0 B6R0.1 C#CCC(O)CO CS-0088972 [0,0,0,0,0,0|1,0,2]=3 1 B6R0.1 C=CCC(N)CO CS-0091325 [0,0,0,0,0,0|2,0,2]=4 2 B6R0.1 CCCC(N)CO CS-0089892 [0,0,0,0,0,0|2,0,0]=2 3 B6R0.1 CCC[C@@H](N)CO CS-0088083 [0,0,0,0,0,0|2,0,0]=2 4 B6R0.1 CCNC(=O)CCl CS-0037573 [0,0,0,0,0,0|2,0,2]=4 5 B6R0.1 COCC(N)CO CS-0091346 [0,0,0,0,0,0|3,0,0]=3 6 B6R0.1 COCC(N)CO CS-0106469 [0,0,0,0,0,0|3,0,0]=3 7 B6R0.1 COCC(O)CN CS-0106474 [0,0,0,0,0,0|2,0,0]=2 8 B6R0.1 COC[C@@H](N)CO CS-0091344 [0,0,0,0,0,0|3,0,0]=3 9 B6R0.1 COC[C@H](N)CO CS-0091345 [0,0,0,0,0,0|3,0,0]=3 10 B6R0.1 NC(CO)CCO CS-0091333 [0,0,0,0,0,0|3,0,0]=3 11 B6R0.1 N[C@@H](CO)CCO CS-0091341 [0,0,0,0,0,0|3,0,0]=3 12 B6R0.1 N[C@H](CO)CCO CS-0091335 [0,0,0,0,0,0|3,0,0]=3 13 B5R0.1 CC(F)CCN CS-0106774 [1,0,0,0,0,0|2,0,0]=3 14 B5R0.1 CC(O)CCN CS-0113030 [1,0,0,0,0,0|1,0,0]=2 15 B5R0.1 CC(O)CCN CS-0113103 [1,0,0,0,0,0|1,0,0]=2 16 B5R0.1 CC(O)CNN CS-0035530 [1,0,0,0,0,0|2,0,0]=3 17 B5R0.1 CC(O)CNN CS-0036622 [1,0,0,0,0,0|2,0,0]=3 18 B5R0.1 CCCC(=N)N CS-W013544 [1,0,0,0,0,0|2,0,1]=4 19 B5R0.1 C[C@@H](O)CCN CS-0113026 [1,0,0,0,0,0|1,0,0]=2 20 B5R0.1 C[C@@H](O)CCN CS-0113150 [1,0,0,0,0,0|1,0,0]=2 21 B5R0.1 C[C@H](N)CC#N CS-0099938 [1,0,0,0,0,0|2,0,1]=4 22 B5R0.1 C[C@H](O)CCN CS-0113024 [1,0,0,0,0,0|1,0,0]=2 23 B5R0.1 C[C@H](O)CCN CS-0113046 [1,0,0,0,0,0|1,0,0]=2 24 B5R0.1 NCCC(F)F CS-0112580 [1,0,0,0,0,0|3,0,0]=4 25 B5R0.1 O=C(O)CCF CS-0038385 [1,0,0,0,0,0|2,0,1]=4 26 B5R0.2 C#CCCCI CS-0088561 [1,0,0,0,0,0|1,0,2]=4 27 B5R0.2 C#CCCCN CS-0038434 [1,0,0,0,0,0|1,0,2]=4 28 B5R0.2 CCCCON CS-0106180 [1,0,0,0,0,0|2,0,0]=3 29 B5R0.2 NCCCNN CS-0037551 [1,0,0,0,0,0|3,0,0]=4 30 B5R0.3 CCC(=O)CO CS-W005327 [1,0,0,0,0,0|1,0,2]=4 31 B5R0.3 CC[C@@H](O)CN CS-0096325 [1,0,0,0,0,0|1,0,0]=2 32 B5R0.3 CC[C@H](O)CN CS-0046763 [1,0,0,0,0,0|1,0,0]=2 33 B5R0.3 CO[C@@H](C)CO CS-0096324 [1,0,0,0,0,0|3,0,0]=4 34 B5R0.3 C[C@@H](CO)CBr CS-0101486 [1,0,0,0,0,0|3,0,0]=4 35 B5R0.3 NC(CO)CF CS-0091321 [1,0,0,0,0,0|3,0,0]=4 36 B5R0.3 NC(CO)CS CS-0089528 [1,0,0,0,0,0|3,0,0]=4 37 B5R0.3 NCC(N)CO CS-0091318 [1,0,0,0,0,0|3,0,0]=4 38 B5R0.3 NC[C@@H](N)CO CS-0091319 [1,0,0,0,0,0|3,0,0]=4 39 B5R0.3 NC[C@H](F)CO CS-0053431 [1,0,0,0,0,0|3,0,0]=4 40 B5R0.3 N[C@H](CO)CS CS-0089529 [1,0,0,0,0,0|3,0,0]=4 41 B7R0.2 CCN(C)C[C@@H](C)O CS-0095832 [0,1,0,0,0,0|2,0,0]=3 42 B7R0.2 CC[C@@H](O)CN(C)C CS-0096089 [0,1,0,0,0,0|1,0,0]=2 43 B7R0.3 C#CCC[C@H](N)CO CS-0089531 [0,1,0,0,0,0|2,0,1]=4 44 B7R0.3 C=CCCC(N)CO CS-0091350 [0,1,0,0,0,0|2,0,1]=4 45 B7R0.3 CC#CCC(N)CO CS-0091348 [0,1,0,0,0,0|2,0,1]=4 46 B7R0.3 CCCCC(N)CO CS-0091368 [0,1,0,0,0,0|2,0,0]=3 47 B7R0.3 CCCC[C@@H](N)CO CS-0089933 [0,1,0,0,0,0|2,0,0]=3 48 B7R0.3 CCCC[C@H](N)CO CS-0089877 [0,1,0,0,0,0|2,0,0]=3 49 B7R0.3 CCCOC(=O)OC CS-0111112 [0,1,0,0,0,0|1,0,2]=4 50 B7R0.3 COCCC(N)CO CS-0106481 [0,1,0,0,0,0|2,0,0]=3 51 B7R0.3 CSCCC(N)CO CS-0091223 [0,1,0,0,0,0|2,0,0]=3 52 B7R0.3 CSCC[C@@H](N)CO CS-0088128 [0,1,0,0,0,0|2,0,0]=3 53 B7R0.5 CCOC(=O)[C@H](C)O CS-0096322 [0,1,0,0,0,0|1,0,2]=4 54 B7R0.5 COCC(N)C(C)C CS-0038205 [0,1,0,0,0,0|2,0,0]=3 55 B7R0.7 CCCC(Br)CCC CS-0106173 [0,1,0,0,0,0|1,0,0]=2 56 B7R0.7 CCOC(=O)CCN CS-W019943 [0,1,0,0,0,0|1,0,2]=4 57 B7R0.7 COCC(Br)COC CS-0089990 [0,1,0,0,0,0|2,0,0]=3 58 B7R0.7 COCC(Cl)COC CS-0089991 [0,1,0,0,0,0|2,0,0]=3 59 B7R0.7 O=C(CCBr)CCBr CS-W007197 [0,1,0,0,0,0|1,0,2]=4 60 B7R0.10 CCC(C)C(N)CO CS-0091231 [0,1,0,0,0,0|2,0,0]=3 61 B7R0.10 CC[C@@H](N)C(=O)OC CS-0100678 [0,1,0,0,0,0|1,0,2]=4 62 B7R0.11 CCCC(C)(N)CO CS-0091365 [0,1,0,0,0,0|2,0,0]=3 63 B7R1.1 BrCC1=CCCC1 CS-0052832 [0,0,0,1,0,0|2,0,1]=4 64 B7R1.1 BrCC1CCCO1 CS-0052243 [0,0,0,1,0,0|1,0,0]=2 65 B7R1.1 C#CC1CCCN1 CS-0051909 [0,0,0,1,0,0|1,0,2]=4 66 B7R1.1 CC[C@@H]1CCNC1 CS-0053328 [0,0,0,1,0,0|2,0,0]=3 67 B7R1.1 CC[C@H]1CCNC1 CS-0053268 [0,0,0,1,0,0|2,0,0]=3 68 B7R1.1 CNC1CCNC1 CS-0099966 [0,0,0,1,0,0|3,0,0]=4 69 B7R1.1 CNC1CCOC1 CS-0046706 [0,0,0,1,0,0|3,0,0]=4 70 B7R1.1 CNC1CCOC1 CS-0048784 [0,0,0,1,0,0|3,0,0]=4 71 B7R1.1 CNC1CCSC1 CS-0046714 [0,0,0,1,0,0|3,0,0]=4 72 B7R1.1 CN[C@@H]1CCNC1 CS-0035658 [0,0,0,1,0,0|3,0,0]=4 73 B7R1.1 CN[C@H]1CCOC1 CS-0053255 [0,0,0,1,0,0|3,0,0]=4 74 B7R1.1 COC1CCNC1 CS-0039937 [0,0,0,1,0,0|3,0,0]=4 75 B7R1.1 ClCC1CCCN1 CS-0106573 [0,0,0,1,0,0|2,0,0]=3 76 B7R1.1 ClC[C@@H]1CCCN1 CS-0106569 [0,0,0,1,0,0|2,0,0]=3 77 B7R1.1 ClC[C@H]1CCCN1 CS-0104825 [0,0,0,1,0,0|2,0,0]=3 78 B7R1.1 FC[C@@H]1CCCN1 CS-0053450 [0,0,0,1,0,0|2,0,0]=3 79 B7R1.1 FC[C@@H]1CCNC1 CS-0085105 [0,0,0,1,0,0|3,0,0]=4 80 B7R1.1 FC[C@H]1CCCN1 CS-0053502 [0,0,0,1,0,0|2,0,0]=3 81 B7R1.1 N#CC1CCCN1 CS-0048722 [0,0,0,1,0,0|2,0,1]=4 82 B7R1.1 N#C[C@@H]1CCCN1 CS-0053430 [0,0,0,1,0,0|2,0,1]=4 83 B7R1.1 N#C[C@H]1CCCN1 CS-0102312 [0,0,0,1,0,0|2,0,1]=4 84 B7R1.1 NCC1CCOC1 CS-0048762 [0,0,0,1,0,0|3,0,0]=4 85 B7R1.1 NCC1OCCO1 CS-D0489 [0,0,0,1,0,0|2,0,0]=3 86 B7R1.1 NC[C@@H]1CCOC1 