0,1]=4 206 B6R0.1 CCNC(=O)NC AM85700 [1,1,0,0,0,0|1,0,1]=4 207 B6R0.1 CCOC(=N)CCl AMY15738 [1,1,0,0,0,0|1,0,1]=4 208 B6R0.1 CCOC(=O)CBr AM20070701 [1,1,0,0,0,0|0,0,1]=3 209 B6R0.1 CCOC(=O)CC AMY21941 [1,1,0,0,0,0|0,0,1]=3 210 B6R0.1 CCOC(=O)CN AM81786 [1,1,0,0,0,0|0,0,1]=3 211 B6R0.1 CCOC(=O)NC AMY3767 [1,1,0,0,0,0|0,0,1]=3 212 B6R0.1 CCOC(=O)NN AMY23328 [1,1,0,0,0,0|1,0,1]=4 213 B6R0.1 CC\C=C(/C)C=O AMY2564 [1,1,0,0,0,0|1,0,1]=4 214 B6R0.1 CNCC(=O)OC AM82645 [1,1,0,0,0,0|2,0,0]=4 215 B6R0.1 COC(=O)CSC AMY10908 [1,1,0,0,0,0|2,0,0]=4 216 B6R0.1 COC(=O)OCCl AMY37648 [1,1,0,0,0,0|1,0,1]=4 217 B6R0.1 COC(=O)\C=C\I AMY21721 [1,1,0,0,0,0|2,0,0]=4 218 B6R0.1 COCC(=O)OC AMY4063 [1,1,0,0,0,0|2,0,0]=4 219 B6R0.1 C\C=C\C(=O)OC AMY15442 [1,1,0,0,0,0|1,0,0]=3 220 B6R0.3 C=CN(C)C(C)=O AMY3934 [1,1,0,0,0,0|1,0,0]=3 221 B6R0.3 CC(=O)[C@@H](C)C=O AMY6397 [1,1,0,0,0,0|2,0,0]=4 222 B6R0.3 CCC(=O)C(C)=O AMY4046 [1,1,0,0,0,0|1,0,1]=4 223 B6R0.3 CCN(O)C(C)=O AMY33549 [1,1,0,0,0,0|1,0,1]=4 224 B6R0.3 COC(=O)C(C)=O AMY40825 [1,1,0,0,0,0|2,0,0]=4 225 B6R0.3 CON(C)C(C)=O AM1188 [1,1,0,0,0,0|2,0,0]=4 226 B6R0.3 C\C=C(/C)C(C)=O AMY4030 [1,1,0,0,0,0|1,0,0]=3 227 B6R0.3 C\C=C(\C)C(=O)O AMY19230 [1,1,0,0,0,0|2,0,0]=4 228 B6R0.4 C#CCOC(C)=O AM90264 [1,1,0,0,0,0|0,0,2]=4 229 B6R0.4 C=CCCC(=O)Cl AMY808 [1,1,0,0,0,0|2,0,0]=4 230 B6R0.4 C=CCCC(=O)O AMY12553 [1,1,0,0,0,0|2,0,0]=4 231 B6R0.4 C=CCCC(C)=O AM84335 [1,1,0,0,0,0|1,0,0]=3 232 B6R0.4 C=CCOC(=O)Cl AMY3928 [1,1,0,0,0,0|1,0,0]=3 233 B6R0.4 C=CCOC(C)=O AMY22115 [1,1,0,0,0,0|0,0,0]=2 234 B6R0.4 C=CNCC(=O)O AMY22733 [1,1,0,0,0,0|2,0,0]=4 235 B6R0.4 CC(=O)NCCN AMY40665 [1,1,0,0,0,0|1,0,1]=4 236 B6R0.4 CCCOC(=O)Cl AMY3779 [1,1,0,0,0,0|1,0,1]=4 237 B6R0.4 CCOCC(=O)O AMY4062 [1,1,0,0,0,0|1,0,1]=4 238 B6R0.4 NC(=O)OCCCl AMY19018 [1,1,0,0,0,0|1,0,1]=4 239 B6R0.4 O=C(O)\C=C\CBr AMY7050 [1,1,0,0,0,0|2,0,0]=4 240 B6R0.5 