0 B8R1.4 CC1CC(=O)CCN1 SC-14913 [0,0,0,0,0,0|1,0,0]=1 1 B8R1.4 CC1CC(=O)CCN1 SC-26346 [0,0,0,0,0,0|1,0,0]=1 2 B8R1.4 CC1CC(=O)CCO1 SC-43658 [0,0,0,0,0,0|1,0,0]=1 3 B8R1.4 CC1CC(O)CCO1 SC-15639 [0,0,0,0,0,0|1,0,2]=3 4 B8R1.4 CC1CCCC(=O)N1 SC-90092 [0,0,0,0,0,0|1,0,0]=1 5 B8R1.4 CC1CCNC(=O)C1 SC-65553 [0,0,0,0,0,0|1,0,0]=1 6 B8R1.4 CC1CCNC(C)C1 SC-05916 [0,0,0,0,0,0|2,0,1]=3 7 B8R1.4 CC1CN(C)CCN1 SC-93123 [0,0,0,0,0,0|3,0,0]=3 8 B8R1.4 CC1CNCC(=O)N1 SC-68745 [0,0,0,0,0,0|2,0,0]=2 9 B8R1.4 CC1CNCC(C)N1 SC-00302 [0,0,0,0,0,0|3,0,1]=4 10 B8R1.4 CC1COCC(C)N1 SC-87916 [0,0,0,0,0,0|3,0,1]=4 11 B8R1.4 CC1COCC(C)N1 SC-91963 [0,0,0,0,0,0|3,0,1]=4 12 B8R1.4 CN1CCCC(=O)C1 SC-88063 [0,0,0,0,0,0|1,0,0]=1 13 B8R1.4 CN1CCNC(=O)C1 SC-43594 [0,0,0,0,0,0|2,0,0]=2 14 B8R1.4 C[C@@H]1CNC[C@@H](C)O1 SC-53240 [0,0,0,0,0,0|3,0,1]=4 15 B8R1.4 C[C@H]1CN(C)CCN1 SC-A3639 [0,0,0,0,0,0|3,0,0]=3 16 B8R1.4 C[C@H]1CNC[C@@H](C)N1 SC-94350 [0,0,0,0,0,0|3,0,1]=4 17 B8R1.4 C[C@H]1CNC[C@@H](C)O1 SC-15727 [0,0,0,0,0,0|3,0,1]=4 18 B8R1.4 C[C@H]1CNC[C@H](C)O1 SC-50936 [0,0,0,0,0,0|3,0,1]=4 19 B8R1.4 C[C@H]1COCC(=O)N1 SC-82343 [0,0,0,0,0,0|2,0,0]=2 20 B8R1.4 C[C@H]1COC[C@H](C)N1 SC-67152 [0,0,0,0,0,0|3,0,1]=4 21 B8R1.4 NC1=CC(=O)CCC1 SC-18537 [0,0,0,0,0,0|1,0,2]=3 22 B8R1.4 NC1CCCC(O)C1 SC-19361 [0,0,0,0,0,0|1,0,2]=3 23 B8R1.4 N[C@@H]1CCC[C@@H](O)C1 SC-43595 [0,0,0,0,0,0|1,0,2]=3 24 B8R1.4 N[C@@H]1CCC[C@@H](O)C1 SC-47974 [0,0,0,0,0,0|1,0,2]=3 25 B8R1.4 N[C@@H]1CCC[C@H](O)C1 SC-43598 [0,0,0,0,0,0|1,0,2]=3 26 B8R1.4 N[C@H]1CCC[C@@H](N)C1 SC-A2329 [0,0,0,0,0,0|2,0,1]=3 27 B8R1.4 N[C@H]1CCC[C@@H](O)C1 SC-12531 [0,0,0,0,0,0|1,0,2]=3 28 B8R1.4 N[C@H]1CCC[C@@H](O)C1 SC-43597 [0,0,0,0,0,0|1,0,2]=3 29 B8R1.4 O=C1CC(O)CCN1 SC-14921 [0,0,0,0,0,0|2,0,0]=2 30 B8R1.4 O=C1CC(O)CCN1 SC-26449 [0,0,0,0,0,0|2,0,0]=2 31 B8R1.4 O=C1CCCC(=O)C1 SC-16085 [0,0,0,0,0,0|1,0,1]=2 32 B8R1.4 O=C1CCCC(=O)N1 SC-65454 [0,0,0,0,0,0|2,0,1]=3 33 B8R1.4 O=C1CCCC(=O)O1 SC-43876 [0,0,0,0,0,0|2,0,1]=3 34 B8R1.4 O=C1CCCC(O)C1 SC-52929 [0,0,0,0,0,0|1,0,0]=1 35 B8R1.4 O=C1COCC(=O)O1 SC-26890 [0,0,0,0,0,0|3,0,1]=4 36 B8R1.4 O=C1CSCC(=O)C1 SC-21904 [0,0,0,0,0,0|2,0,1]=3 37 B7R1.3 BrC1=CCCCC1 SC-69986 [1,0,0,0,0,0|1,0,1]=3 38 B7R1.3 BrC1CCCOC1 SC-43426 [1,0,0,0,0,0|2,0,0]=3 39 B7R1.3 BrC1CCNCC1 SC-05213 [1,0,0,0,0,0|2,0,1]=4 40 B7R1.3 BrC1CCNCC1 SC-48705 [1,0,0,0,0,0|2,0,1]=4 41 B7R1.3 BrC1CCOCC1 SC-27394 [1,0,0,0,0,0|2,0,1]=4 42 B7R1.3 C=C1CCNCC1 SC-88353 [1,0,0,0,0,0|2,0,0]=3 43 B7R1.3 CC1=CCCCC1 SC-99243 [1,0,0,0,0,0|1,0,1]=3 44 B7R1.3 CC1=CCCNC1 SC-82898 [1,0,0,0,0,0|1,0,2]=4 45 B7R1.3 CC1=CCNCC1 SC-B8899 [1,0,0,0,0,0|2,0,1]=4 46 B7R1.3 CC1CCCCC1 SC-79075 [1,0,0,0,0,0|0,0,1]=2 47 B7R1.3 CC1CCCNC1 SC-46299 [1,0,0,0,0,0|1,0,0]=2 48 B7R1.3 CC1CCNCC1 SC-05890 [1,0,0,0,0,0|1,0,1]=3 49 B7R1.3 CC1CNCCO1 SC-49158 [1,0,0,0,0,0|2,0,0]=3 50 B7R1.3 CC1CNCCO1 SC-82780 [1,0,0,0,0,0|2,0,0]=3 51 B7R1.3 CC1CNCCO1 SC-A3535 [1,0,0,0,0,0|2,0,0]=3 52 B7R1.3 CC1COCCN1 SC-49161 [1,0,0,0,0,0|2,0,0]=3 53 B7R1.3 CN1CCNCC1 SC-00315 [1,0,0,0,0,0|2,0,1]=4 54 B7R1.3 CN1CCNCC1 SC-66326 [1,0,0,0,0,0|2,0,1]=4 55 B7R1.3 C[C@@H]1CNCCO1 SC-43965 [1,0,0,0,0,0|2,0,0]=3 56 B7R1.3 C[C@@H]1CNCCO1 SC-88816 [1,0,0,0,0,0|2,0,0]=3 57 B7R1.3 C[C@@H]1COCCN1 SC-53994 [1,0,0,0,0,0|2,0,0]=3 58 B7R1.3 C[C@H]1CCCNC1 SC-99949 [1,0,0,0,0,0|1,0,0]=2 59 B7R1.3 C[C@H]1CNCCO1 SC-44479 [1,0,0,0,0,0|2,0,0]=3 60 B7R1.3 C[C@H]1COCCN1 SC-21564 [1,0,0,0,0,0|2,0,0]=3 61 B7R1.3 C[C@H]1COCCN1 SC-69967 [1,0,0,0,0,0|2,0,0]=3 62 B7R1.3 C[SiH]1CCCCO1 SC-91060 [1,0,0,0,0,0|1,1,1]=4 63 B7R1.3 ClC1CCCCO1 SC-85266 [1,0,0,0,0,0|2,0,1]=4 64 B7R1.3 FC1CCCCC1 SC-09547 [1,0,0,0,0,0|1,0,1]=3 65 B7R1.3 FC1CCCNC1 SC-21265 [1,0,0,0,0,0|2,0,0]=3 