CS-0053252 [0,0,0,1,0,0|3,0,0]=4 87 B7R1.1 NNC1CCCC1 CS-D0525 [0,0,0,1,0,0|3,0,0]=4 88 B7R1.1 OCC1CCNC1 CS-0048724 [0,0,0,1,0,0|3,0,0]=4 89 B7R1.1 OCC1OCCO1 CS-W019186 [0,0,0,1,0,0|2,0,0]=3 90 B7R1.1 OC[C@@H]1CCOC1 CS-0053251 [0,0,0,1,0,0|3,0,0]=4 91 B7R1.1 OC[C@H]1CCOC1 CS-0053313 [0,0,0,1,0,0|3,0,0]=4 92 B7R1.2 CC1CCC(=O)N1 CS-0046659 [0,0,0,1,0,0|1,0,2]=4 93 B7R1.2 CC1CCC(O)C1 CS-0107204 [0,0,0,1,0,0|0,0,0]=1 94 B7R1.2 CN1CC[C@H](N)C1 CS-0053279 [0,0,0,1,0,0|2,0,0]=3 95 B7R1.2 C[C@@H]1CCC(=O)N1 CS-0046592 [0,0,0,1,0,0|1,0,2]=4 96 B7R1.2 C[C@@H]1CC[C@@H](C)N1 CS-0053461 [0,0,0,1,0,0|2,0,0]=3 97 B7R1.2 C[C@@H]1CC[C@@H](C)N1 CS-0111299 [0,0,0,1,0,0|2,0,0]=3 98 B7R1.2 C[C@@H]1CNC(=O)C1 CS-0053172 [0,0,0,1,0,0|1,0,2]=4 99 B7R1.2 C[C@@H]1C[C@@H](O)CN1 CS-0038437 [0,0,0,1,0,0|1,0,0]=2 100 B7R1.2 C[C@@H]1C[C@H](O)CN1 CS-0053223 [0,0,0,1,0,0|1,0,0]=2 101 B7R1.2 C[C@H]1CC[C@@H](C)N1 CS-0053458 [0,0,0,1,0,0|2,0,0]=3 102 B7R1.2 C[C@H]1CC[C@H](C)N1 CS-0111295 [0,0,0,1,0,0|2,0,0]=3 103 B7R1.2 C[C@H]1CNC(=O)C1 CS-0055121 [0,0,0,1,0,0|1,0,2]=4 104 B7R1.2 C[C@H]1C[C@@H](O)CN1 CS-0053292 [0,0,0,1,0,0|1,0,0]=2 105 B7R1.2 C[C@H]1C[C@H](O)CN1 CS-0053220 [0,0,0,1,0,0|1,0,0]=2 106 B7R1.2 N[C@H]1CC[C@@H](F)C1 CS-0053565 [0,0,0,1,0,0|2,0,0]=3 107 B7R1.2 N[C@H]1CC[C@@H](O)C1 CS-0062467 [0,0,0,1,0,0|1,0,0]=2 108 B7R1.2 O[C@@H]1CC[C@@H](O)C1 CS-0056775 [0,0,0,1,0,0|1,0,0]=2 109 B7R1.2 O[C@H]1CC[C@@H](O)C1 CS-0049663 [0,0,0,1,0,0|1,0,0]=2 110 B7R1.2 [C@@H]1(O)CCN(C)C1 CS-W013705 [0,0,0,1,0,0|1,0,0]=2 111 B7R1.3 CC1COCCN1 CS-0038078 [0,0,0,1,0,0|3,0,0]=4 112 B7R1.3 FC1CCNCC1 CS-0101735 [0,0,0,1,0,0|2,0,0]=3 113 B7R1.3 F[C@@H]1CCCNC1 CS-0053327 [0,0,0,1,0,0|2,0,0]=3 114 B7R1.3 NC1CCCNC1 CS-W005316 [0,0,0,1,0,0|2,0,0]=3 115 B7R1.3 NN1CCNCC1 CS-0098935 [0,0,0,1,0,0|3,0,0]=4 116 B7R1.3 OC1C=CCNC1 CS-0060460 [0,0,0,1,0,0|1,0,2]=4 117 B7R1.3 OC1CCCCN1 CS-0112594 [0,0,0,1,0,0|1,0,0]=2 118 B7R1.3 O[C@@H]1CCCNC1 CS-0053770 [0,0,0,1,0,0|1,0,0]=2 119 B7R1.3 O[C@@H]1CCCOC1 CS-0053086 [0,0,0,1,0,0|1,0,0]=2 120 B7R1.3 SC1CCCNC1 CS-0048753 [0,0,0,1,0,0|1,1,0]=3 121 B7R1.3 [C@H]1(C)CNCCN1 CS-W011321 [0,0,0,1,0,0|3,0,0]=4 122 B7R1.4 C[C@@H]1CCNC1=O CS-0046449 [0,0,0,1,0,0|1,0,2]=4 123 B7R1.4 C[C@@H]1COC[C@H]1N CS-0047781 [0,0,0,1,0,0|2,0,0]=3 124 B7R1.4 C[C@H]1CCC[C@@H]1O CS-0036071 [0,0,0,1,0,0|0,0,0]=1 125 B7R1.4 C[C@H]1CCNC1=O CS-0046446 [0,0,0,1,0,0|1,0,2]=4 126 B7R1.4 C[C@H]1CNC[C@@H]1O CS-0035605 [0,0,0,1,0,0|1,0,0]=2 127 B7R1.4 C[C@H]1CNC[C@H]1O CS-0036375 [0,0,0,1,0,0|1,0,0]=2 128 B7R1.4 F[C@H]1CNC[C@@H]1F CS-0047807 [0,0,0,1,0,0|3,0,0]=4 129 B7R1.4 F[C@H]1CNC[C@H]1F CS-0012663 [0,0,0,1,0,0|3,0,0]=4 130 B7R1.4 NC1CCCC1F CS-0101183 [0,0,0,1,0,0|2,0,0]=3 131 B7R1.4 NC1COCC1O CS-0112323 [0,0,0,1,0,0|2,0,0]=3 132 B7R1.4 N[C@@H]1CCC[C@@H]1O CS-0096405 [0,0,0,1,0,0|1,0,0]=2 133 B7R1.4 N[C@@H]1CCC[C@H]1F CS-0047825 [0,0,0,1,0,0|2,0,0]=3 134 B7R1.4 N[C@@H]1CCC[C@H]1N CS-0047743 [0,0,0,1,0,0|2,0,0]=3 135 B7R1.4 N[C@@H]1CCC[C@H]1O CS-0096407 [0,0,0,1,0,0|1,0,0]=2 136 B7R1.4 N[C@@H]1CNC[C@@H]1F CS-0096695 [0,0,0,1,0,0|3,0,0]=4 137 B7R1.4 N[C@@H]1COC[C@@H]1F CS-0046590 [0,0,0,1,0,0|3,0,0]=4 138 B7R1.4 N[C@@H]1COC[C@@H]1N CS-0049723 [0,0,0,1,0,0|3,0,0]=4 139 B7R1.4 N[C@@H]1COC[C@@H]1O CS-0049679 [0,0,0,1,0,0|2,0,0]=3 140 B7R1.4 N[C@@H]1COC[C@H]1N CS-0046716 [0,0,0,1,0,0|3,0,0]=4 141 B7R1.4 N[C@@H]1COC[C@H]1N CS-0053226 [0,0,0,1,0,0|3,0,0]=4 142 B7R1.4 N[C@@H]1COC[C@H]1O CS-0037840 [0,0,0,1,0,0|2,0,0]=3 143 B7R1.4 N[C@@H]1COC[C@H]1O CS-0046712 [0,0,0,1,0,0|2,0,0]=3 144 B7R1.4 N[C@@H]1CSC[C@@H]1O CS-0046601 [0,0,0,1,0,0|2,0,0]=3 145 B7R1.4 N[C@@H]1CSC[C@H]1O CS-0046604 [0,0,0,1,0,0|2,0,0]=3 146 B7R1.4 N[C@H]1CCC[C@H]1N CS-0049664 [0,0,0,1,0,0|2,0,0]=3 147 B7R1.4 N[C@H]1COC[C@@H]1N CS-0058692 [0,0,0,1,0,0|3,0,0]=4 148 B7R1.4 N[C@H]1COC[C@@H]1O CS-0047593 [0,0,0,1,0,0|2,0,0]=3 149 B7R1.4 N[C@H]1COC[C@H]1F CS-0092759 [0,0,0,1,0,0|3,0,0]=4 150 B7R1.4 N[C@H]1COC[C@H]1O CS-0053228 [0,0,0,1,0,0|2,0,0]=3 151 B7R1.4 O=C1NCC[C@H]1O CS-W018663 [0,0,0,1,0,0|2,0,1]=4 152 B7R1.4 O[C@@H]1CCC[C@H]1F CS-0101190 [0,0,0,1,0,0|1,0,0]=2 153 B7R1.4 O[C@@H]1CNC[C@@H]1F CS-0047354 [0,0,0,1,0,0|2,0,0]=3 154 B7R1.4 O[C@@H]1CNC[C@@H]1F CS-0058738 [0,0,0,1,0,0|2,0,0]=3 155 B7R1.4 O[C@H]1CNC[C@@H]1F CS-0047134 [0,0,0,1,0,0|2,0,0]=3 156 B7R1.4 O[C@H]1CNC[C@@H]1O CS-0047805 [0,0,0,1,0,0|2,0,0]=3 157 B7R1.4 O[C@H]1CNC[C@@H]1O CS-0058679 [0,0,0,1,0,0|2,0,0]=3 158 B7R1.4 O[C@H]1COC[C@H]1O CS-0049648 [0,0,0,1,0,0|2,0,0]=3 159 B7R1.4 [C@@H]1(N)CCC[C@H]1O CS-0031413 [0,0,0,1,0,0|1,0,0]=2 160 B7R1.6 CCNC1COC1 CS-0045508 [0,0,0,1,0,0|3,0,0]=4 161 B7R1.6 CNCC1COC1 CS-0048871 [0,0,0,1,0,0|3,0,0]=4 162 B7R1.6 COCC1CCN1 CS-0052226 [0,0,0,1,0,0|2,0,0]=3 163 B7R1.6 COCC1CNC1 CS-0051676 [0,0,0,1,0,0|3,0,0]=4 164 B7R1.6 COC[C@@H]1CCN1 CS-0052225 [0,0,0,1,0,0|2,0,0]=3 