0 B10R1.18 BrC(Br)=CC1=CC=CC=C1 12060 [0,0,0,0,0,0|2,0,1]=3 1 B10R1.18 CC(=O)CC1=CC=CC=C1 12126 [0,0,0,0,0,0|1,0,0]=1 2 B10R1.18 CC(=O)NC1=CC=CC=C1 20132 [0,0,0,0,0,0|2,0,0]=2 3 B10R1.18 N=C(N)CC1=CC=CC=C1 745 [0,0,0,0,0,0|2,0,0]=2 4 B10R1.18 O=C(O)CC1=CC=CC=C1 12288 [0,0,0,0,0,0|0,0,0]=0 5 B10R1.18 O=C(O)CC1=CC=CC=C1 15735 [0,0,0,0,0,0|0,0,0]=0 6 B9R1.8 Br\C=C/C1=CC=CC=C1 102665 [1,0,0,0,0,0|1,0,1]=3 7 B9R1.8 COCC1=CC=CC=C1 102522 [1,0,0,0,0,0|2,0,0]=3 8 B9R1.8 C\C=C/C1=CC=CC=C1 103008 [1,0,0,0,0,0|1,0,1]=3 9 B9R1.8 F\C=C\C1=CC=CC=C1 102664 [1,0,0,0,0,0|1,0,1]=3 10 B9R1.8 I\C=C\C1=CC=CC=C1 103084 [1,0,0,0,0,0|1,0,1]=3 11 B9R1.8 NCCC1=CC=CC=C1 11614 [1,0,0,0,0,0|1,0,1]=3 12 B9R1.8 NCCC1=CC=CC=C1 12328 [1,0,0,0,0,0|1,0,1]=3 13 B9R1.8 [N-]=[N+]=NC1=CC=CC=C1 22277 [1,0,0,0,0,0|3,0,0]=4 14 B9R1.8 [NH3+]CCC1=CC=CC=C1 12322 [1,0,0,0,0,0|1,0,1]=3 15 B11R1.20 CC(=O)NC1=CC=C(Br)C=C1 15704 [0,1,0,0,0,0|2,0,0]=3 16 B11R1.20 CC(C)CC1=CC=C(O)C=C1 17197 [0,1,0,0,0,0|2,0,1]=4 17 B11R1.20 N(C(C)=O)C1=NC=C(Cl)C=C1 20662 [0,1,0,0,0,0|3,0,0]=4 18 B11R1.20 NC(=O)NC1=CC=C(Cl)C=C1 532 [0,1,0,0,0,0|2,0,0]=3 19 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 102171 [0,1,0,0,0,0|0,0,0]=1 20 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 20773 [0,1,0,0,0,0|0,0,0]=1 21 B11R1.36 CC(C)C(C)C1=CC=CC=C1 15777 [0,1,0,0,0,0|2,0,1]=4 22 B11R1.36 NC(=O)C(N)C1=CC=CC=C1 19771 [0,1,0,0,0,0|1,0,0]=2 23 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 102534 [0,1,0,0,0,0|0,0,0]=1 24 B11R1.36 [NH3+]C(C(=O)O)C1=CC=CC=C1 102467 [0,1,0,0,0,0|0,0,0]=1 25 B11R1.40 CC\C(C)=C/C1=CC=CC=C1 100800 [0,1,0,0,0,0|2,0,1]=4 26 B11R1.40 CC\C(I)=C/C1=CC=CC=C1 102669 [0,1,0,0,0,0|2,0,1]=4 27 B11R1.40 COC(=S)NC1=CC=CC=C1 10045 [0,1,0,0,0,0|1,1,0]=3 28 B11R1.40 FCC(F)CC1=CC=CC=C1 102361 [0,1,0,0,0,0|2,0,1]=4 29 