CCOS(C)(=O)=O AMY38422 [1,1,0,0,0,0|1,0,1]=4 241 B6R0.7 CC(=O)C(C)(C)N AM806454 [0,1,0,0,1,0|0,0,2]=4 242 B6R0.7 CC(=O)C(C)(C)O AM84347 [0,1,0,0,1,0|0,0,2]=4 243 B8R0.9 CC(=O)OCC(=O)CCl AMY14363 [0,1,0,0,0,1|1,0,0]=3 244 B8R0.9 CC=C(C)C=CC(=O)O AM806492 [0,1,0,0,0,1|2,0,0]=4 245 B8R0.9 CCC(=O)COC(C)=O AM20080565 [0,1,0,0,0,1|1,0,0]=3 246 B8R0.23 CC(=O)N[C@@H](C)C(C)=O AMY4869 [0,1,0,0,0,1|2,0,0]=4 247 B8R0.23 CC(=O)O[C@@H](C)C(=O)O AMY24695 [0,1,0,0,0,1|2,0,0]=4 248 B8R0.23 CC(=O)O[C@@H](C)C(C)=O AM20080686 [0,1,0,0,0,1|1,0,0]=3 249 B8R0.2 COC(=O)[C@@H](Br)C(C)=O AM85319 [0,2,0,0,0,0|2,0,0]=4 250 B8R0.5 CC(C)OC(=O)OCCl AM20090681 [0,2,0,0,0,0|0,0,2]=4 251 B8R0.5 COCC(=O)OC(C)C AMY3876 [0,2,0,0,0,0|0,0,2]=4 252 B8R0.19 C=CC(=O)OC(=O)C=C AMY40703 [0,2,0,0,0,0|1,0,1]=4 253 B8R0.19 CCC(=O)CC(=O)CC AMY8840 [0,2,0,0,0,0|2,0,0]=4 254 B8R0.19 CCC(=O)CC(=O)OC AMY21932 [0,2,0,0,0,0|2,0,0]=4 255 B8R0.19 COC(=N)CC(=O)OC AMY31003 [0,2,0,0,0,0|2,0,0]=4 256 B8R0.19 COC(=O)CC(=O)OC AMY10014 [0,2,0,0,0,0|2,0,0]=4 257 B8R0.19 COC(=O)\C=C(/C)C=O AMY39195 [0,2,0,0,0,0|1,0,0]=3 258 B8R0.19 O=C(CBr)OC(=O)CBr AM806585 [0,2,0,0,0,0|1,0,0]=3 259 B8R0.19 O=C(CCl)OC(=O)CCl AMY18521 [0,2,0,0,0,0|1,0,0]=3 260 B8R0.24 CC(C)(C)OC(=O)CBr AMY28710 [0,2,0,0,0,0|0,0,2]=4 261 B8R0.24 CC(C)(C)OC(=O)CN AM20090346 [0,2,0,0,0,0|0,0,2]=4 262 B8R0.24 CC(C)(C)OC(=O)CN AM62773 [0,2,0,0,0,0|0,0,2]=4 263 B8R0.24 CC(C)(C)OC(=O)CO AMY202100090 [0,2,0,0,0,0|0,0,2]=4 264 B8R0.24 CC(C)(C)OC(=O)C[Zn+] AMY31010 [0,2,0,0,0,0|0,0,2]=4 265 B8R0.24 CCC(=O)OC(C)(C)C AMY3894 [0,2,0,0,0,0|0,0,2]=4 266 B8R0.24 CNC(=O)OC(C)(C)C AMY31371 [0,2,0,0,0,0|0,0,2]=4 267 B6R1.2 BrC1=CC=CO1 AMY11096 [1,0,0,1,0,0|1,0,1]=4 268 B6R1.2 C=C1CCOC1 AMY6014 [1,0,0,1,0,0|2,0,0]=4 269 B6R1.2 CC1=CC=CN1 AMY18997 [1,0,0,1,0,0|1,0,1]=4 270 B6R1.2 CC1=CC=CO1 AMY11051 [1,0,0,1,0,0|0,0,1]=3 271 B6R1.2 CC1=CC=CS1 AMY23234 [1,0,0,1,0,0|0,1,1]=4 272 B6R1.2 CC1=CC=NO1 AM20100414 [1,0,0,1,0,0|1,0,1]=4 273 B6R1.2 CC1=CCCC1 AMY6023 [1,0,0,1,0,0|1,0,1]=4 274 B6R1.2 CC1=CN=C[Tb]1 AMY33347 [1,0,0,1,0,0|2,0,0]=4 275 B6R1.2 CC1=CNC=C1 AMY14173 [1,0,0,1,0,0|2,0,0]=4 276 B6R1.2 CC1=CNC=N1 AMY23279 [1,0,0,1,0,0|2,0,0]=4 277 B6R1.2 CC1=COC=N1 AMY32123 [1,0,0,1,0,0|1,0,1]=4 278 B6R1.2 CC1=CSC=C1 AMY40151 [1,0,0,1,0,0|1,1,0]=4 279 B6R1.2 CC1=CSC=N1 AM20100646 [1,0,0,1,0,0|1,1,0]=4 280 B6R1.2 CC1=NC=CN1 AM20100647 [1,0,0,1,0,0|2,0,0]=4 281 B6R1.2 CC1=NC=CO1 AMY24088 [1,0,0,1,0,0|1,0,0]=3 282 B6R1.2 CC1=NC=CS1 AM20090566 [1,0,0,1,0,0|1,1,0]=4 283 B6R1.2 CC1=NN=CO1 AM20090539 [1,0,0,1,0,0|2,0,0]=4 284 B6R1.2 IC1=NC=CO1 AMY33608 [1,0,0,1,0,0|2,0,0]=4 285 B6R1.2 NC1=NC=CO1 AM20100168 [1,0,0,1,0,0|2,0,0]=4 286 B6R1.2 O=C1C=CCC1 AM61702 [1,0,0,1,0,0|1,0,0]=3 287 B6R1.2 O=C1C=CCO1 AM20100212 [1,0,0,1,0,0|0,0,2]=4 288 B6R1.2 O=C1CC=NN1 AMY11924 [1,0,0,1,0,0|2,0,0]=4 289 B6R1.2 O=C1CCCC1 AMY37126 [1,0,0,1,0,0|1,0,1]=4 290 B6R1.2 O=C1CCCN1 AMY25506 [1,0,0,1,0,0|1,0,1]=4 291 B6R1.2 O=C1CCNC1 AM20120384 [1,0,0,1,0,0|2,0,0]=4 292 B6R1.2 O=C1CCNC1 AMY6183 [1,0,0,1,0,0|2,0,0]=4 293 B6R1.2 O=C1CCNN1 AMY39277 [1,0,0,1,0,0|2,0,0]=4 294 B6R1.2 O=C1CCOC1 AM20090235 [1,0,0,1,0,0|2,0,0]=4 295 B6R1.2 O=C1CCSC1 AMY23378 [1,0,0,1,0,0|2,0,0]=4 296 B6R1.2 O=C1NC=CN1 AMY20044 [1,0,0,1,0,0|2,0,0]=4 297 B6R1.2 O=C1NCCO1 AMY39498 [1,0,0,1,0,0|1,0,1]=4 298 B6R1.2 O=C1OC=CO1 AMY10397 [1,0,0,1,0,0|1,0,0]=3 299 B6R1.5 CC1CC(=O)C1 AM806996 [1,0,0,1,0,0|1,0,1]=4 300 B6R1.11 CC(=O)C1CC1 AM83286 [1,0,0,1,0,0|1,0,1]=4 301 B8R1.3 CC1=CC=C(C)N=N1 AMY13381 [0,0,0,1,0,1|2,0,0]=4 302 B8R1.3 CC1=CN=C(C)C=N1 AMY23196 [0,0,0,1,0,1|2,0,0]=4 303 B8R1.3 CC1=CN=C(C)N=C1 AMY15639 [0,0,0,1,0,1|2,0,0]=4 304 B8R1.3 CC1=NNC(=O)C=C1 AM20080238 [0,0,0,1,0,1|1,0,1]=4 305 B8R1.3 CC1=NNC(=O)CC1 AMY24896 [0,0,0,1,0,1|1,0,1]=4 306 B8R1.3 