66 B7R1.3 IC1CCOCC1 SC-98886 [1,0,0,0,0,0|2,0,1]=4 67 B7R1.3 NC1CCCNC1 SC-54118 [1,0,0,0,0,0|2,0,0]=3 68 B7R1.3 NC1CCCNC1 SC-77469 [1,0,0,0,0,0|2,0,0]=3 69 B7R1.3 NC1CCCOC1 SC-35742 [1,0,0,0,0,0|2,0,0]=3 70 B7R1.3 NC1CCCOC1 SC-49332 [1,0,0,0,0,0|2,0,0]=3 71 B7R1.3 NC1CCNCC1 SC-00743 [1,0,0,0,0,0|2,0,1]=4 72 B7R1.3 NC1CCNCC1 SC-03792 [1,0,0,0,0,0|2,0,1]=4 73 B7R1.3 NC1CCOCC1 SC-03529 [1,0,0,0,0,0|2,0,1]=4 74 B7R1.3 NC1CCOCC1 SC-04006 [1,0,0,0,0,0|2,0,1]=4 75 B7R1.3 NC1CCSCC1 SC-35455 [1,0,0,0,0,0|2,0,1]=4 76 B7R1.3 NC1CCSCC1 SC-49681 [1,0,0,0,0,0|2,0,1]=4 77 B7R1.3 NN1CCCCC1 SC-18780 [1,0,0,0,0,0|2,0,0]=3 78 B7R1.3 NN1CCOCC1 SC-27139 [1,0,0,0,0,0|3,0,0]=4 79 B7R1.3 N[C@@H]1CCCNC1 SC-03568 [1,0,0,0,0,0|2,0,0]=3 80 B7R1.3 N[C@@H]1CCCOC1 SC-71639 [1,0,0,0,0,0|2,0,0]=3 81 B7R1.3 N[C@@H]1CCCOC1 SC-96408 [1,0,0,0,0,0|2,0,0]=3 82 B7R1.3 N[C@H]1CCCNC1 SC-25042 [1,0,0,0,0,0|2,0,0]=3 83 B7R1.3 N[C@H]1CCCOC1 SC-94110 [1,0,0,0,0,0|2,0,0]=3 84 B7R1.3 O=C1C=CCCN1 SC-25185 [1,0,0,0,0,0|1,0,2]=4 85 B7R1.3 O=C1C=CCCO1 SC-50374 [1,0,0,0,0,0|1,0,2]=4 86 B7R1.3 O=C1CCCCN1 SC-16274 [1,0,0,0,0,0|1,0,0]=2 87 B7R1.3 O=C1CCCCO1 SC-65111 [1,0,0,0,0,0|1,0,0]=2 88 B7R1.3 O=C1CCCNC1 SC-29391 [1,0,0,0,0,0|1,0,0]=2 89 B7R1.3 O=C1CCCNC1 SC-48015 [1,0,0,0,0,0|1,0,0]=2 90 B7R1.3 O=C1CCCOC1 SC-14944 [1,0,0,0,0,0|1,0,0]=2 91 B7R1.3 O=C1CCNCC1 SC-04236 [1,0,0,0,0,0|1,0,0]=2 92 B7R1.3 O=C1CCNCC1 SC-04379 [1,0,0,0,0,0|1,0,0]=2 93 B7R1.3 O=C1CCNCC1 SC-19352 [1,0,0,0,0,0|1,0,0]=2 94 B7R1.3 O=C1CCOCC1 SC-03251 [1,0,0,0,0,0|1,0,0]=2 95 B7R1.3 O=C1CCSCC1 SC-19697 [1,0,0,0,0,0|1,0,0]=2 96 B7R1.3 O=C1CNCCN1 SC-05365 [1,0,0,0,0,0|2,0,0]=3 97 B7R1.3 O=C1CNCCO1 SC-84883 [1,0,0,0,0,0|2,0,0]=3 98 B7R1.3 O=C1COCCN1 SC-24222 [1,0,0,0,0,0|2,0,0]=3 99 B7R1.3 O=C1CSCCN1 SC-28581 [1,0,0,0,0,0|2,0,0]=3 100 B7R1.3 OC1CC=CCC1 SC-87372 [1,0,0,0,0,0|1,0,1]=3 