B11R1.86 CC(=O)NC1=CC=CC=C1Br 17116 [0,1,0,0,0,0|2,0,0]=3 30 B11R1.86 CC(=O)NC1=CC=CC=C1Cl 17122 [0,1,0,0,0,0|2,0,0]=3 31 B11R1.86 O=C(O)CC1=C(Br)C=CC=C1 102170 [0,1,0,0,0,0|0,0,0]=1 32 B11R1.86 O=C(O)CC1=C(O)C=CC=C1 20759 [0,1,0,0,0,0|0,0,0]=1 33 B11R1.86 O=C(O)CC1=CC=CC=C1Cl 102178 [0,1,0,0,0,0|0,0,0]=1 34 B11R1.86 O=C(O)CC1=CC=CC=C1O 19282 [0,1,0,0,0,0|0,0,0]=1 35 B11R1.157 CC(=O)NC1=CC=CC(Cl)=C1 17121 [0,1,0,0,0,0|2,0,0]=3 36 B11R1.157 N(C(C)=O)C1=NC(C)=CC=C1 20549 [0,1,0,0,0,0|3,0,0]=4 37 B11R1.157 O=C(O)CC1=CC(Cl)=CC=C1 102173 [0,1,0,0,0,0|0,0,0]=1 38 B11R1.157 O=C(O)CC1=CC=CC(Br)=C1 102158 [0,1,0,0,0,0|0,0,0]=1 39 B11R1.157 O=C(O)CC1=CC=CC(F)=C1 102175 [0,1,0,0,0,0|0,0,0]=1 40 B11R1.509 O=S(=O)(Cl)OC1=CC=CC=C1 100229 [0,1,0,0,0,0|2,0,1]=4 41 B11R1.509 O=S(=O)(F)CC1=CC=CC=C1 20763 [0,1,0,0,0,0|1,0,1]=3 42 B11R1.509 [O-][N+](O)(O)[Hg]C1=CC=CC=C1 20771 [0,1,0,0,0,0|2,0,1]=4 43 B11R2.10 CC1=NC2=CC=CC=C2N1 11720 [0,0,0,1,0,0|3,0,0]=4 44 B11R2.10 NC1=NC2=CC=CC=C2N1 500 [0,0,0,1,0,0|3,0,0]=4 45 B11R2.10 S=C1NC2=CC=CC=C2O1 18932 [0,0,0,1,0,0|1,1,0]=3 46 B11R2.10 SC1=NC2=C(C=CC=C2)N1 520 [0,0,0,1,0,0|2,1,0]=4 47 B11R2.10 SC1=NC2=CC=CC=C2O1 10015 [0,0,0,1,0,0|1,1,0]=3 48 B11R2.59 CC1(C)CC2=CC=CC=C21 16581 [0,0,0,1,0,0|2,0,1]=4 49 B11R2.59 CC1(O)CC2=CC=CC=C21 16426 [0,0,0,1,0,0|1,0,1]=3 50 B11R2.59 ClC1(Cl)CC2=CC=CC=C21 16569 [0,0,0,1,0,0|2,0,1]=4 51 B11R2.59 [2H]C1(O)CC2=CC=CC=C21 16155 [0,0,0,1,0,0|1,0,1]=3 52 B9R1.6 NC(=S)C1=CC=CN=C1 20784 [0,0,0,0,1,0|2,1,0]=4 53 B9R1.6 O=C(O)C1=CC=CC=C1 15736 [0,0,0,0,1,0|0,0,0]=1 54 B9R1.6 O=C(O)C1=CC=CN=C1 20778 [0,0,0,0,1,0|1,0,0]=2 55 B11R1.91 C=C(C)\C=C/C1=CC=CC=C1 100560 [0,0,0,0,0,1|2,0,1]=4 56 B11R1.91 C=C(C)\C=C\C1=CC=CC=C1 100556 [0,0,0,0,0,1|2,0,1]=4 57 B11R1.91 O=C(O)CCC1=CC=CC=C1 19283 [0,0,0,0,0,1|0,0,0]=1 58 