O=C1CCC(=O)NC1 AMY24844 [0,0,0,1,0,1|2,0,0]=4 307 B8R1.23 C=C1CC(C(=O)O)C1 AM20070595 [0,0,0,1,0,1|2,0,0]=4 308 B8R1.1 CC1=CC=C(C=O)N1 AM803022 [0,1,0,1,0,0|1,0,1]=4 309 B8R1.1 CC1=CC=C(C=O)O1 AMY23296 [0,1,0,1,0,0|0,0,1]=3 310 B8R1.1 CC1=CC=C(C=O)S1 AM803182 [0,1,0,1,0,0|0,1,1]=4 311 B8R1.1 CC1=CC=C(CN)S1 AM802866 [0,1,0,1,0,0|1,1,0]=4 312 B8R1.1 CC1=CC=C(CN)S1 AMY4599 [0,1,0,1,0,0|1,1,0]=4 313 B8R1.1 CC1=CC=C(CO)O1 AMY41923 [0,1,0,1,0,0|1,0,0]=3 314 B8R1.1 CC1=CC=C(CO)S1 AM804180 [0,1,0,1,0,0|1,1,0]=4 315 B8R1.1 CC1=CN=C(C=O)N1 AM20080647 [0,1,0,1,0,0|2,0,0]=4 316 B8R1.1 CC1=CN=C(CN)O1 AMY35786 [0,1,0,1,0,0|1,0,0]=3 317 B8R1.1 CC1=CN=C(CN)O1 AMY35797 [0,1,0,1,0,0|1,0,0]=3 318 B8R1.1 CC1=CN=C(CO)S1 AMY17419 [0,1,0,1,0,0|1,1,0]=4 319 B8R1.1 CC1=CNC(C=O)=C1 AMY17862 [0,1,0,1,0,0|2,0,0]=4 320 B8R1.1 CC1=CNC(CN)=N1 AM803982 [0,1,0,1,0,0|2,0,0]=4 321 B8R1.1 CC1=COC(CN)=N1 AM806396 [0,1,0,1,0,0|1,0,1]=4 322 B8R1.1 CC1=CSC(C=O)=C1 AM804119 [0,1,0,1,0,0|2,0,0]=4 323 B8R1.1 CC1=CSC(C=O)=N1 AM803186 [0,1,0,1,0,0|2,0,0]=4 324 B8R1.1 CC1=CSC(CN)=C1 AM802868 [0,1,0,1,0,0|1,1,0]=4 325 B8R1.1 CC1=CSC(CO)=C1 AM804307 [0,1,0,1,0,0|1,1,0]=4 326 B8R1.1 CC1=NC(CCl)=CS1 AM804353 [0,1,0,1,0,0|1,1,0]=4 327 B8R1.1 CC1=NC(CCl)=CS1 AMY202100079 [0,1,0,1,0,0|1,1,0]=4 328 B8R1.1 CC1=NC(CN)=CS1 AMY4585 [0,1,0,1,0,0|1,1,0]=4 329 B8R1.1 CC1=NC(CO)=CO1 AMY15126 [0,1,0,1,0,0|1,0,1]=4 330 B8R1.1 CC1=NC(CO)=CS1 AMY4969 [0,1,0,1,0,0|1,1,0]=4 331 B8R1.1 CC1=NC=C(CCl)S1 AM806403 [0,1,0,1,0,0|1,1,0]=4 332 B8R1.1 CC1=NC=C(CN)S1 AM804163 [0,1,0,1,0,0|1,1,0]=4 333 B8R1.1 CC1=NC=C(CO)N1 AM806536 [0,1,0,1,0,0|2,0,0]=4 334 B8R1.1 CC1=NC=C(CO)O1 AMY202003195 [0,1,0,1,0,0|1,0,0]=3 335 B8R1.1 CC1=NC=C(CO)S1 AM804044 [0,1,0,1,0,0|1,1,0]=4 336 B8R1.1 CC1=NN=C(C=O)O1 AMY202100035 [0,1,0,1,0,0|2,0,0]=4 337 B8R1.1 CC1=NN=C(CCl)O1 AM803832 [0,1,0,1,0,0|2,0,0]=4 338 B8R1.1 O=C1C=C[C@@H](CO)O1 