165 B7R1.6 COC[C@@H]1CCN1 CS-0053449 [0,0,0,1,0,0|2,0,0]=3 166 B7R1.6 COC[C@H]1CCN1 CS-0053501 [0,0,0,1,0,0|2,0,0]=3 167 B7R1.6 NCCC1CCO1 CS-0052220 [0,0,0,1,0,0|1,0,0]=2 168 B7R1.6 NNCC1CCC1 CS-0049633 [0,0,0,1,0,0|3,0,0]=4 169 B7R1.6 OCCC1CCN1 CS-0104824 [0,0,0,1,0,0|2,0,0]=3 170 B7R1.6 OCCC1CCO1 CS-0052219 [0,0,0,1,0,0|1,0,0]=2 171 B7R1.6 OCCC1CNC1 CS-0052250 [0,0,0,1,0,0|3,0,0]=4 172 B7R1.6 OCCC1COC1 CS-0052216 [0,0,0,1,0,0|3,0,0]=4 173 B7R1.6 OCC[C@H]1CCO1 CS-0057152 [0,0,0,1,0,0|1,0,0]=2 174 B7R1.8 CN1CC[C@H]1CN CS-0053064 [0,0,0,1,0,0|3,0,0]=4 175 B7R1.8 O=C1CCC1CO CS-0045469 [0,0,0,1,0,0|1,0,2]=4 176 B7R1.8 OCC1CCC1F CS-0045492 [0,0,0,1,0,0|2,0,0]=3 177 B7R1.9 OC[C@H]1C[C@H]1CO CS-0053077 [0,0,0,1,0,0|3,0,0]=4 178 B7R1.10 CCN1CC(O)C1 CS-0052566 [0,0,0,1,0,0|3,0,0]=4 179 B7R1.10 CN1CC(CN)C1 CS-0053644 [0,0,0,1,0,0|3,0,0]=4 180 B7R1.10 CNC1CC(O)C1 CS-0051674 [0,0,0,1,0,0|3,0,0]=4 181 B7R1.10 CNC1CN(C)C1 CS-0048839 [0,0,0,1,0,0|3,0,0]=4 182 B7R1.10 CN[C@H]1C[C@H](O)C1 CS-0047809 [0,0,0,1,0,0|3,0,0]=4 183 B7R1.10 COC1CC(Br)C1 CS-0077320 [0,0,0,1,0,0|3,0,0]=4 184 B7R1.10 COC1CC(N)C1 CS-0051290 [0,0,0,1,0,0|3,0,0]=4 185 B7R1.10 CO[C@H]1C[C@@H](N)C1 CS-0049700 [0,0,0,1,0,0|3,0,0]=4 186 B7R1.10 NC1CC(CO)C1 CS-0053387 [0,0,0,1,0,0|3,0,0]=4 187 B7R1.10 NCC1CC(O)C1 CS-0051730 [0,0,0,1,0,0|3,0,0]=4 188 B7R1.10 NC[C@H]1C[C@@H](F)C1 CS-0057386 [0,0,0,1,0,0|3,0,0]=4 189 B7R1.10 NC[C@H]1C[C@@H](O)C1 CS-0021312 [0,0,0,1,0,0|3,0,0]=4 190 B7R1.10 NC[C@H]1C[C@H](O)C1 CS-0047821 [0,0,0,1,0,0|3,0,0]=4 191 B7R1.10 N[C@H]1C[C@@H](CO)C1 CS-0049714 [0,0,0,1,0,0|3,0,0]=4 192 B7R1.10 N[C@H]1C[C@H](CO)C1 CS-0045535 [0,0,0,1,0,0|3,0,0]=4 193 B7R1.10 OCC1CC(F)C1 CS-0053367 [0,0,0,1,0,0|3,0,0]=4 194 B7R1.21 CC1(CCO)CC1 CS-0088475 [0,0,0,1,0,0|2,0,0]=3 195 B7R1.21 COCC1(N)CC1 CS-0088505 [0,0,0,1,0,0|2,0,0]=3 196 B7R1.21 COCC1(O)CC1 CS-0055994 [0,0,0,1,0,0|1,0,0]=2 197 B7R1.21 NCCC1(O)CC1 CS-0069297 [0,0,0,1,0,0|1,0,0]=2 198 B7R1.21 OCCC1(O)CC1 CS-0052907 [0,0,0,1,0,0|1,0,0]=2 199 B7R1.22 CCC(N)C1CC1 CS-0052574 [0,0,0,1,0,0|1,0,0]=2 200 B7R1.22 CNC(=O)C1CC1 CS-0106601 [0,0,0,1,0,0|1,0,2]=4 201 B7R1.22 NC(CO)C1CC1 CS-0091326 [0,0,0,1,0,0|2,0,0]=3 202 B7R1.22 N[C@@H](CO)C1CC1 CS-0091328 [0,0,0,1,0,0|2,0,0]=3 203 B7R1.22 N[C@@H](CO)C1CC1 CS-0111762 [0,0,0,1,0,0|2,0,0]=3 204 B7R1.22 N[C@H](CO)C1CC1 CS-0091327 [0,0,0,1,0,0|2,0,0]=3 205 B7R1.25 C#CC1(O)CNC1 CS-0051376 [0,0,0,1,0,0|1,0,2]=4 206 B7R1.25 C#CC1(O)COC1 CS-0051375 [0,0,0,1,0,0|1,0,2]=4 207 B7R1.25 C=CC1(O)COC1 CS-B1109 [0,0,0,1,0,0|1,0,2]=4 208 B7R1.25 CC1(CCl)COC1 CS-0051705 [0,0,0,1,0,0|3,0,0]=4 209 B7R1.25 CC1(CI)COC1 CS-0051679 [0,0,0,1,0,0|3,0,0]=4 210 B7R1.25 CC1(CN)CCC1 CS-0045540 [0,0,0,1,0,0|2,0,0]=3 211 B7R1.25 CC1(CN)CNC1 CS-0053359 [0,0,0,1,0,0|3,0,0]=4 212 B7R1.25 CC1(CO)CNC1 CS-0053358 [0,0,0,1,0,0|3,0,0]=4 213 B7R1.25 CC1(CO)CSC1 CS-0091512 [0,0,0,1,0,0|3,0,0]=4 214 B7R1.25 CCC1(F)CNC1 CS-0106613 [0,0,0,1,0,0|2,0,0]=3 215 B7R1.25 CCC1(O)CNC1 CS-0051380 [0,0,0,1,0,0|1,0,0]=2 216 B7R1.25 CNC1(C)COC1 CS-0045413 [0,0,0,1,0,0|3,0,0]=4 217 B7R1.25 FC1(CBr)COC1 CS-0045512 [0,0,0,1,0,0|3,0,0]=4 218 B7R1.25 FC1(CI)COC1 CS-0051366 [0,0,0,1,0,0|3,0,0]=4 219 B7R1.25 N#CC1(N)CCC1 CS-0089764 [0,0,0,1,0,0|2,0,1]=4 220 B7R1.25 N#CC1(O)CCC1 CS-0039879 [0,0,0,1,0,0|1,0,1]=3 221 B7R1.25 NC1(CO)COC1 CS-0040896 [0,0,0,1,0,0|3,0,0]=4 222 B7R1.25 NCC1(F)CCC1 CS-0046396 [0,0,0,1,0,0|2,0,0]=3 223 B7R1.25 NCC1(F)CCC1 CS-0053659 [0,0,0,1,0,0|2,0,0]=3 224 B7R1.25 NCC1(F)COC1 CS-0045511 [0,0,0,1,0,0|3,0,0]=4 225 B7R1.25 NCC1(N)COC1 CS-0051727 [0,0,0,1,0,0|3,0,0]=4 226 B7R1.25 NCC1(O)COC1 CS-0051726 [0,0,0,1,0,0|2,0,0]=3 227 B7R1.25 OCC1(F)CNC1 CS-0036390 [0,0,0,1,0,0|3,0,0]=4 228 B7R1.25 OCC1(F)CNC1 CS-0060757 [0,0,0,1,0,0|3,0,0]=4 229 B7R1.25 OCC1(F)COC1 CS-0045510 [0,0,0,1,0,0|3,0,0]=4 230 B7R1.25 OCC1(O)CNC1 CS-0049771 [0,0,0,1,0,0|2,0,0]=3 231 B7R1.25 OCC1(O)COC1 CS-0051683 [0,0,0,1,0,0|2,0,0]=3 232 B4R0.1 [C@H](C)(N)CO CS-W011362 [2,0,0,0,0,0|2,0,0]=4 233 B4R0.2 CCCON CS-0106185 [2,0,0,0,0,0|2,0,0]=4 234 B4R0.2 CNCCF CS-0103514 [2,0,0,0,0,0|2,0,0]=4 235 B4R0.2 CNCCN CS-0108722 [2,0,0,0,0,0|2,0,0]=4 236 B4R0.2 COCCBr CS-0015336 [2,0,0,0,0,0|2,0,0]=4 237 B4R0.2 NCCCF CS-0088913 [2,0,0,0,0,0|2,0,0]=4 238 B6R0.2 CC(N)CN(C)C CS-B1299 [1,1,0,0,0,0|2,0,0]=4 239 B6R0.3 CC(O)C(N)CO CS-0091337 [1,1,0,0,0,0|1,0,0]=3 240 B6R0.3 C[C@@H](O)[C@@H](N)CO CS-0091338 [1,1,0,0,0,0|1,0,0]=3 241 B6R0.3 C[C@H](O)[C@H](N)CO CS-0091343 [1,1,0,0,0,0|1,0,0]=3 242 B6R0.4 CC(=O)CCCBr CS-0103669 [1,1,0,0,0,0|0,0,2]=4 243 B6R0.4 CC(F)CCCN CS-0104689 [1,1,0,0,0,0|1,0,0]=3 244 B6R0.4 CN(C)CCCCl CS-W004690 [1,1,0,0,0,0|2,0,0]=4 245 B6R0.4 CNCCC(=O)O CS-0112815 [1,1,0,0,0,0|1,0,1]=4 246 B6R0.4 NCCCC(F)F CS-0098955 [1,1,0,0,0,0|2,0,0]=4 247 B6R0.5 CC(C)(O)CCBr CS-W018816 [1,1,0,0,0,0|1,0,0]=3 