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 12253 [0,0,0,0,0,1|0,0,1]=2 59 B11R1.91 O=S([O-])NCC1=CC=CC=C1 102536 [0,0,0,0,0,1|1,0,1]=3 60 B11R1.91 O=[N+]([O-])NNC1=CC=CC=C1 22288 [0,0,0,0,0,1|2,0,1]=4 61 B8R0.4 C=C\C=C\C=C\CCC 102625 [1,0,1,0,0,0|1,0,1]=4 62 B8R1.2 NCC1=NC=CC=C1 21601 [2,0,0,0,0,0|2,0,0]=4 63 B10R1.1 NCCC1=CC=C(O)C=C1 15431 [1,1,0,0,0,0|1,0,1]=4 64 B10R1.1 NCCC1=CC=C(O)C=C1 17135 [1,1,0,0,0,0|1,0,1]=4 65 B10R1.1 O\N=CC1=CC=C(Br)C=C1 20648 [1,1,0,0,0,0|1,0,1]=4 66 B10R1.1 O\N=CC1=CC=C(C)C=C1 20713 [1,1,0,0,0,0|1,0,1]=4 67 B10R1.1 O\N=C\C1=CC=C(Cl)C=C1 19845 [1,1,0,0,0,0|1,0,1]=4 68 B10R1.1 O\N=C\C1=CC=C(O)C=C1 15709 [1,1,0,0,0,0|1,0,1]=4 69 B10R1.4 CC1=CC=CC=C1NC=O 20052 [1,1,0,0,0,0|1,0,0]=3 70 B10R1.4 O\N=CC1=CC=CC=C1Br 20508 [1,1,0,0,0,0|1,0,1]=4 71 B10R1.10 N#CCC1=CC=CC(F)=C1 102623 [1,1,0,0,0,0|1,0,1]=4 72 B10R1.10 NCCC1=CC(O)=CC=C1 17137 [1,1,0,0,0,0|1,0,1]=4 73 B10R1.10 O\N=C\C1=CC=CC(Br)=C1 102460 [1,1,0,0,0,0|1,0,1]=4 74 B10R1.10 O\N=C\C1=CC=CC(Cl)=C1 102223 [1,1,0,0,0,0|1,0,1]=4 75 B10R1.10 O\N=C\C1=CC=CC(O)=C1 102535 [1,1,0,0,0,0|1,0,1]=4 76 B10R1.15 CC(C#N)C1=CC=CC=C1 14750 [1,1,0,0,0,0|1,0,1]=4 77 B10R1.15 C\C(=C/Cl)C1=CC=CC=C1 103092 [1,1,0,0,0,0|1,0,1]=4 78 B10R1.15 C\C(=N/O)C1=CC=CC=C1 16747 [1,1,0,0,0,0|1,0,1]=4 79 B10R1.15 C\C=C(\C)C1=CC=CC=C1 103072 [1,1,0,0,0,0|1,0,1]=4 80 B10R1.15 NCC(O)C1=CC=CC=C1 12321 [1,1,0,0,0,0|1,0,1]=4 81 B10R1.15 N\C(=N\O)C1=CC=CC=C1 12254 [1,1,0,0,0,0|1,0,1]=4 82 B10R1.15 OCC(O)C1=CC=CC=C1 731 [1,1,0,0,0,0|0,0,1]=3 83 B10R1.15 O\N=C(\O)C1=CC=CC=C1 12250 [1,1,0,0,0,0|1,0,1]=4 84 B10R1.17 C=C\C=C\C1=CC=CC=C1 103200 [1,1,0,0,0,0|1,0,1]=4 85 B10R1.17 CC\C=C\C1=CC=CC=C1 102672 [1,1,0,0,0,0|1,0,1]=4 86 B10R1.17 CO\C=C\C1=CC=CC=C1 103085 [1,1,0,0,0,0|0,0,1]=3 87 B10R1.17 N#C[Se]CC1=CC=CC=C1 20016 [1,1,0,0,0,0|1,0,1]=4 88 