AMY42490 [0,1,0,1,0,0|0,0,2]=4 339 B8R1.1 O=C1CC[C@H](CO)O1 AM20090484 [0,1,0,1,0,0|0,0,2]=4 340 B8R1.1 O=CC1=CC=C(Br)O1 AM20090109 [0,1,0,1,0,0|1,0,1]=4 341 B8R1.1 OCC1=NC=C(Br)O1 AMY27833 [0,1,0,1,0,0|2,0,0]=4 342 B8R1.4 CC1=CC(=O)NN=C1 AM20100351 [0,1,0,1,0,0|2,0,0]=4 343 B8R1.4 CC1=CC(C)=NC=C1 AM20050655 [0,1,0,1,0,0|2,0,0]=4 344 B8R1.4 CC1=CC(C)=NC=N1 AM20080404 [0,1,0,1,0,0|2,0,0]=4 345 B8R1.4 CC1=CC=CC(C)=N1 AM10711 [0,1,0,1,0,0|2,0,0]=4 346 B8R1.4 CC1=CN=CC(C)=C1 AM81286 [0,1,0,1,0,0|2,0,0]=4 347 B8R1.4 CC1=CN=CC(C)=N1 AMY23200 [0,1,0,1,0,0|2,0,0]=4 348 B8R1.4 O=C1CCCC(=O)C1 AM20070493 [0,1,0,1,0,0|2,0,0]=4 349 B8R1.4 O=C1CCCC(=O)N1 AMY400 [0,1,0,1,0,0|2,0,0]=4 350 B8R1.4 O=C1CCCC(=O)O1 AM1000009 [0,1,0,1,0,0|1,0,0]=3 351 B8R1.4 O=C1CCNC(=O)C1 AM20100242 [0,1,0,1,0,0|2,0,0]=4 352 B8R1.4 O=C1CNCC(=O)N1 AMY34235 [0,1,0,1,0,0|2,0,0]=4 353 B8R1.18 CC1=CC(I)=C(C)S1 AMY5425 [0,1,0,1,0,0|1,1,0]=4 354 B8R1.18 CC1=CN(C)C(Br)=N1 AM803566 [0,1,0,1,0,0|2,0,0]=4 355 B8R1.18 CC1=C[C@H](Cl)OC1=O AMY31036 [0,1,0,1,0,0|1,0,1]=4 356 B8R1.18 CC1=NC(C)=C(Br)S1 AM20090367 [0,1,0,1,0,0|1,1,0]=4 357 B8R1.18 CN1CC(=O)NC1=N AMY8979 [0,1,0,1,0,0|2,0,0]=4 358 B8R1.18 C[C@@H]1NC(=O)OC1=O AM84795 [0,1,0,1,0,0|2,0,0]=4 359 B8R1.18 O=C1C=C(Br)C(=O)O1 AMY844 [0,1,0,1,0,0|1,0,1]=4 360 B8R1.34 CC(=O)C=C1COC1 AMY5443 [0,1,0,1,0,0|1,0,1]=4 361 B8R1.50 CC1=CSC(C)=C1Br AMY28879 [0,1,0,1,0,0|1,1,0]=4 362 B8R1.50 CC1C(=O)CCC1=O AM20100124 [0,1,0,1,0,0|2,0,0]=4 363 B8R1.50 CN1C(=O)CCC1=O AMY228 [0,1,0,1,0,0|2,0,0]=4 364 B8R1.50 O=C1CCC(=O)N1Br AMY24078 [0,1,0,1,0,0|2,0,0]=4 365 B8R1.50 O=C1CCC(=O)N1Cl AMY31063 [0,1,0,1,0,0|2,0,0]=4 366 B8R1.50 O=C1CCC(=O)N1I AM20100260 [0,1,0,1,0,0|2,0,0]=4 367 B8R1.50 O=C1CCC(=O)N1O AM83849 [0,1,0,1,0,0|2,0,0]=4 368 B8R0.28 C=C(C)CCCC(C)=O AMY15319 [0,0,0,0,0,2|1,0,0]=3 369 B8R0.28 C=C(C)CNCC(=C)C AMY13330 [0,0,0,0,0,2|2,0,0]=4