248 B6R0.5 CC(C)(O)CON CS-0091973 [1,1,0,0,0,0|2,0,0]=4 249 B6R0.5 CC(C)(O)CON CS-0091974 [1,1,0,0,0,0|2,0,0]=4 250 B6R0.5 CNCC(C)(C)O CS-0038213 [1,1,0,0,0,0|1,0,0]=3 251 B6R0.5 CSCC(C)(C)N CS-0107363 [1,1,0,0,0,0|2,0,0]=4 252 B6R0.6 C#CCCCCI CS-0088557 [1,1,0,0,0,0|0,0,2]=4 253 B6R0.6 C#CCCCCN CS-0059697 [1,1,0,0,0,0|0,0,2]=4 254 B6R0.6 C#CCCCCN CS-0106594 [1,1,0,0,0,0|0,0,2]=4 255 B6R0.8 CCC(C)(N)CO CS-0091232 [1,1,0,0,0,0|2,0,0]=4 256 B6R0.9 CCC(CBr)CBr CS-0059688 [1,1,0,0,0,0|2,0,0]=4 257 B6R0.9 OCC(CO)CO CS-W005889 [1,1,0,0,0,0|2,0,0]=4 258 B8R0.2 CC[C@@H](C)[C@@H](O)C(=O)O CS-0108582 [0,2,0,0,0,0|1,0,1]=4 259 B8R0.2 CC[C@@H](O)[C@H](N)C(=O)O CS-0099896 [0,2,0,0,0,0|1,0,1]=4 260 B8R0.2 CC[C@H](O)[C@H](N)C(=O)O CS-0099899 [0,2,0,0,0,0|1,0,1]=4 261 B8R0.5 CCOC(=O)C[C@H](C)O CS-0112519 [0,2,0,0,0,0|0,0,2]=4 262 B8R0.34 CC(C)C[C@](C)(N)CO CS-0109916 [0,2,0,0,0,0|2,0,0]=4 263 B8R0.8 NCCC[C@H](O)C(=O)O CS-0105324 [0,2,0,0,0,0|1,0,1]=4 264 B8R0.11 COC(CCCN)OC CS-WAA0041 [0,2,0,0,0,0|1,0,0]=3 265 B8R0.14 NCCC(O)C(F)(F)F CS-0051051 [0,2,0,0,0,0|2,0,0]=4 266 B6R1.2 CC1CCCN1 CS-0051829 [1,0,0,1,0,0|1,0,0]=3 267 B6R1.2 NC1CCSC1 CS-0046717 [1,0,0,1,0,0|2,0,0]=4 268 B6R1.2 N[C@H]1CCOC1 CS-0053253 [1,0,0,1,0,0|2,0,0]=4 269 B6R1.2 OC1CCNC1 CS-W002985 [1,0,0,1,0,0|1,0,0]=3 270 B6R1.2 O[C@@H]1CNOC1 CS-0060090 [1,0,0,1,0,0|2,0,0]=4 271 B6R1.2 O[C@H]1CNOC1 CS-0060087 [1,0,0,1,0,0|2,0,0]=4 272 B6R1.3 ICCC1CC1 CS-0012702 [1,0,0,1,0,0|2,0,0]=4 273 B6R1.5 CN1CC(N)C1 CS-0045520 [1,0,0,1,0,0|2,0,0]=4 274 B6R1.5 C[C@H]1C[C@@H](N)C1 CS-0049698 [1,0,0,1,0,0|1,0,0]=3 275 B6R1.5 NC1CC(N)C1 CS-0049638 [1,0,0,1,0,0|2,0,0]=4 276 B6R1.5 NC1CC(O)C1 CS-W020372 [1,0,0,1,0,0|1,0,0]=3 277 B6R1.5 NN1CC(O)C1 CS-0052640 [1,0,0,1,0,0|2,0,0]=4 278 B6R1.5 N[C@H]1C[C@@H](F)C1 CS-0049708 [1,0,0,1,0,0|2,0,0]=4 279 B6R1.5 N[C@H]1C[C@@H](N)C1 CS-0049755 [1,0,0,1,0,0|2,0,0]=4 280 B6R1.5 N[C@H]1C[C@H](F)C1 CS-0047786 [1,0,0,1,0,0|2,0,0]=4 281 B6R1.5 N[C@H]1C[C@H](N)C1 CS-0047838 [1,0,0,1,0,0|2,0,0]=4 282 B6R1.5 N[C@H]1C[C@H](N)C1 CS-0047839 [1,0,0,1,0,0|2,0,0]=4 283 B6R1.5 N[C@H]1C[C@H](O)C1 CS-0047791 [1,0,0,1,0,0|1,0,0]=3 284 B6R1.5 OC1CC(O)C1 CS-0049637 [1,0,0,1,0,0|1,0,0]=3 285 B6R1.5 O[C@H]1C[C@@H](F)C1 CS-0049706 [1,0,0,1,0,0|1,0,0]=3 286 B6R1.5 O[C@H]1C[C@H](F)C1 CS-0047784 [1,0,0,1,0,0|1,0,0]=3 287 B6R1.5 O[C@H]1C[C@H](O)C1 CS-0056268 [1,0,0,1,0,0|1,0,0]=3 288 B6R1.8 COC1CC1N CS-0096341 [1,0,0,1,0,0|2,0,0]=4 289 B6R1.8 CO[C@@H]1C[C@H]1N CS-0081493 [1,0,0,1,0,0|2,0,0]=4 290 B6R1.9 CC1(C)CC1O CS-0081490 [1,0,0,1,0,0|2,0,0]=4 291 B6R1.9 CC1CC1(C)O CS-0098175 [1,0,0,1,0,0|0,0,0]=2 292 B6R1.10 CC1(F)CNC1 CS-0051364 [1,0,0,1,0,0|2,0,0]=4 293 B6R1.10 CC1(N)CCC1 CS-0089780 [1,0,0,1,0,0|1,0,0]=3 294 B6R1.10 CC1(N)CNC1 CS-0051248 [1,0,0,1,0,0|2,0,0]=4 295 B6R1.10 CC1(N)COC1 CS-0045507 [1,0,0,1,0,0|2,0,0]=4 296 B6R1.10 CC1(N)CSC1 CS-0045441 [1,0,0,1,0,0|2,0,0]=4 297 B6R1.10 CC1(O)CSC1 CS-0051237 [1,0,0,1,0,0|1,0,0]=3 298 B6R1.11 CC(N)C1CC1 CS-0099739 [1,0,0,1,0,0|1,0,0]=3 299 B6R1.11 CC(N)C1CC1 CS-0112917 [1,0,0,1,0,0|1,0,0]=3 300 B6R1.4 CC1OCC1O CS-0051834 [1,0,0,1,0,0|2,0,0]=4 301 B6R1.4 N[C@@H]1CC[C@H]1O CS-0045479 [1,0,0,1,0,0|2,0,0]=4 302 B6R1.4 N[C@H]1CC[C@H]1O CS-0049745 [1,0,0,1,0,0|2,0,0]=4 303 B6R1.6 BrCC1CCO1 CS-0045505 [1,0,0,1,0,0|2,0,0]=4 304 B6R1.6 CSC1CNC1 CS-0051673 [1,0,0,1,0,0|2,0,0]=4 305 B6R1.6 ClCC1COC1 CS-0051702 [1,0,0,1,0,0|2,0,0]=4 306 B6R1.6 FCC1CNC1 CS-0085106 [1,0,0,1,0,0|2,0,0]=4 307 B6R1.6 FCC1CNC1 CS-0102314 [1,0,0,1,0,0|2,0,0]=4 308 B6R1.6 ICC1CCC1 CS-0053096 [1,0,0,1,0,0|1,0,0]=3 309 B6R1.6 ICC1CCO1 CS-0052227 [1,0,0,1,0,0|2,0,0]=4 310 B6R1.6 ICC1COC1 CS-0045504 [1,0,0,1,0,0|2,0,0]=4 311 B6R1.6 NCC1CCN1 CS-0049914 [1,0,0,1,0,0|2,0,0]=4 312 B6R1.6 NCC1CCO1 CS-0048767 [1,0,0,1,0,0|2,0,0]=4 313 B6R1.6 NCC1CNC1 CS-0089832 [1,0,0,1,0,0|2,0,0]=4 314 B6R1.6 NCC1COC1 CS-W008698 [1,0,0,1,0,0|2,0,0]=4 315 B6R1.6 NCC1CSC1 CS-0045533 [1,0,0,1,0,0|2,0,0]=4 316 B6R1.6 NC[C@@H]1CCO1 CS-0100100 [1,0,0,1,0,0|2,0,0]=4 317 B6R1.6 NC[C@H]1CCO1 CS-0102901 [1,0,0,1,0,0|2,0,0]=4 318 B6R1.6 OCC1CCN1 CS-0049913 [1,0,0,1,0,0|2,0,0]=4 319 B6R1.6 OCC1CSC1 CS-0045518 [1,0,0,1,0,0|2,0,0]=4 320 B8R1.1 CCC1CCC(=O)N1 CS-0046651 [0,1,0,1,0,0|0,0,2]=4 321 B8R1.1 CCN1CCC(N)C1 CS-0052564 [0,1,0,1,0,0|1,0,0]=3 322 B8R1.1 CCN1CCC(O)C1 CS-W016601 [0,1,0,1,0,0|0,0,0]=2 323 B8R1.1 CCN1CC[C@@H](N)C1 CS-0053343 [0,1,0,1,0,0|1,0,0]=3 324 B8R1.1 CCN1CC[C@H](N)C1 CS-0053283 [0,1,0,1,0,0|1,0,0]=3 325 B8R1.1 CN1CCC(CN)C1 CS-0053642 [0,1,0,1,0,0|2,0,0]=4 326 B8R1.1 CN1CC[C@@H](CN)C1 CS-0053042 [0,1,0,1,0,0|2,0,0]=4 327 B8R1.1 CN1CC[C@@H](CN)C1 CS-0053043 [0,1,0,1,0,0|2,0,0]=4 328 B8R1.1 CN1CC[C@@H](CO)C1 CS-D0333 [0,1,0,1,0,0|1,0,0]=3 329 B8R1.1 CN1CC[C@H](CN)C1 CS-0053048 [0,1,0,1,0,0|2,0,0]=4 330 B8R1.1 CN1CC[C@H](CO)C1 CS-0053041 [0,1,0,1,0,0|1,0,0]=3 331 B8R1.1 N#C[C@H]1CC[C@@H](O)C1 CS-0038000 [0,1,0,1,0,0|0,0,1]=3 332 B8R1.1 NCC1CCC(F)C1 CS-0047567 [0,1,0,1,0,0|1,0,0]=3 333 B8R1.1 NCC1CCC(O)C1 CS-0107088 [0,1,0,1,0,0|0,0,0]=2 334 B8R1.1 O=C1CC[C@H](CO)O1 CS-0046919 [0,1,0,1,0,0|1,0,1]=4 335 B8R1.1 OCC1CCC(O)C1 CS-0108613 [0,1,0,1,0,0|0,0,0]=2 336 B8R1.1 OC[C@@H]1C[C@@H](F)CN1 CS-0035888 [0,1,0,1,0,0|2,0,0]=4 337 B8R1.1 OC[C@H]1C[C@@H](O)CO1 CS-0060089 [0,1,0,1,0,0|1,0,0]=3 338 B8R1.1 OC[C@H]1C[C@H](O)CN1 CS-0053224 [0,1,0,1,0,0|1,0,0]=3 339 B8R1.4 CC1CC(=O)CCN1 CS-0012636 [0,1,0,1,0,0|0,0,2]=4 340 B8R1.4 CC1CC(=O)CCN1 CS-0080309 [0,1,0,1,0,0|0,0,2]=4 341 B8R1.4 CC1CC(O)CCN1 CS-0051832 [0,1,0,1,0,0|0,0,0]=2 342 B8R1.4 CC1CC(O)CCN1 CS-0057464 [0,1,0,1,0,0|0,0,0]=2 343 B8R1.4 CC1CC(O)CCO1 CS-0051835 [0,1,0,1,0,0|0,0,0]=2 344 B8R1.4 CN1CCC[C@@H](N)C1 CS-0053341 [0,1,0,1,0,0|1,0,0]=3 345 B8R1.4 CN1CCC[C@@H](O)C1 CS-0053340 [0,1,0,1,0,0|0,0,0]=2 346 B8R1.4 CN1CCC[C@H](O)C1 CS-0053281 [0,1,0,1,0,0|0,0,0]=2 347 B8R1.4 C[C@@H]1CC(=O)CCN1 CS-0053488 [0,1,0,1,0,0|0,0,2]=4 348 B8R1.4 C[C@@H]1CNC[C@@H](C)N1 CS-0053457 [0,1,0,1,0,0|2,0,0]=4 349 B8R1.4 C[C@@H]1CNC[C@@H](C)O1 CS-0088046 [0,1,0,1,0,0|2,0,0]=4 350 B8R1.4 C[C@@H]1CNC[C@@H](C)O1 CS-W005832 [0,1,0,1,0,0|2,0,0]=4 351 B8R1.4 C[C@@H]1COC[C@@H](C)N1 CS-0055639 [0,1,0,1,0,0|2,0,0]=4 352 B8R1.4 C[C@@H]1COC[C@@H](C)N1 CS-0112796 [0,1,0,1,0,0|2,0,0]=4 353 B8R1.4 C[C@@H]1C[C@H](O)CCN1 CS-0053467 [0,1,0,1,0,0|0,0,0]=2 354 B8R1.4 C[C@H]1CC(=O)CCN1 CS-0053434 [0,1,0,1,0,0|0,0,2]=4 355 B8R1.4 C[C@H]1CC(=O)CCN1 CS-0053435 [0,1,0,1,0,0|0,0,2]=4 356 B8R1.4 C[C@H]1CNC[C@H](C)N1 CS-0053399 [0,1,0,1,0,0|2,0,0]=4 357 B8R1.4 C[C@H]1CNC[C@H](C)N1 CS-0099931 [0,1,0,1,0,0|2,0,0]=4 358 B8R1.4 C[C@H]1CNC[C@H](C)O1 CS-0102294 [0,1,0,1,0,0|2,0,0]=4 359 B8R1.4 C[C@H]1COC[C@@H](C)N1 CS-0049722 [0,1,0,1,0,0|2,0,0]=4 360 B8R1.4 C[C@H]1COC[C@H](C)N1 CS-0102260 [0,1,0,1,0,0|2,0,0]=4 361 B8R1.4 C[C@H]1C[C@@H](O)CCN1 CS-0053413 [0,1,0,1,0,0|0,0,0]=2 362 B8R1.4 NC1CCCC(F)C1 CS-0106921 [0,1,0,1,0,0|1,0,0]=3 363 B8R1.4 NC1CCCC(F)C1 CS-0106922 [0,1,0,1,0,0|1,0,0]=3 364 B8R1.4 NC1COCC(O)C1 CS-0050678 [0,1,0,1,0,0|1,0,0]=3 365 B8R1.4 N[C@@H]1CCC[C@@H](F)C1 CS-0047783 [0,1,0,1,0,0|1,0,0]=3 366 B8R1.4 N[C@@H]1CCC[C@@H](N)C1 CS-0110011 [0,1,0,1,0,0|1,0,0]=3 367 B8R1.4 N[C@@H]1CCC[C@@H](O)C1 CS-0047790 [0,1,0,1,0,0|0,0,0]=2 368 B8R1.4 N[C@@H]1CCC[C@H](O)C1 CS-0112892 [0,1,0,1,0,0|0,0,0]=2 369 B8R1.4 N[C@@H]1CCC[C@H](O)C1 CS-W007314 [0,1,0,1,0,0|0,0,0]=2 370 B8R1.4 N[C@H]1CCC[C@@H](N)C1 CS-0111626 [0,1,0,1,0,0|1,0,0]=3 371 B8R1.4 N[C@H]1CCC[C@H](N)C1 CS-0053558 [0,1,0,1,0,0|1,0,0]=3 372 B8R1.4 N[C@H]1CCC[C@H](O)C1 CS-0112699 [0,1,0,1,0,0|0,0,0]=2 373 B8R1.4 O=C1CCCC(O)C1 CS-0051335 [0,1,0,1,0,0|0,0,1]=3 374 B8R1.4 O=C1C[C@H](O)CCN1 CS-0105946 [0,1,0,1,0,0|1,0,1]=4 375 B8R1.18 CN1C[C@H](N)[C@H](O)C1 CS-0053297 [0,1,0,1,0,0|1,0,0]=3 376 B8R1.31 O=C(O)C1CCC1O CS-0090873 [0,1,0,1,0,0|1,0,1]=4 377 B8R1.34 CN(C)C[C@H]1CCN1 CS-0090866 [0,1,0,1,0,0|2,0,0]=4 378 B8R1.40 NC(CO)CC1CC1 CS-0091357 [0,1,0,1,0,0|2,0,0]=4 379 B8R1.40 N[C@@H](CO)CC1CC1 CS-0091358 [0,1,0,1,0,0|2,0,0]=4 380 B8R1.40 N[C@H](CO)CC1CC1 CS-0091361 [0,1,0,1,0,0|2,0,0]=4 381 B8R1.51 CC1(C)CC(O)CN1 CS-0050732 [0,1,0,1,0,0|1,0,0]=3 382 B8R1.51 C[C@@H]1CNC(C)(C)C1 CS-0094199 [0,1,0,1,0,0|2,0,0]=4 383 B8R1.51 N[C@@H]1CCC(F)(F)C1 CS-0053637 [0,1,0,1,0,0|2,0,0]=4 384 B8R1.51 N[C@H]1CCC(F)(F)C1 CS-0053585 [0,1,0,1,0,0|2,0,0]=4 385 B8R1.53 CC1(C)CC(CBr)C1 CS-0051713 [0,1,0,1,0,0|2,0,0]=4 386 B8R1.53 CC1(C)CC(CBr)O1 CS-0051172 [0,1,0,1,0,0|1,0,0]=3 387 B8R1.53 CC1(C)CC(CN)O1 CS-0053215 [0,1,0,1,0,0|1,0,0]=3 388 B8R1.53 CC1(C)CC(CO)O1 CS-0053214 [0,1,0,1,0,0|1,0,0]=3 389 B8R1.53 C[C@]1(O)C[C@@H](CN)C1 CS-0049703 [0,1,0,1,0,0|2,0,0]=4 390 B8R1.62 NC1(CO)CC(F)C1 CS-0053662 [0,1,0,1,0,0|2,0,0]=4 391 B8R1.2 BrCC1CCCNC1 CS-0112575 [0,1,0,1,0,0|2,0,0]=4 392 B8R1.2 BrCC1CCCOC1 CS-D0475 [0,1,0,1,0,0|1,0,0]=3 393 B8R1.2 BrCC1COCCO1 CS-0099875 [0,1,0,1,0,0|1,0,0]=3 394 B8R1.2 C#CC1CCNCC1 CS-0050866 [0,1,0,1,0,0|2,0,0]=4 395 B8R1.2 C#CC1CCNCC1 CS-0081005 [0,1,0,1,0,0|2,0,0]=4 396 B8R1.2 C#CC1CCOCC1 CS-0050867 [0,1,0,1,0,0|2,0,0]=4 397 B8R1.2 C#CC1CCSCC1 CS-0050864 [0,1,0,1,0,0|2,0,0]=4 398 B8R1.2 CC[C@@H]1CNCCO1 CS-0096526 [0,1,0,1,0,0|0,0,0]=2 399 B8R1.2 CC[C@@H]1CNCCO1 CS-0100798 [0,1,0,1,0,0|0,0,0]=2 400 B8R1.2 CC[C@H]1CNCCO1 CS-0094360 [0,1,0,1,0,0|0,0,0]=2 401 B8R1.2 CC[C@H]1CNCCO1 CS-0100795 [0,1,0,1,0,0|0,0,0]=2 402 B8R1.2 CNC1CCNCC1 CS-0048783 [0,1,0,1,0,0|2,0,0]=4 403 B8R1.2 CNC1CCOCC1 CS-D1570 [0,1,0,1,0,0|2,0,0]=4 404 B8R1.2 COC1CCCNC1 CS-0051284 [0,1,0,1,0,0|1,0,0]=3 405 B8R1.2 CO[C@H]1CCCNC1 CS-0053262 [0,1,0,1,0,0|1,0,0]=3 406 B8R1.2 ClCC1CCNCC1 CS-0051167 [0,1,0,1,0,0|2,0,0]=4 407 B8R1.2 ClCC1CNCCO1 CS-0060823 [0,1,0,1,0,0|1,0,0]=3 408 B8R1.2 FCC1CCCNC1 