B10R1.17 O=CNNC1=CC=CC=C1 16370 [1,1,0,0,0,0|1,0,0]=3 89 B10R1.13 CC1=CC=C(C(=O)O)C=C1 15778 [0,1,0,0,1,0|0,0,0]=2 90 B10R1.13 NC(=O)C1=CC=C(Cl)N=C1 20768 [0,1,0,0,1,0|2,0,0]=4 91 B10R1.13 O=C(O)C1=CC=C(F)C=C1 101191 [0,1,0,0,1,0|0,0,0]=2 92 B10R1.13 O=C(O)C1=CC=C(F)C=N1 100749 [0,1,0,0,1,0|1,0,0]=3 93 B10R1.13 O=C(O)C1=CC=C(O)C=C1 15302 [0,1,0,0,1,0|0,0,0]=2 94 B10R1.13 O=C(O)C1=CN=C(F)C=C1 100678 [0,1,0,0,1,0|1,0,0]=3 95 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 101615 [0,1,0,0,1,0|1,0,0]=3 96 B10R1.13 O=[N+]([O-])C1=CC=C(O)C=C1 20068 [0,1,0,0,1,0|1,0,1]=4 97 B10R1.61 CC1=C(C(=O)O)C=NC=C1 15747 [0,1,0,0,1,0|1,0,0]=3 98 B10R1.61 CC1=C(C(=O)O)C=NC=C1 15765 [0,1,0,0,1,0|1,0,0]=3 99 B10R1.61 CC1=C(C(N)=O)C=NC=C1 15751 [0,1,0,0,1,0|2,0,0]=4 100 B10R1.61 CC1=CC=CC=C1C(=O)Br 16795 [0,1,0,0,1,0|1,0,0]=3 101 B10R1.61 NC(=O)C1=CC=CC=C1F 102470 [0,1,0,0,1,0|1,0,0]=3 102 B10R1.61 NC(=O)C1=CC=CC=C1I 10354 [0,1,0,0,1,0|1,0,0]=3 103 B10R1.61 NC1=CC=CC=C1C(=O)O 22066 [0,1,0,0,1,0|0,0,0]=2 104 B10R1.61 O=C(O)C1=C(Cl)C=CC=C1 101190 [0,1,0,0,1,0|0,0,0]=2 105 B10R1.61 O=C(O)C1=C(F)C=CC=N1 100687 [0,1,0,0,1,0|1,0,0]=3 106 B10R1.61 O=C(O)C1=C(F)C=NC=C1 100632 [0,1,0,0,1,0|1,0,0]=3 107 B10R1.61 O=C(O)C1=C(F)N=CC=C1 100686 [0,1,0,0,1,0|1,0,0]=3 108 B10R1.61 O=C(O)C1=C(O)C=CC=C1 15776 [0,1,0,0,1,0|0,0,0]=2 109 B10R1.61 O=C(O)C1=CC=CC=C1F 100197 [0,1,0,0,1,0|0,0,0]=2 110 B10R1.61 O=C(O)C1=CC=NC=C1Cl 100086 [0,1,0,0,1,0|1,0,0]=3 111 B10R1.61 O=[N+]([O-])C1=C(O)C=CC=C1 20069 [0,1,0,0,1,0|1,0,1]=4 112 B10R1.113 C[N+]1=CC(C(N)=O)=CC=C1 15663 [0,1,0,0,1,0|2,0,0]=4 113 B10R1.113 NC(=O)C1=CC=CC(F)=C1 102469 [0,1,0,0,1,0|1,0,0]=3 114 B10R1.113 O=C(O)C1=CC(F)=NC=C1 100685 [0,1,0,0,1,0|1,0,0]=3 115 B10R1.113 O=C(O)C1=CC(O)=CC=C1 18167 [0,1,0,0,1,0|0,0,0]=2 116 B10R1.113 O=C(O)C1=CC=CC(F)=N1 