0 B5R0.3 C#C[C@@H](C)CC W11641 [0,0,0,0,0,0|2,0,1]=3 1 B5R0.3 C=C(CC)CC D90428 [0,0,0,0,0,0|2,0,2]=4 2 B5R0.3 C=C(SC)SC T70983 [0,0,0,0,0,0|0,2,2]=4 3 B5R0.3 CC(CI)CI AC4732 [0,0,0,0,0,0|4,0,0]=4 4 B5R0.3 CCP(Cl)CC A12755 [0,0,0,0,0,0|4,0,0]=4 5 B5R0.3 CC[C@H](C)CBr D86395 [0,0,0,0,0,0|3,0,0]=3 6 B5R0.3 CC[C@H](C)CN 88661 [0,0,0,0,0,0|3,0,0]=3 7 B5R0.3 CC[C@H](C)CO 88660 [0,0,0,0,0,0|3,0,0]=3 8 B5R0.3 CC[C@H](C)NN AB8698 [0,0,0,0,0,0|3,0,0]=3 9 B5R0.3 CC[C@H](C)ON AT14504 [0,0,0,0,0,0|2,0,0]=2 10 B5R0.3 CC[C@H](N)C#N AT12684 [0,0,0,0,0,0|4,0,0]=4 11 B5R0.3 CC[C@H](N)C#N AT12685 [0,0,0,0,0,0|4,0,0]=4 12 B5R0.3 CC[C@H](N)C#N N14345 [0,0,0,0,0,0|4,0,0]=4 13 B5R0.3 CN[C@@H](C)C#N AT19980 [0,0,0,0,0,0|3,0,0]=3 14 B5R0.3 COC(=N)CCl H10399 [0,0,0,0,0,0|3,0,1]=4 15 B5R0.3 CO[C@@H](C)CN 91000 [0,0,0,0,0,0|2,0,0]=2 16 B5R0.3 C[C@@H](CO)CBr C16753 [0,0,0,0,0,0|4,0,0]=4 17 B5R0.3 [2H]N(CC)CC D98468 [0,0,0,0,0,0|4,0,0]=4 18 B4R0.1 C=C=C(C)C T72680 [1,0,0,0,0,0|1,0,2]=4 19 B4R0.1 CC(C)CN T72053 [1,0,0,0,0,0|2,0,0]=3 20 B4R0.1 CC[13C](=O)O D99417 [1,0,0,0,0,0|2,0,1]=4 21 B4R0.1 CC[C@H](C)N 90231 [1,0,0,0,0,0|2,0,0]=3 22 B4R0.1 CC[C@H](C)N N12286 [1,0,0,0,0,0|2,0,0]=3 23 B4R0.1 CC[C@H](C)N N12342 [1,0,0,0,0,0|2,0,0]=3 24 B4R0.1 C[C@H](O)C#N 12324 [1,0,0,0,0,0|2,0,0]=3 25 B4R0.1 C[C@H](S)CO AC8877 [1,0,0,0,0,0|2,1,0]=4 26 B4R0.1 C[C@H](S)CS T72965 [1,0,0,0,0,0|2,1,0]=4 27 B4R0.1 [2H]C(=O)OC D99666 [1,0,0,0,0,0|1,0,2]=4 28 B4R0.1 [2H]OC(C)C D98571 [1,0,0,0,0,0|1,0,0]=2 29 B4R0.1 [2H][C@H](Br)CC D99041 [1,0,0,0,0,0|3,0,0]=4 30 B4R0.2 C#CCSC AT19944 [1,0,0,0,0,0|1,1,1]=4 31 B4R0.2 CCNCC T70517 [1,0,0,0,0,0|3,0,0]=4 32 B4R0.2 CNCCS AT25552 [1,0,0,0,0,0|3,0,0]=4 33 B4R0.2 COCCS AT13674 [1,0,0,0,0,0|2,0,0]=3 34 B4R0.2 [2H]OCCC D99167 [1,0,0,0,0,0|2,0,0]=3 35 B6R0.1 C=C[C@@H](C)CCC