CS-0105992 [0,1,0,1,0,0|2,0,0]=4 409 B8R1.2 FCC1CCNCC1 CS-0051153 [0,1,0,1,0,0|2,0,0]=4 410 B8R1.2 FCC1CNCCN1 CS-0106315 [0,1,0,1,0,0|2,0,0]=4 411 B8R1.2 N#CC1CCCCN1 CS-0048755 [0,1,0,1,0,0|2,0,0]=4 412 B8R1.2 N#CC1CCCNC1 CS-0048754 [0,1,0,1,0,0|2,0,0]=4 413 B8R1.2 N#CC1CCSCC1 CS-0045921 [0,1,0,1,0,0|2,0,0]=4 414 B8R1.2 N#CC1CNCCO1 CS-0103652 [0,1,0,1,0,0|1,0,1]=4 415 B8R1.2 N#C[C@@H]1CCCCN1 CS-0049775 [0,1,0,1,0,0|2,0,0]=4 416 B8R1.2 N#C[C@@H]1CCCNC1 CS-0060758 [0,1,0,1,0,0|2,0,0]=4 417 B8R1.2 N#C[C@@H]1CNCCO1 CS-0103653 [0,1,0,1,0,0|1,0,1]=4 418 B8R1.2 N#C[C@H]1CCCNC1 CS-0053248 [0,1,0,1,0,0|2,0,0]=4 419 B8R1.2 NCC1CCCOC1 CS-0048770 [0,1,0,1,0,0|1,0,0]=3 420 B8R1.2 NCC1CCCOC1 CS-D0477 [0,1,0,1,0,0|1,0,0]=3 421 B8R1.2 NCC1CCOCC1 CS-0036420 [0,1,0,1,0,0|2,0,0]=4 422 B8R1.2 NCC1CCSCC1 CS-0045666 [0,1,0,1,0,0|2,0,0]=4 423 B8R1.2 NCC1CCSCC1 CS-0047857 [0,1,0,1,0,0|2,0,0]=4 424 B8R1.2 NCC1CNCCN1 CS-0112092 [0,1,0,1,0,0|2,0,0]=4 425 B8R1.2 NC[C@@H]1COCCO1 CS-0037059 [0,1,0,1,0,0|1,0,0]=3 426 B8R1.2 NNC1CCNCC1 CS-0109590 [0,1,0,1,0,0|2,0,0]=4 427 B8R1.2 O=CC1CCCOC1 CS-W008553 [0,1,0,1,0,0|1,0,1]=4 428 B8R1.2 O=CC1CCCSC1 CS-0100800 [0,1,0,1,0,0|1,0,1]=4 429 B8R1.2 O=CN1CCCCC1 CS-W016610 [0,1,0,1,0,0|1,0,1]=4 430 B8R1.2 OCC1CCCCO1 CS-0034490 [0,1,0,1,0,0|1,0,0]=3 431 B8R1.2 OCC1CCCOC1 CS-D0478 [0,1,0,1,0,0|1,0,0]=3 432 B8R1.2 OCC1CNCCN1 CS-0106316 [0,1,0,1,0,0|2,0,0]=4 433 B8R1.2 OCC1CNCCO1 CS-0106282 [0,1,0,1,0,0|1,0,0]=3 434 B8R1.2 OC[C@@H]1CNCCN1 CS-0112095 [0,1,0,1,0,0|2,0,0]=4 435 B8R1.2 OC[C@H]1CNCCN1 CS-0106317 [0,1,0,1,0,0|2,0,0]=4 436 B8R1.2 OC[C@H]1CNCCO1 CS-0108806 [0,1,0,1,0,0|1,0,0]=3 437 B8R1.3 CC1CCC(=O)NC1 CS-0009361 [0,1,0,1,0,0|0,0,2]=4 438 B8R1.3 CC1CNC(C)CN1 CS-0106273 [0,1,0,1,0,0|2,0,0]=4 439 B8R1.3 C[C@H]1CC[C@@H](O)CN1 CS-0057814 [0,1,0,1,0,0|0,0,0]=2 440 B8R1.3 C[C@H]1CN[C@@H](C)CN1 CS-0048757 [0,1,0,1,0,0|2,0,0]=4 441 B8R1.3 NC1CCC(=O)CC1 CS-0106163 [0,1,0,1,0,0|0,0,2]=4 442 B8R1.3 NC1CCC(F)CC1 CS-0106938 [0,1,0,1,0,0|1,0,0]=3 443 B8R1.3 N[C@H]1CC[C@@H](O)CC1 CS-0049680 [0,1,0,1,0,0|0,0,0]=2 444 B8R1.3 O=C1CCC(F)CC1 CS-0091730 [0,1,0,1,0,0|0,0,2]=4 445 B8R1.3 O=C1CCC(O)CC1 CS-D0911 [0,1,0,1,0,0|0,0,1]=3 446 B8R1.3 OC1CCC(S)CC1 CS-0106060 [0,1,0,1,0,0|0,0,0]=2 447 B8R1.3 O[C@H]1CC[C@@H](O)CC1 CS-0049754 [0,1,0,1,0,0|0,0,0]=2 448 B8R1.5 CC1CCNCC1O CS-0050805 [0,1,0,1,0,0|0,0,0]=2 449 B8R1.5 CC1CNCCC1=O CS-D0300 [0,1,0,1,0,0|0,0,2]=4 450 B8R1.5 CC1CNCCC1O CS-0051241 [0,1,0,1,0,0|0,0,0]=2 451 B8R1.5 CC1COCCC1N CS-D0213 [0,1,0,1,0,0|1,0,0]=3 452 B8R1.5 C[C@@H]1CCNC[C@@H]1O CS-0038217 [0,1,0,1,0,0|0,0,0]=2 453 B8R1.5 C[C@@H]1CNCCN1C CS-0006864 [0,1,0,1,0,0|2,0,0]=4 454 B8R1.5 C[C@@H]1CNCCN1C CS-0053508 [0,1,0,1,0,0|2,0,0]=4 455 B8R1.5 C[C@@H]1CNCC[C@@H]1O CS-0100460 [0,1,0,1,0,0|0,0,0]=2 456 B8R1.5 C[C@@H]1CNCC[C@H]1O CS-0051211 [0,1,0,1,0,0|0,0,0]=2 457 B8R1.5 C[C@@H]1COCC[C@@H]1N CS-0098981 [0,1,0,1,0,0|1,0,0]=3 458 B8R1.5 C[C@@H]1COCC[C@H]1N CS-0053239 [0,1,0,1,0,0|1,0,0]=3 459 B8R1.5 C[C@H]1CCNC[C@@H]1O CS-0036436 [0,1,0,1,0,0|0,0,0]=2 460 B8R1.5 C[C@H]1CNCCN1C CS-0006863 [0,1,0,1,0,0|2,0,0]=4 461 B8R1.5 C[C@H]1CNCCN1C CS-0053455 [0,1,0,1,0,0|2,0,0]=4 462 B8R1.5 C[C@H]1COCC[C@@H]1N CS-0047776 [0,1,0,1,0,0|1,0,0]=3 463 B8R1.5 C[C@H]1COCC[C@@H]1N CS-0058689 [0,1,0,1,0,0|1,0,0]=3 464 B8R1.5 F[C@H]1CCNC[C@@H]1F CS-0054840 [0,1,0,1,0,0|2,0,0]=4 465 B8R1.5 F[C@H]1CCNC[C@H]1F CS-0049725 [0,1,0,1,0,0|2,0,0]=4 466 B8R1.5 NC1CCOCC1O CS-0104804 [0,1,0,1,0,0|1,0,0]=3 467 B8R1.5 N[C@@H]1CCCC[C@H]1F CS-0038959 [0,1,0,1,0,0|1,0,0]=3 468 B8R1.5 N[C@@H]1CCCC[C@H]1F CS-0058722 [0,1,0,1,0,0|1,0,0]=3 469 B8R1.5 N[C@@H]1CCCC[C@H]1O CS-0062471 [0,1,0,1,0,0|0,0,0]=2 470 B8R1.5 N[C@@H]1CCCC[C@H]1O CS-0096323 [0,1,0,1,0,0|0,0,0]=2 471 B8R1.5 N[C@@H]1CCNC[C@H]1O CS-0109627 [0,1,0,1,0,0|1,0,0]=3 472 B8R1.5 N[C@@H]1CCOC[C@@H]1F CS-0049705 [0,1,0,1,0,0|2,0,0]=4 473 B8R1.5 N[C@@H]1CCOC[C@@H]1F CS-0058693 [0,1,0,1,0,0|2,0,0]=4 474 B8R1.5 N[C@@H]1CCOC[C@@H]1F CS-0100794 [0,1,0,1,0,0|2,0,0]=4 475 B8R1.5 N[C@@H]1CCOC[C@@H]1O CS-0049677 [0,1,0,1,0,0|1,0,0]=3 476 B8R1.5 N[C@@H]1CCOC[C@H]1F CS-0053241 [0,1,0,1,0,0|2,0,0]=4 477 B8R1.5 N[C@@H]1CCOC[C@H]1F CS-0100799 [0,1,0,1,0,0|2,0,0]=4 478 B8R1.5 N[C@@H]1CCOC[C@H]1O CS-0053238 [0,1,0,1,0,0|1,0,0]=3 479 B8R1.5 N[C@@H]1COCC[C@@H]1O CS-0058644 [0,1,0,1,0,0|1,0,0]=3 480 B8R1.5 N[C@@H]1COCC[C@H]1O CS-0053305 [0,1,0,1,0,0|1,0,0]=3 481 B8R1.5 N[C@H]1CCCC[C@H]1O CS-W008152 [0,1,0,1,0,0|0,0,0]=2 482 B8R1.5 N[C@H]1CCNC[C@@H]1O CS-0109961 [0,1,0,1,0,0|1,0,0]=3 483 B8R1.5 N[C@H]1CCOC[C@@H]1F CS-0058691 [0,1,0,1,0,0|2,0,0]=4 484 B8R1.5 N[C@H]1CCOC[C@@H]1O CS-0029596 [0,1,0,1,0,0|1,0,0]=3 485 B8R1.5 N[C@H]1CCOC[C@@H]1O CS-0053298 [0,1,0,1,0,0|1,0,0]=3 486 B8R1.5 N[C@H]1CCOC[C@H]1F CS-0053232 [0,1,0,1,0,0|2,0,0]=4 487 B8R1.5 N[C@H]1CCOC[C@H]1F CS-0093952 [0,1,0,1,0,0|2,0,0]=4 488 B8R1.5 N[C@H]1CCOC[C@H]1O CS-0053229 [0,1,0,1,0,0|1,0,0]=3 489 B8R1.5 N[C@H]1COCC[C@@H]1O CS-0047794 [0,1,0,1,0,0|1,0,0]=3 490 B8R1.5 N[C@H]1COCC[C@@H]1O CS-0053233 [0,1,0,1,0,0|1,0,0]=3 491 B8R1.5 O=C1CCCCC1F CS-0040502 [0,1,0,1,0,0|0,0,2]=4 492 B8R1.5 O=C1NCCC[C@H]1O CS-0112089 [0,1,0,1,0,0|1,0,1]=4 493 B8R1.5 OC1CCOCC1F CS-0051356 [0,1,0,1,0,0|1,0,0]=3 494 B8R1.5 O[C@@H]1CCCC[C@H]1F CS-0101188 [0,1,0,1,0,0|0,0,0]=2 495 B8R1.5 O[C@@H]1CCCC[C@H]1F CS-0101192 [0,1,0,1,0,0|0,0,0]=2 496 B8R1.5 O[C@@H]1CCNC[C@@H]1F CS-0102297 [0,1,0,1,0,0|1,0,0]=3 497 B8R1.5 O[C@@H]1CCNC[C@H]1F CS-0021964 [0,1,0,1,0,0|1,0,0]=3 498 B8R1.5 O[C@@H]1CCNC[C@H]1O CS-0047738 [0,1,0,1,0,0|1,0,0]=3 499 B8R1.5 O[C@@H]1CCOC[C@@H]1F CS-0049704 [0,1,0,1,0,0|1,0,0]=3 500 B8R1.5 O[C@@H]1CCOC[C@@H]1F CS-0058688 [0,1,0,1,0,0|1,0,0]=3 501 B8R1.5 O[C@@H]1CNCC[C@H]1F CS-0053301 [0,1,0,1,0,0|1,0,0]=3 502 B8R1.5 O[C@H]1CCCC[C@@H]1F CS-0101186 [0,1,0,1,0,0|0,0,0]=2 503 B8R1.5 O[C@H]1CCNC[C@@H]1F CS-0021965 [0,1,0,1,0,0|1,0,0]=3 504 B8R1.5 O[C@H]1CCNC[C@@H]1F CS-0035996 [0,1,0,1,0,0|1,0,0]=3 505 B8R1.5 O[C@H]1CCNC[C@H]1F CS-0021967 [0,1,0,1,0,0|1,0,0]=3 506 B8R1.5 O[C@H]1CCNC[C@H]1F CS-0039754 [0,1,0,1,0,0|1,0,0]=3 507 B8R1.5 O[C@H]1CCNC[C@H]1F CS-0058642 [0,1,0,1,0,0|1,0,0]=3 508 B8R1.5 O[C@H]1CCOC[C@H]1F CS-0053299 [0,1,0,1,0,0|1,0,0]=3 509 B8R1.5 O[C@H]1CNCC[C@H]1O CS-0049724 [0,1,0,1,0,0|1,0,0]=3 510 B8R1.22 CC1CCCCNC1 CS-0038439 [0,1,0,1,0,0|1,0,0]=3 511 B8R1.22 CC1CNCCCN1 CS-0100317 [0,1,0,1,0,0|2,0,0]=4 512 B8R1.22 C[C@@H]1CNCCCN1 CS-0100401 [0,1,0,1,0,0|2,0,0]=4 513 B8R1.22 C[C@H]1CNCCCN1 CS-0100318 [0,1,0,1,0,0|2,0,0]=4 514 B8R1.22 NC1CCCCCC1 CS-0071927 [0,1,0,1,0,0|1,0,0]=3 515 B8R1.22 OC1CCCNCC1 CS-0038201 [0,1,0,1,0,0|0,0,0]=2 516 B8R1.22 SC1CCCCCC1 CS-0106062 [0,1,0,1,0,0|0,1,0]=3 517 B8R1.38 CC(CO)C1CCO1 CS-0052218 [0,1,0,1,0,0|1,0,0]=3 518 B8R1.38 NC(CO)C1CCC1 CS-0091364 [0,1,0,1,0,0|2,0,0]=4 519 B8R1.38 N[C@@H](CO)C1CCC1 CS-0091362 [0,1,0,1,0,0|2,0,0]=4 520 B8R1.38 N[C@H](CO)C1CCC1 CS-0089880 [0,1,0,1,0,0|2,0,0]=4 521 B8R1.47 CCN1CC(CN)C1 CS-0045566 [0,1,0,1,0,0|2,0,0]=4 522 B8R1.47 CO[C@H]1C[C@@H](CN)C1 CS-0052977 [0,1,0,1,0,0|2,0,0]=4 523 B8R1.47 CO[C@H]1C[C@H](CN)C1 CS-0047778 [0,1,0,1,0,0|2,0,0]=4 524 B8R1.50 CN1CCC(O)C1=O CS-0099936 [0,1,0,1,0,0|1,0,1]=4 525 B8R1.50 CN1CC[C@@H](O)C1=O CS-0106928 [0,1,0,1,0,0|1,0,1]=4 526 B8R1.52 C#CC1(O)CCOC1 CS-0051374 [0,1,0,1,0,0|0,0,2]=4 527 B8R1.52 CC1(CN)CCCC1 CS-0037963 [0,1,0,1,0,0|2,0,0]=4 528 B8R1.52 CC1(CN)CCNC1 CS-0053353 [0,1,0,1,0,0|2,0,0]=4 529 B8R1.52 CC1(CN)CCOC1 CS-0053357 [0,1,0,1,0,0|2,0,0]=4 530 B8R1.52 C[C@@]1(CO)CCCN1 CS-0053062 [0,1,0,1,0,0|2,0,0]=4 531 B8R1.52 C[C@]1(CO)CCCN1 CS-0053068 [0,1,0,1,0,0|2,0,0]=4 532 B8R1.52 NC1(CO)CCCC1 CS-0088069 [0,1,0,1,0,0|2,0,0]=4 533 B8R1.52 NC1(CO)CCOC1 CS-0053386 [0,1,0,1,0,0|2,0,0]=4 534 B8R1.52 OC1(CF)CCNC1 CS-0051689 [0,1,0,1,0,0|1,0,0]=3 535 B8R1.52 OCC1(O)CCNC1 CS-0051680 [0,1,0,1,0,0|1,0,0]=3 536 B8R1.7 CC(C)[C@@H]1CCCN1 CS-0053448 [0,1,0,1,0,0|1,0,0]=3 537 B8R1.7 CC(C)[C@H]1CCCN1 CS-0053500 [0,1,0,1,0,0|1,0,0]=3 538 B8R1.7 CC(C)[C@H]1CCNC1 CS-0053334 [0,1,0,1,0,0|2,0,0]=4 539 B8R1.7 CC(N)C1CCCC1 CS-0052581 [0,1,0,1,0,0|1,0,0]=3 540 B8R1.7 CC(N)C1CCCO1 CS-0091427 [0,1,0,1,0,0|0,0,0]=2 541 B8R1.7 FC(F)[C@@H]1CCCN1 CS-0053451 [0,1,0,1,0,0|2,0,0]=4 542 B8R1.7 O=C(O)[C@H]1CCCO1 CS-W005223 [0,1,0,1,0,0|1,0,1]=4 543 B8R1.19 CC1CNCC1(F)F CS-0102311 [0,1,0,1,0,0|2,0,0]=4 544 B8R1.19 C[C@@]1(O)CCC[C@H]1N CS-0105761 [0,1,0,1,0,0|1,0,0]=3 545 B8R1.19 C[C@@]1(O)CCC[C@H]1N CS-0112219 [0,1,0,1,0,0|1,0,0]=3 546 B8R1.19 C[C@H]1COC[C@@]1(C)O CS-0047333 [0,1,0,1,0,0|1,0,0]=3 547 B8R1.19 NC1CCCC1(F)F CS-0108754 [0,1,0,1,0,0|2,0,0]=4 548 B8R1.19 OC1CNCC1(F)F CS-0051119 [0,1,0,1,0,0|2,0,0]=4 549 B8R1.24 CC1(C)[C@@H](N)C[C@H]1O CS-0049716 [0,1,0,1,0,0|1,0,0]=3 550 B8R1.54 CC(Br)C(=O)C1CC1 CS-0052008 [0,1,0,1,0,0|0,0,2]=4 551 B8R1.78 CC(C)C1(O)CNC1 CS-0051665 [0,1,0,1,0,0|1,0,0]=3 552 B8R1.78 O=C(O)C1(O)CCC1 CS-0052945 [0,1,0,1,0,0|1,0,1]=4 553 B8R1.6 CCNC1CN(C)C1 CS-0054593 [0,1,0,1,0,0|2,0,0]=4 554 B8R1.6 CCOC1CC(N)C1 CS-0102254 [0,1,0,1,0,0|2,0,0]=4 555 B8R1.6 CN1CC(CCO)C1 CS-0052322 [0,1,0,1,0,0|2,0,0]=4 556 B8R1.6 COCC1CC(N)C1 CS-0051675 [0,1,0,1,0,0|2,0,0]=4 557 B8R1.6 COC[C@H]1C[C@@H](N)C1 CS-0049727 [0,1,0,1,0,0|2,0,0]=4 558 B8R1.8 CCNC1CCOC1 CS-0048813 [0,1,0,1,0,0|1,0,0]=3 559 B8R1.8 CCO[C@H]1CCNC1 CS-0053269 [0,1,0,1,0,0|2,0,0]=4 560 B8R1.8 CNCC1CCOC1 CS-0048865 [0,1,0,1,0,0|1,0,0]=3 561 B8R1.8 COCC1CCNC1 CS-0038166 [0,1,0,1,0,0|2,0,0]=4 562 B8R1.8 COCC1CCNC1 CS-0058668 [0,1,0,1,0,0|2,0,0]=4 563 B8R1.8 COC[C@@H]1CCNC1 CS-0053335 [0,1,0,1,0,0|2,0,0]=4 564 B8R1.8 COC[C@H]1CCNC1 CS-0053272 [0,1,0,1,0,0|2,0,0]=4 565 B8R1.8 N#CCC1CCCC1 CS-0060786 [0,1,0,1,0,0|1,0,1]=4 566 B8R1.8 NCCC1CCCC1 CS-W006125 [0,1,0,1,0,0|1,0,0]=3 567 B8R1.8 OCCC1CCNC1 CS-0052204 [0,1,0,1,0,0|2,0,0]=4 568 B8R1.11 CN1CCC[C@@H]1CN CS-0053069 [0,1,0,1,0,0|2,0,0]=4 569 B8R1.11 CN1CCC[C@H]1CBr CS-0112933 [0,1,0,1,0,0|2,0,0]=4 570 B8R1.11 CO[C@@H]1CNC[C@@H]1F CS-0036147 [0,1,0,1,0,0|2,0,0]=4 571 B8R1.11 CO[C@@H]1CNC[C@@H]1O CS-0053237 [0,1,0,1,0,0|1,0,0]=3 572 B8R1.11 CO[C@@H]1CNC[C@H]1F CS-0106644 [0,1,0,1,0,0|2,0,0]=4 573 B8R1.11 CO[C@@H]1CNC[C@H]1O CS-0047754 [0,1,0,1,0,0|1,0,0]=3 574 B8R1.11 CO[C@@H]1COC[C@H]1N CS-0046713 [0,1,0,1,0,0|2,0,0]=4 575 B8R1.11 CO[C@H]1CNC[C@H]1O CS-0055739 [0,1,0,1,0,0|1,0,0]=3 576 B8R1.11 N[C@@H]1CNC[C@H]1CO CS-0094627 [0,1,0,1,0,0|2,0,0]=4 577 B8R1.11 OC[C@@H]1CC=C[C@@H]1O CS-M0199 [0,1,0,1,0,0|0,0,2]=4 578 B8R1.11 OC[C@H]1OCC[C@@H]1O CS-0089202 [0,1,0,1,0,0|1,0,0]=3 579 B8R1.66 C#CCC1(O)COC1 CS-0051667 [0,1,0,1,0,0|0,0,2]=4 580 B8R1.66 CNCC1(C)COC1 CS-0048867 [0,1,0,1,0,0|2,0,0]=4 581 B8R1.66 COCC1(F)CNC1 CS-0051365 [0,1,0,1,0,0|2,0,0]=4 582 B8R1.66 NC1(CCO)COC1 CS-0052287 [0,1,0,1,0,0|2,0,0]=4 583 B8R1.66 OCCC1(F)COC1 CS-0057751 [0,1,0,1,0,0|2,0,0]=4 584 B8R1.66 OCCC1(O)COC1 CS-0051770 [0,1,0,1,0,0|1,0,0]=3 585 B8R1.48 NCC1CCC1(F)F CS-0046530 [0,1,0,1,0,0|2,0,0]=4 586 B8R1.72 CC1(N)CCNCC1 CS-0091552 [0,1,0,1,0,0|2,0,0]=4 587 B8R1.72 CC1(N)CCNCC1 CS-0091554 [0,1,0,1,0,0|2,0,0]=4 588 B8R1.72 CC1(N)CCOCC1 CS-0039635 [0,1,0,1,0,0|2,0,0]=4 589 B8R1.72 CC1(N)CCOCC1 CS-W018780 [0,1,0,1,0,0|2,0,0]=4 590 B8R1.72 CC1(O)CCCNC1 CS-0051242 [0,1,0,1,0,0|1,0,0]=3 591 B8R1.72 C[C@]1(O)CCCNC1 CS-0053261 [0,1,0,1,0,0|1,0,0]=3 592 B8R1.82 CNCC1(OC)CC1 CS-0081517 [0,1,0,1,0,0|1,0,0]=3 593 B8R1.82 COCC1(C=O)CC1 CS-0090320 [0,1,0,1,0,0|1,0,1]=4 594 B8R1.82 N#CC1(CCO)CC1 CS-0052906 [0,1,0,1,0,0|2,0,0]=4 595 B8R1.60 CCC1(C#N)CNC1 CS-0104530 [0,1,0,1,0,0|2,0,0]=4 596 B8R1.60 CCC1(C#N)COC1 CS-0051379 [0,1,0,1,0,0|2,0,0]=4 597 B8R1.60 CCC1(CN)COC1 CS-0053369 [0,1,0,1,0,0|2,0,0]=4 598 B8R1.60 CNC1(CO)COC1 CS-0052994 [0,1,0,1,0,0|2,0,0]=4 599 B8R1.60 COC1(CN)COC1 CS-0053365 [0,1,0,1,0,0|2,0,0]=4 600 B8R1.60 COC1(CO)COC1 CS-0053364 [0,1,0,1,0,0|2,0,0]=4 601 B8R1.60 NCC1(CN)CCC1 CS-0052782 [0,1,0,1,0,0|2,0,0]=4 602 B8R1.60 NCC1(CO)COC1 CS-0053001 [0,1,0,1,0,0|2,0,0]=4 603 B8R1.60 NCC1(CO)COC1 CS-0053002 [0,1,0,1,0,0|2,0,0]=4 604 B8R1.60 NCC1(CO)COC1 CS-W006858 [0,1,0,1,0,0|2,0,0]=4 605 B8R1.60 OCC1(CO)CCC1 CS-D0251 [0,1,0,1,0,0|1,0,0]=3 606 B8R1.60 OCC1(CO)CNC1 CS-0052996 [0,1,0,1,0,0|2,0,0]=4 607 B8R1.60 OCC1(CO)COC1 CS-0052995 [0,1,0,1,0,0|2,0,0]=4 608 B8R2.11 N[C@@H]1[C@H]2COC[C@H]21 CS-0035789 [0,0,0,2,0,0|2,0,0]=4 609 B8R2.22 C1CC2CNCC12 CS-0046699 [0,0,0,2,0,0|2,0,0]=4 610 B8R2.22 C1CC2CNCC12 CS-0046701 [0,0,0,2,0,0|2,0,0]=4 611 B8R2.22 C1NCC2NCC12 CS-0046539 [0,0,0,2,0,0|2,0,0]=4 612 B8R2.34 C1CC2CC1CN2 CS-0067833 [0,0,0,2,0,0|1,0,0]=3 613 B8R2.34 C1CC2CCC1N2 CS-0050113 [0,0,0,2,0,0|1,0,0]=3 614 B8R2.34 C1NC2CNC1C2 CS-0047653 [0,0,0,2,0,0|2,0,0]=4 615 B8R2.34 C1OC2CNC1C2 CS-0051828 [0,0,0,2,0,0|1,0,0]=3 616 B8R2.34 C1O[C@H]2CN[C@@H]1C2 CS-0053606 [0,0,0,2,0,0|1,0,0]=3 617 B8R2.34 [C@H]12CC[C@H](C1)NC2 CS-0067821 [0,0,0,2,0,0|1,0,0]=3 618 B8R2.55 C1CC2(CC2)CN1 CS-0058662 [0,0,0,2,0,0|2,0,0]=4 619 B8R2.55 C1CNC2(C1)CC2 CS-0088474 [0,0,0,2,0,0|1,0,0]=3 620 B8R2.55 C1CNC2(C1)CC2 CS-0103023 [0,0,0,2,0,0|1,0,0]=3 621 B8R2.7 NC12CCC(C1)C2 CS-0088989 [0,0,0,2,0,0|1,0,0]=3 622 B8R2.7 NC12CCC(C1)C2 CS-0088990 [0,0,0,2,0,0|1,0,0]=3 623 B8R2.18 NC1CC2CC2C1 CS-0046677 [0,0,0,2,0,0|1,0,0]=3 624 B8R2.18 NC1CC2CC2C1 CS-0049781 [0,0,0,2,0,0|1,0,0]=3 625 B8R2.18 OC1CC2CC2C1 CS-0035529 [0,0,0,2,0,0|0,0,0]=2 626 B8R2.38 [C@H]12C[C@H]1CC[C@@H]2O CS-0088889 [0,0,0,2,0,0|0,0,0]=2 627 B8R2.2 CC12CCCC1O2 CS-0112282 [0,0,0,2,0,0|0,0,0]=2 628 B8R2.23 C1NCC2CC1C2 CS-0058463 [0,0,0,2,0,0|2,0,0]=4 629 B8R2.23 C1NCC2CC1O2 CS-0054897 [0,0,0,2,0,0|1,0,0]=3 630 B8R2.23 C1OCC2CC1N2 CS-0037985 [0,0,0,2,0,0|2,0,0]=4 631 B8R2.23 C1OCC2CC1N2 CS-0051232 [0,0,0,2,0,0|2,0,0]=4 632 B8R2.25 C1CC2CC2CN1 CS-0059003 [0,0,0,2,0,0|2,0,0]=4 633 B8R2.25 C1CC2NC2CO1 CS-0112795 [0,0,0,2,0,0|2,0,0]=4 634 B8R2.25 C1CC2OC2CO1 CS-0051589 [0,0,0,2,0,0|1,0,0]=3 635 B8R2.42 C1CC2(C1)CCN2 CS-0047658 [0,0,0,2,0,0|1,0,0]=3 636 B8R2.42 C1CC2(C1)CNC2 CS-0112364 [0,0,0,2,0,0|2,0,0]=4 637 B8R2.42 C1CC2(CNC2)O1 CS-0029784 [0,0,0,2,0,0|1,0,0]=3 638 B8R2.42 C1CC2(CNC2)S1 CS-0052354 [0,0,0,2,0,0|1,1,0]=4 639 B8R2.19 NC1CCC12CC2 CS-0067017 [0,0,0,2,0,0|1,0,0]=3 640 B8R2.19 O=C1CCC12CC2 CS-0048699 [0,0,0,2,0,0|0,0,2]=4 641 B8R2.20 NCC1CC12CC2 CS-0067342 [0,0,0,2,0,0|2,0,0]=4 642 B8R2.20 OCC1CC12CC2 CS-0067352 [0,0,0,2,0,0|2,0,0]=4 643 B8R2.31 BrCC12CC(C1)C2 CS-0052834 [0,0,0,2,0,0|2,0,0]=4 644 B8R2.31 OCC12CC(C1)C2 CS-0049790 [0,0,0,2,0,0|2,0,0]=4 645 B8R2.53 NC1CC2(CC2)C1 CS-0067434 [0,0,0,2,0,0|2,0,0]=4 646 B8R2.41 NC1(C2CC2)CC1 CS-0088517 [0,0,0,2,0,0|1,0,0]=3