100675 [0,1,0,0,1,0|1,0,0]=3 117 B10R1.113 O=C(O)C1=CN=CC(F)=C1 100682 [0,1,0,0,1,0|1,0,0]=3 118 B10R1.23 O=C(O)C(O)N1C=CN=C1 21324 [0,1,0,0,1,0|2,0,0]=4 119 B10R1.64 N=C1SC=CN1CC(=O)O 18604 [0,1,0,0,1,0|2,0,0]=4 120 B12R1.21 O=C(O)CCC1=CC=C(O)C=C1 15265 [0,1,0,0,0,1|0,0,0]=2 121 B12R1.21 O=C(O)\C=C\C1=CC=C(Cl)C=C1 17096 [0,1,0,0,0,1|0,0,1]=3 122 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 15283 [0,1,0,0,0,1|0,0,1]=3 123 B12R1.27 COC(=O)CCC1=CC=CC=C1 19761 [0,1,0,0,0,1|0,0,0]=2 124 B12R1.27 COC(=O)\C=C\C1=CC=CC=C1 103161 [0,1,0,0,0,1|0,0,1]=3 125 B12R1.27 COC(=O)\C=C\C1=CC=CN=C1 19785 [0,1,0,0,0,1|1,0,1]=4 126 B12R1.27 O=C(NCl)OCC1=CC=CC=C1 19804 [0,1,0,0,0,1|1,0,0]=3 127 B12R1.43 CC(=O)C(=O)NC1=CC=CC=C1 544 [0,1,0,0,0,1|1,0,1]=4 128 B12R1.43 CC(CC1=CC=CC=C1)C(=O)O 17187 [0,1,0,0,0,1|0,0,0]=2 129 B12R1.43 O=C(O)C(=O)CC1=CC=CC=C1 15432 [0,1,0,0,0,1|0,0,0]=2 130 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 20898 [0,1,0,0,0,1|1,0,0]=3 131 B12R1.125 CC(=O)NCC1=C(C)C=CN=C1 15651 [0,1,0,0,0,1|2,0,0]=4 132 B12R1.125 CC(=O)OCC1=CC=CC=C1C 16781 [0,1,0,0,0,1|1,0,0]=3 133 B12R1.125 CC1=C(C=CC(=O)O)C=NC=C1 17150 [0,1,0,0,0,1|1,0,1]=4 134 B12R1.125 NC1=C(\C=C\C(=O)O)C=CC=C1 11093 [0,1,0,0,0,1|0,0,1]=3 135 B12R1.226 O=C(O)\C=C\C1=CC(Cl)=CC=C1 17097 [0,1,0,0,0,1|0,0,1]=3 136 B12R1.4 C=CC1=CC=C(NC(C)=O)C=C1 13490 [0,2,0,0,0,0|2,0,0]=4 137 B12R1.4 COC1=CC=C(NC(C)=O)C=C1 17114 [0,2,0,0,0,0|2,0,0]=4 138 B12R1.19 CC(=O)NC1=CC(Cl)=C(C)C=C1 17118 [0,2,0,0,0,0|2,0,0]=4 139 B12R1.19 CC(=O)NC1=CC(Cl)=C(Cl)C=C1 17125 [0,2,0,0,0,0|2,0,0]=4 140 B12R1.20 CC1=CC=C(C(C)C(=O)O)C=C1 12756 [0,2,0,0,0,0|0,0,0]=2 141 B12R1.233 CC(=O)NC1=CC=C(C)C=C1C 17105 [0,2,0,0,0,0|2,0,0]=4 142 B12R1.233 CC(=O)NC1=CC=C(C)C=C1O 20859 [0,2,0,0,0,0|2,0,0]=4 143 B12R1.233 CC(=O)NC1=CC=C(Cl)C=C1C 17120 [0,2,0,0,0,0|2,0,0]=4 144 B12R1.233 CC(=O)NC1=CC=C(Cl)C=C1O 20863 [0,2,0,0,0,0|2,0,0]=4 145 B12R1.233 N(C(C)=O)C1=C(Cl)C=C(Br)C=C1 20543 [0,2,0,0,0,0|2,0,0]=4 146 B12R1.253 CC(C)(C(=O)O)C1=CC=CC=C1 12619 [0,2,0,0,0,0|0,0,0]=2 147 B12R1.253 CC(F)(C(=O)O)C1=CC=CC=C1 102146 [0,2,0,0,0,0|0,0,0]=2 148 B12R1.253 CC(F)(C(N)=O)C1=CC=CC=C1 101107 [0,2,0,0,0,0|1,0,0]=3 149 B12R1.253 CC(F)(C(N)=O)C1=CC=CC=N1 101123 [0,2,0,0,0,0|2,0,0]=4 150 B12R1.253 CC(O)(C(=O)O)C1=CC=CC=[SH]1 101121 [0,2,0,0,0,0|1,0,0]=3 151 B12R1.253 CC(O)(C(N)=O)C1=CC=CC=C1 101105 [0,2,0,0,0,0|1,0,0]=3 152 B12R1.253 CC(O)(C(N)=O)C1=CC=CC=N1 101109 [0,2,0,0,0,0|2,0,0]=4 153 B12R1.478 CCC(C(=O)[O-])C1=CC=CC=C1 12772 [0,2,0,0,0,0|0,0,1]=3 154 B12R1.478 C\C(O)=C(\C#N)C1=CC=CC=C1 11876 [0,2,0,0,0,0|1,0,1]=4 155 B12R1.478 [NH3+]CC(C(=O)O)C1=CC=CC=C1 100283 [0,2,0,0,0,0|0,0,0]=2 156 B12R1.564 CC(C)(O)C(O)C1=CC=CC=C1 1124 [0,2,0,0,0,0|1,0,1]=4 157 B12R1.75 CCC1=CC=CC=C1NC(C)=O 17109 [0,2,0,0,0,0|2,0,0]=4 158 B12R1.75 COC1=CC=CC=C1NC(C)=O 17112 [0,2,0,0,0,0|2,0,0]=4 159 B12R1.127 CC(=O)NC1=C(Cl)C=CC(C)=C1 10901 [0,2,0,0,0,0|2,0,0]=4 160 B12R1.127 CC(=O)NC1=CC(C)=CC=C1C 17107 [0,2,0,0,0,0|2,0,0]=4 161 B12R1.127 CC(=O)NC1=CC(Cl)=CC=C1C 17119 [0,2,0,0,0,0|2,0,0]=4 162 B12R1.127 CC(=O)NC1=CC(Cl)=CC=C1Cl 17124 [0,2,0,0,0,0|2,0,0]=4 163 B12R1.127 O=C(O)CC1=C(O)C=CC(O)=C1 20758 [0,2,0,0,0,0|0,0,0]=2 164 B12R1.127 O=C(O)CC1=CC(F)=CC=C1F 102974 [0,2,0,0,0,0|0,0,0]=2 165 B12R1.224 CC(=O)NC1=CC=CC(C)=C1C 17106 [0,2,0,0,0,0|2,0,0]=4 166 B12R1.224 CC(=O)NC1=CC=CC(Cl)=C1C 17117 [0,2,0,0,0,0|2,0,0]=4 167 B12R1.224 CC(=O)NC1=CC=CC(Cl)=C1Cl 17123 [0,2,0,0,0,0|2,0,0]=4 168 B12R1.1009 CC(=O)NC1=C(C)C=CC=C1C 17108 [0,2,0,0,0,0|2,0,0]=4 169 B10R1.66 O=C(O)C=CC1=CC=CO1 13414 [0,0,1,1,0,0|1,0,1]=4 170 B10R2.320 CC1CC2=CC=CC=C21 16579 [1,0,0,1,0,0|1,0,1]=4 