T72328 [0,1,0,0,0,0|2,0,1]=4 36 B6R0.1 CCC[C@H](C)CBr S11885 [0,1,0,0,0,0|3,0,0]=4 37 B6R0.1 CCNC(=O)OC C16084 [0,1,0,0,0,0|2,0,1]=4 38 B6R0.1 CCOC(=S)SC AC9840 [0,1,0,0,0,0|1,1,1]=4 39 B6R0.1 CC[C@H](N)CCO AT22371 [0,1,0,0,0,0|3,0,0]=4 40 B6R0.1 CC[C@H](N)COC D87652 [0,1,0,0,0,0|2,0,0]=3 41 B6R0.1 CC[C@H](N)COC D87653 [0,1,0,0,0,0|2,0,0]=3 42 B6R0.1 CNC[C@@H](C)CN T70175 [0,1,0,0,0,0|3,0,0]=4 43 B6R0.1 COCC(=O)OC F53343 [0,1,0,0,0,0|1,0,1]=3 44 B6R0.1 COC[C@@H](C)CO O10176 [0,1,0,0,0,0|2,0,0]=3 45 B6R0.1 COC[C@@H](N)CO 91276 [0,1,0,0,0,0|3,0,0]=4 46 B6R0.1 COC[C@@H](N)CO 91277 [0,1,0,0,0,0|3,0,0]=4 47 B6R0.1 COC[C@@H](N)CO C90595 [0,1,0,0,0,0|3,0,0]=4 48 B6R0.1 COC[C@@H](O)CN 94766 [0,1,0,0,0,0|3,0,0]=4 49 B6R0.1 COC[C@@H](O)CN 98632 [0,1,0,0,0,0|3,0,0]=4 50 B6R0.1 COC[C@H](C)C#N C77646 [0,1,0,0,0,0|2,0,0]=3 51 B6R0.1 COC[C@H](N)C#N AT12993 [0,1,0,0,0,0|3,0,0]=4 52 B6R0.1 C[C@H](CN)CCO AT20757 [0,1,0,0,0,0|3,0,0]=4 53 B6R0.1 C[C@H](CO)CCO 96740 [0,1,0,0,0,0|3,0,0]=4 54 B6R0.1 [2H]OC[C@H](C)O[2H] D98238 [0,1,0,0,0,0|2,0,0]=3 55 B6R0.3 C=C[C@H](C)[C@H](C)O D85605 [0,1,0,0,0,0|2,0,1]=4 56 B6R0.3 C=C[C@H](C)[C@H](C)O D85606 [0,1,0,0,0,0|2,0,1]=4 57 B6R0.3 CCC(C)C(C)N 78513 [0,1,0,0,0,0|2,0,0]=3 58 B6R0.3 CCC(N)C(C)O N14662 [0,1,0,0,0,0|3,0,0]=4 59 B6R0.3 CC[C@H](N)C(C)C 74049 [0,1,0,0,0,0|3,0,0]=4 60 B6R0.3 C[C@H](ON)C(=O)O AT14508 [0,1,0,0,0,0|3,0,0]=4 61 B6R0.8 CC(C)(CO)ON AT14544 [0,1,0,0,0,0|3,0,0]=4 62 B6R0.8 CCC(C)(Br)CC F20158 [0,1,0,0,0,0|2,0,0]=3 63 B6R0.8 CC[C@](C)(N)C#N 20939 [0,1,0,0,0,0|3,0,0]=4 64 B6R0.8 CC[C@](C)(N)CO D75057 [0,1,0,0,0,0|3,0,0]=4 65 B6R0.8 CC[C@](C)(O)CO D78587 [0,1,0,0,0,0|3,0,0]=4 66 B6R0.8 CNC(C)(C)C#N F13452 [0,1,0,0,0,0|3,0,0]=4 67 B6R0.8 COC(C)(C)C#N AT24380 [0,1,0,0,0,0|2,0,0]=3 68 B6R0.8 COC(C)(C)CN D87550 [0,1,0,0,0,0|2,0,0]=3 69 B6R0.8 COC(C)(C)CN W19681 [0,1,0,0,0,0|2,0,0]=3 70 B6R0.8 COP(=S)(S)OC T72912 [0,1,0,0,0,0|2,0,0]=3 71 B6R0.8 CSC(C)(C)CCl AT13953 [0,1,0,0,0,0|2,1,0]=4 72 B6R0.8 CSC(C)(C)CN AT13938 [0,1,0,0,0,0|2,1,0]=4 73 B6R0.8 CSC(C)(C)CO AT13941 [0,1,0,0,0,0|2,1,0]=4 74 B6R0.9 CCC(OC)OC D87756 [0,1,0,0,0,0|0,0,0]=1 75 B6R0.9 [C-]#[N+]C(OC)OC S10362 [0,1,0,0,0,0|0,0,1]=2 76 B6R1.2 C[C@H]1CCNC1 71655 [0,0,0,1,0,0|3,0,0]=4 77 B6R1.2 FC1CCCC1 T71800 [0,0,0,1,0,0|3,0,0]=4 78 B6R1.4 CC1CCC1N W15200 [0,0,0,1,0,0|3,0,0]=4 79 B6R1.4 CC1NCC1O P13360 [0,0,0,1,0,0|3,0,0]=4 80 B6R1.4 CC1OCC1N P20429 [0,0,0,1,0,0|2,0,0]=3 81 B6R1.4 C[C@H]1NC[C@@H]1O AT24512 [0,0,0,1,0,0|3,0,0]=4 82 B6R1.6 CNC1COC1 F51705 [0,0,0,1,0,0|3,0,0]=4 83 B6R1.6 ClC[C@H]1CCO1 32069 [0,0,0,1,0,0|2,0,0]=3 84 B6R1.6 N#C[C@@H]1CCN1 P14909 [0,0,0,1,0,0|3,0,0]=4 85 B6R1.6 NOC1CCC1 97653 [0,0,0,1,0,0|2,0,0]=3 86 B6R1.6 NOC1COC1 97652 [0,0,0,1,0,0|3,0,0]=4 87 B6R1.7 CC1(C#N)CC1 94087 [0,0,0,1,0,0|3,0,0]=4 88 B6R1.7 C[C@]1(CBr)CO1 AC6229 [0,0,0,1,0,0|2,0,0]=3 89 B6R1.8 CC1CC1C#N C77546 [0,0,0,1,0,0|3,0,0]=4 90 B6R1.8 CC1CC1CBr P20770 [0,0,0,1,0,0|3,0,0]=4 91 B6R1.8 CC[C@H]1C[C@@H]1N AT11453 [0,0,0,1,0,0|3,0,0]=4 92 B6R1.8 CC[C@H]1C[C@@H]1N AT11457 [0,0,0,1,0,0|3,0,0]=4 93 B6R1.8 C[C@@H]1C[C@@H]1CBr 55223 [0,0,0,1,0,0|3,0,0]=4 94 B3R0.1 CCCN T71779 [2,0,0,0,0,0|2,0,0]=4 95 B3R0.1 [2H]OCC D99756 [2,0,0,0,0,0|1,0,0]=3 96 B3R0.2 CC(=O)O 41449 [2,0,0,0,0,0|0,0,2]=4 97 B3R0.2 CC(C)N T72805 [2,0,0,0,0,0|1,0,0]=3 98 B3R0.2 [2H]N(C)C D98629 [2,0,0,0,0,0|2,0,0]=4 99 B3R0.2 [2H][C@@H](C)I D98644 [2,0,0,0,0,0|2,0,0]=4 100 B5R0.1 CC(C)CNN AR2531 [1,1,0,0,0,0|2,0,0]=4 101 B5R0.1 CC(C)\C=N\O D77551 [1,1,0,0,0,0|2,0,0]=4 102 B5R0.1 CCC[C@H](C)N N10856 [1,1,0,0,0,0|2,0,0]=4 103 B5R0.1 CCC[C@H](C)N N15476 [1,1,0,0,0,0|2,0,0]=4 104 B5R0.1 CN(C)CCBr F20843 [1,1,0,0,0,0|2,0,0]=4 105 B5R0.1 CONC(C)=O AT24901 [1,1,0,0,0,0|0,0,2]=4 106 B5R0.1 CONC(C)C AT24926 [1,1,0,0,0,0|0,0,0]=2 107 B5R0.1 CSC[C@H](C)N AT10784 [1,1,0,0,0,0|1,1,0]=4 108 B5R0.1 C[C@H](N)CCO 83613 [1,1,0,0,0,0|2,0,0]=4 109 B5R0.1 C[C@H](N)CCO 83649 [1,1,0,0,0,0|2,0,0]=4 110 B5R0.1 C[C@H](O)CCN D77181 [1,1,0,0,0,0|1,0,0]=3 111 B5R0.1 C[C@H](O)CCN D77194 [1,1,0,0,0,0|1,0,0]=3 112 B5R0.1 C[C@H](O)CNN W10671 [1,1,0,0,0,0|2,0,0]=4 113 B5R0.1 C[C@H](O)CON AT14481 [1,1,0,0,0,0|1,0,0]=3 114 B5R0.1 C\C=C/C(C)C T72834 [1,1,0,0,0,0|1,0,0]=3 115 B5R0.4 CC(C)(C)Cl=O D90846 [1,1,0,0,0,0|2,0,0]=4 116 B5R0.4 CC(C)(N)CF AT13343 [1,1,0,0,0,0|2,0,0]=4 117 B5R0.4 CC(C)(N)CN F16110 [1,1,0,0,0,0|2,0,0]=4 118 B5R0.4 COS(=O)(=O)O 44493 [1,1,0,0,0,0|2,0,0]=4 119 B5R0.4 [2H]C(C)(C)CO D98435 [1,1,0,0,0,0|2,0,0]=4 120 B5R0.4 [2H]C([2H])(C)NC D99751 [1,1,0,0,0,0|2,0,0]=4 121 B5R0.4 [2H]C([2H])(O)CC D99543 [1,1,0,0,0,0|2,0,0]=4 122 B5R0.4 [2H]C([2H])([2H])OC D99308 [1,1,0,0,0,0|2,0,0]=4 123 B5R0.4 [2H]OC(C)(C)C D99425 [1,1,0,0,0,0|1,0,0]=3 124 B5R0.5 CC(=O)[C@H](C)N 91522 [1,1,0,0,0,0|2,0,0]=4 125 B5R0.5 CC(C)C(=O)O A11457 [1,1,0,0,0,0|2,0,0]=4 126 B5R0.5 CC(C)C(I)I AC2721 [1,1,0,0,0,0|2,0,0]=4 127 B5R0.5 CC(C)S(=O)[O-] AT25017 [1,1,0,0,0,0|1,1,0]=4 128 B5R0.5 CC(C)[13C](=O)[O-] D99296 [1,1,0,0,0,0|2,0,0]=4 129 B5R0.5 CC(C)[C@H](C)Br AT23713 [1,1,0,0,0,0|1,0,0]=3 130 B5R0.5 CC(C)[C@H](C)N A12293 [1,1,0,0,0,0|1,0,0]=3 131 B5R0.5 CC(C)[S@](=O)[O-] C11403 [1,1,0,0,0,0|1,1,0]=4 132 B5R0.5 CC(N)C(C)N AT12970 [1,1,0,0,0,0|2,0,0]=4 133 B5R0.5 C[C@H](O)C(=N)N F21307 [1,1,0,0,0,0|2,0,0]=4 134 B5R0.5 C[C@H](O)[C@@H](C)N N16999 [1,1,0,0,0,0|1,0,0]=3 135 B5R0.2 C#CCCOC AC9661 [1,1,0,0,0,0|1,0,1]=4 136 B5R0.2 CC#CCNC AT19972 [1,1,0,0,0,0|2,0,0]=4 