171 B10R2.320 ClC1CC2=CC=CC=C21 16435 [1,0,0,1,0,0|1,0,1]=4 172 B10R2.320 O=C1CC2=CC=CC=C12 16218 [1,0,0,1,0,0|0,0,0]=2 173 B10R2.320 OC1CC2=CC=CC=C21 16154 [1,0,0,1,0,0|0,0,1]=3 174 B10R2.320 [NH3+]C1CC2=CC=CC=C21 16601 [1,0,0,1,0,0|1,0,1]=4 175 B12R2.24 O=C1C=CC2=CC=CC=C2N1 101464 [0,0,0,1,0,1|1,0,1]=4 176 B12R2.24 O=C1CC2=CC=CC=C2CO1 16340 [0,0,0,1,0,1|1,0,0]=3 177 B12R2.24 O=C1CSC2=CC=CC=C2N1 102677 [0,0,0,1,0,1|1,0,0]=3 178 B12R2.3190 O=C(O)C1CC2=CC=CC=C21 16604 [0,0,0,1,0,1|0,0,0]=2 179 B12R2.18 C=C1C(=O)NC2=CC=CC=C12 18545 [0,1,0,1,0,0|1,0,1]=4 180 B12R2.18 CC1=C(C)C2=CC=CC=C2C1 16651 [0,1,0,1,0,0|2,0,0]=4 181 B12R2.18 CC1=CC2=CC=CC=C2C1O 16748 [0,1,0,1,0,0|1,0,1]=4 182 B12R2.18 CC1CC2=CC=CC=C2C1=O 16626 [0,1,0,1,0,0|1,0,1]=4 183 B12R2.18 CN1C(=O)CC2=CC=CC=C21 18631 [0,1,0,1,0,0|1,0,0]=3 184 B12R2.18 N[C@H]1C2=CC=CC=C2C[C@H]1O 19197 [0,1,0,1,0,0|1,0,1]=4 185 B12R2.18 O=C1NC2=CC=CC=C2C1=O 20896 [0,1,0,1,0,0|1,0,1]=4 186 B12R2.32 N#CC1=CC2=CC=CC=C2C1 16646 [0,1,0,1,0,0|2,0,0]=4 187 B12R2.95 O=S1(=O)CC2=CC=CC=C2C1 16358 [0,1,0,1,0,0|1,0,1]=4 188 B12R2.1095 CC1(O)CC2=CC=CC(Br)=C21 16489 [0,1,0,1,0,0|1,0,1]=4 189 B12R2.1095 CC1(O)CC2=CC=CC(Cl)=C21 16427 [0,1,0,1,0,0|1,0,1]=4 190 B12R2.1095 CC1(O)CC2=CC=CC(F)=C21 16428 [0,1,0,1,0,0|1,0,1]=4 191 B8R1.7 NC(=O)C1=CC=CO1 16899 [0,0,0,0,2,0|2,0,0]=4 192 B8R1.7 O=C(O)C1=CN=CN1 21322 [0,0,0,0,2,0|2,0,0]=4 193 B8R1.7 O=C(O)C1=CNN=C1 21414 [0,0,0,0,2,0|2,0,0]=4 194 B8R1.7 O=C(O)C1=CSC=C1 1212 [0,0,0,0,2,0|1,0,0]=3 195 B12R1.252 CC(=O)NCCC1=CC=CC=C1 13725 [0,0,0,0,0,2|1,0,0]=3 196 B12R1.252 CC(C)=CCCC1=CC=CC=C1 12062 [0,0,0,0,0,2|2,0,0]=4 197 B12R1.252 NC(=O)NN=CC1=CC=CC=C1 20474 [0,0,0,0,0,2|1,0,1]=4 198 B12R1.252 O=C(O)CCCC1=CC=CC=C1 18169 [0,0,0,0,0,2|0,0,0]=2 199 B12R1.252 O=C(O)CSCC1=CC=CC=C1 10410 [0,0,0,0,0,2|0,0,0]=2