137 B5R0.2 CCCNOC AT24927 [1,1,0,0,0,0|1,0,0]=3 138 B5R0.2 CNCCSC D87904 [1,1,0,0,0,0|1,1,0]=4 139 B5R0.2 COCCNN AC7088 [1,1,0,0,0,0|2,0,0]=4 140 B5R0.2 CONCCO AT24903 [1,1,0,0,0,0|2,0,0]=4 141 B5R0.2 NOCCCO P16653 [1,1,0,0,0,0|2,0,0]=4 142 B5R0.2 [2H]OCCCC D98922 [1,1,0,0,0,0|2,0,0]=4 143 B5R0.2 [2H]OCCO[2H] D98232 [1,1,0,0,0,0|2,0,0]=4 144 B7R0.2 C=C(C)C[C@@H](C)CC T70395 [0,2,0,0,0,0|2,0,0]=4 145 B7R0.2 CN[C@@H](C)CC(F)F AT22542 [0,2,0,0,0,0|2,0,0]=4 146 B7R0.3 CNOCC(=O)OC AT14517 [0,2,0,0,0,0|1,0,1]=4 147 B7R0.3 C\C=C\C[C@@H](C)CC T72110 [0,2,0,0,0,0|2,0,0]=4 148 B7R0.5 CC(=O)[C@@H](C)CCBr AC2947 [0,2,0,0,0,0|2,0,0]=4 149 B7R0.5 COC[C@H](N)C(C)C 71787 [0,2,0,0,0,0|2,0,0]=4 150 B7R0.7 COCC(Br)COC D74902 [0,2,0,0,0,0|1,0,0]=3 151 B7R0.7 COCC(N)COC AT12494 [0,2,0,0,0,0|1,0,0]=3 152 B7R0.10 CCC(C)C(N)CO D75056 [0,2,0,0,0,0|2,0,0]=4 153 B7R0.10 COC(=O)[C@@H](C)C=O AC6281 [0,2,0,0,0,0|2,0,0]=4 154 B7R0.10 COC(=O)[C@H](C)OC 29231 [0,2,0,0,0,0|0,0,0]=2 155 B7R0.10 [C-]#[N+][C@@H](C)C(=O)OC AC8795 [0,2,0,0,0,0|1,0,1]=4 156 B7R0.11 CCCC(C)(C)CC T71064 [0,2,0,0,0,0|2,0,0]=4 157 B7R0.11 CCOC(C)(C)C=O F20263 [0,2,0,0,0,0|2,0,0]=4 158 B7R0.11 CCOC(C)(C)CC D78478 [0,2,0,0,0,0|1,0,0]=3 159 B7R0.11 COCC(C)(C)C=O D84794 [0,2,0,0,0,0|2,0,0]=4 160 B7R0.12 C#CCC(OC)OC 51903 [0,2,0,0,0,0|0,0,0]=2 161 B7R0.13 COC(C)(C)C(=N)N AT24383 [0,2,0,0,0,0|2,0,0]=4 162 B7R0.13 COC(C)(C)C(C)=O S10204 [0,2,0,0,0,0|1,0,0]=3 163 B7R0.14 CC[C@H](C)C(C)(C)C T72627 [0,2,0,0,0,0|2,0,0]=4 164 B7R0.15 COC(OC)C(=O)O AT19758 [0,2,0,0,0,0|0,0,1]=3 165 B7R0.16 CC(C)C(C)C(C)C T72628 [0,2,0,0,0,0|2,0,0]=4 166 B7R0.18 CCC(N)(CC)CO D75115 [0,2,0,0,0,0|2,0,0]=4 167 B5R1.2 C[C@H]1CCN1 71554 [1,0,0,1,0,0|1,0,0]=3 168 B5R1.3 C=CC1CC1 59738 [1,0,0,1,0,0|1,0,1]=4 169 B5R1.3 IC[C@H]1CO1 CS1242 [1,0,0,1,0,0|2,0,0]=4 170 B5R1.3 NNC1CC1 P19257 [1,0,0,1,0,0|2,0,0]=4 171 B5R1.3 SCC1CC1 AT12991 [1,0,0,1,0,0|2,0,0]=4 172 B5R1.4 C[C@H]1C[C@@H]1N 73029 [1,0,0,1,0,0|2,0,0]=4 173 B5R1.1 C1=NCCO1 F18129 [1,0,0,1,0,0|1,0,1]=4 174 B5R1.1 C1CNOC1 F14141 [1,0,0,1,0,0|2,0,0]=4 175 B7R1.1 CCC1CCCC1 T71889 [0,1,0,1,0,0|2,0,0]=4 176 B7R1.1 CC[C@H]1CCCN1 N12693 [0,1,0,1,0,0|2,0,0]=4 177 B7R1.1 CN[C@H]1CCNC1 C14692 [0,1,0,1,0,0|2,0,0]=4 178 B7R1.1 CN[C@H]1CCOC1 P13110 [0,1,0,1,0,0|1,0,0]=3 179 B7R1.1 CN[C@H]1CCOC1 P13111 [0,1,0,1,0,0|1,0,0]=3 180 B7R1.1 CN[C@H]1CCSC1 D72867 [0,1,0,1,0,0|1,1,0]=4 181 B7R1.1 COC1=NCCN1 D98226 [0,1,0,1,0,0|1,0,1]=4 182 B7R1.1 ClC[C@H]1CCCN1 87778 [0,1,0,1,0,0|2,0,0]=4 183 B7R1.1 ClC[C@H]1CCCN1 D76474 [0,1,0,1,0,0|2,0,0]=4 184 B7R1.1 ClC[C@H]1CCOC1 N12624 [0,1,0,1,0,0|2,0,0]=4 185 B7R1.1 FC[C@H]1CCCN1 AT24807 [0,1,0,1,0,0|2,0,0]=4 186 B7R1.1 FC[C@H]1CCCN1 P12668 [0,1,0,1,0,0|2,0,0]=4 187 B7R1.1 NC[C@H]1CCCN1 C16283 [0,1,0,1,0,0|2,0,0]=4 188 B7R1.1 NC[C@H]1CCCN1 FD10638 [0,1,0,1,0,0|2,0,0]=4 189 B7R1.1 NC[C@H]1CCCN1 S10708 [0,1,0,1,0,0|2,0,0]=4 190 B7R1.1 NC[C@H]1CCOC1 68889 [0,1,0,1,0,0|2,0,0]=4 191 B7R1.1 NN[C@H]1CCOC1 91992 [0,1,0,1,0,0|2,0,0]=4 192 B7R1.1 NN[C@H]1CCOC1 C93321 [0,1,0,1,0,0|2,0,0]=4 193 B7R1.1 NN[C@H]1CCOC1 F15303 [0,1,0,1,0,0|2,0,0]=4 194 B7R1.1 NOC1CCCC1 97656 [0,1,0,1,0,0|2,0,0]=4 195 B7R1.1 OC[C@H]1CCCN1 11147 [0,1,0,1,0,0|2,0,0]=4 196 B7R1.2 CC1CC(O)CN1 AT24888 [0,1,0,1,0,0|2,0,0]=4 197 B7R1.2 CC1CNC(C)C1 83923 [0,1,0,1,0,0|2,0,0]=4 198 B7R1.2 C[C@@H]1C[C@H](F)CN1 73102 [0,1,0,1,0,0|2,0,0]=4 199 B7R1.2 C[C@H]1CC[C@@H](C)C1 T70658 [0,1,0,1,0,0|2,0,0]=4 200 B7R1.3 C[C@H]1CCCCN1 N14212 [0,1,0,1,0,0|2,0,0]=4 201 B7R1.3 C[C@H]1CCCNC1 F14484 [0,1,0,1,0,0|2,0,0]=4 202 B7R1.3 C[C@H]1CNCCS1 AT10751 [0,1,0,1,0,0|1,1,0]=4 203 B7R1.3 C[C@H]1CNCCS1 AT25278 [0,1,0,1,0,0|1,1,0]=4 204 B7R1.3 C[C@H]1CSCCN1 AT10756 [0,1,0,1,0,0|1,1,0]=4 205 B7R1.3 C[C@H]1CSCCN1 AT10759 [0,1,0,1,0,0|1,1,0]=4 206 B7R1.3 N[C@H]1CCCOC1 F31015 [0,1,0,1,0,0|2,0,0]=4 207 B7R1.3 N[C@H]1CCCOC1 P11042 [0,1,0,1,0,0|2,0,0]=4 208 B7R1.4 C[C@@H]1CCC[C@@H]1N 97379 [0,1,0,1,0,0|2,0,0]=4 209 B7R1.4 C[C@H]1COCC1=O AT13358 [0,1,0,1,0,0|2,0,0]=4 210 B7R1.6 OCC[C@H]1CCN1 D76473 [0,1,0,1,0,0|2,0,0]=4 211 B7R1.6 OCC[C@H]1CCN1 F50335 [0,1,0,1,0,0|2,0,0]=4 212 B7R1.8 CN1CC[C@@H]1CN P13167 [0,1,0,1,0,0|2,0,0]=4 213 B7R1.8 CN1CC[C@@H]1CN P13169 [0,1,0,1,0,0|2,0,0]=4 214 B7R1.8 CN1CC[C@@H]1CN P15774 [0,1,0,1,0,0|2,0,0]=4 215 B7R1.8 CN1CC[C@@H]1CN P15856 [0,1,0,1,0,0|2,0,0]=4 216 B7R1.10 CNC1CC(O)C1 AT20141 [0,1,0,1,0,0|2,0,0]=4 217 B7R1.10 COC1CC(N)C1 P12017 [0,1,0,1,0,0|1,0,0]=3 218 B7R1.10 CSC1CC(N)C1 AT20164 [0,1,0,1,0,0|1,1,0]=4 219 B7R1.21 CCOC1(Br)CC1 F53374 [0,1,0,1,0,0|2,0,0]=4 220 B7R1.21 CCOC1(N)CC1 AT19095 [0,1,0,1,0,0|2,0,0]=4 221 B7R1.25 CC1(CS)COC1 CS1170 [0,1,0,1,0,0|2,0,0]=4 222 B7R1.25 CCC1(N)COC1 CS2262 [0,1,0,1,0,0|2,0,0]=4 223 B7R1.25 CNC1(C)COC1 39043 [0,1,0,1,0,0|1,0,0]=3 224 B7R1.25 C[C@]1(CN)CCO1 D97140 [0,1,0,1,0,0|2,0,0]=4 225 B7R1.18 C[C@H](N)C1CCC1 32380 [0,1,0,1,0,0|2,0,0]=4 226 B7R1.18 C[C@H](N)C1CCC1 93059 [0,1,0,1,0,0|2,0,0]=4 227 B7R1.18 C[C@H](N)C1CCC1 93061 [0,1,0,1,0,0|2,0,0]=4 228 B7R1.14 CC1(C)NCCO1 A51220 [0,1,0,1,0,0|1,0,0]=3 229 B7R1.14 CC1(N)CCCC1 F50575 [0,1,0,1,0,0|2,0,0]=4 230 B7R1.29 CCC1(CC)CO1 91067 [0,1,0,1,0,0|1,0,0]=3 231 B7R1.29 CCC1(CO)CC1 AT23872 [0,1,0,1,0,0|2,0,0]=4 232 B7R1.29 CC[C@]1(CCl)CO1 T71304 [0,1,0,1,0,0|1,0,0]=3 233 B7R1.29 CNC1(CO)CC1 98659 [0,1,0,1,0,0|2,0,0]=4 234 B7R1.29 COC1(CN)CC1 P17998 [0,1,0,1,0,0|1,0,0]=3 235 B7R2.13 C1CC2CC2N1 P10693 [0,0,0,2,0,0|2,0,0]=4