101 B7R1.3 OC1CCCCO1 SC-84303 [1,0,0,0,0,0|1,0,2]=4 102 B7R1.3 OC1CCCNC1 SC-06262 [1,0,0,0,0,0|2,0,0]=3 103 B7R1.3 OC1CCCNC1 SC-47771 [1,0,0,0,0,0|2,0,0]=3 104 B7R1.3 OC1CCCOC1 SC-19794 [1,0,0,0,0,0|2,0,0]=3 105 B7R1.3 OC1CCCOC1 SC-35801 [1,0,0,0,0,0|2,0,0]=3 106 B7R1.3 OC1CCNCC1 SC-05165 [1,0,0,0,0,0|1,0,2]=4 107 B7R1.3 OC1CCOCC1 SC-02372 [1,0,0,0,0,0|1,0,2]=4 108 B7R1.3 OC1CCSCC1 SC-35917 [1,0,0,0,0,0|1,0,2]=4 109 B7R1.3 ON1CCCCC1 SC-13334 [1,0,0,0,0,0|1,0,1]=3 110 B7R1.3 O[C@@H]1CCCNC1 SC-12564 [1,0,0,0,0,0|2,0,0]=3 111 B7R1.3 O[C@H]1CCCNC1 SC-19802 [1,0,0,0,0,0|2,0,0]=3 112 B7R1.3 SC1CCOCC1 SC-47759 [1,0,0,0,0,0|1,1,1]=4 113 B7R1.3 [C@H]1(C)CNCCN1 SC-16783 [1,0,0,0,0,0|2,0,0]=3 114 B9R1.2 CCC1CC(=O)CCN1 SC-35111 [0,1,0,0,0,0|1,0,0]=2 115 B9R1.2 CCN1CCCC(N)C1 SC-83319 [0,1,0,0,0,0|2,0,1]=4 116 B9R1.2 CCN1CCN[C@H](C)C1 SC-94381 [0,1,0,0,0,0|3,0,0]=4 117 B9R1.2 CCN1CCN[C@H](C)C1 SC-95248 [0,1,0,0,0,0|3,0,0]=4 118 B9R1.2 CN1CCOC(CN)C1 SC-71487 [0,1,0,0,0,0|3,0,0]=4 119 B9R1.2 O=C1CCCC(CO)N1 SC-21439 [0,1,0,0,0,0|1,0,0]=2 120 B9R1.3 CC1C(=O)CCCC1=O SC-24698 [0,1,0,0,0,0|1,0,1]=3 121 B9R1.34 CC1CC(=O)CC(=O)C1 SC-26551 [0,1,0,0,0,0|0,0,1]=2 122 B9R1.34 CC1CC(=O)CC(C)N1 SC-49668 [0,1,0,0,0,0|1,0,0]=2 123 B9R1.34 CC1CC(=O)CC(C)O1 SC-43659 [0,1,0,0,0,0|1,0,0]=2 124 B9R1.34 CC1CC(=O)OC(=O)C1 SC-68133 [0,1,0,0,0,0|1,0,1]=3 125 B9R1.34 C[C@@H]1CC(=O)C[C@@H](C)N1 SC-88301 [0,1,0,0,0,0|1,0,0]=2 126 B9R1.34 C[C@H]1CC(=O)C[C@@H](C)N1 SC-88300 [0,1,0,0,0,0|1,0,0]=2 127 B9R1.66 CC1(C)CC(=O)CCO1 SC-22069 [0,1,0,0,0,0|1,0,0]=2 128 B9R1.66 CC1(C)CC(N)CCO1 SC-A4709 [0,1,0,0,0,0|2,0,1]=4 129 B9R1.66 CC1(C)CCCC(=O)C1 SC-67598 [0,1,0,0,0,0|0,0,0]=1 130 B9R1.69 CC1CC(=O)CCN1C SC-21165 [0,1,0,0,0,0|1,0,0]=2 131 B9R1.69 CC1CN(C)CCC1=O SC-21048 [0,1,0,0,0,0|2,0,1]=4 132 B9R1.69 CN1CCC(=O)CC1=O SC-A3321 [0,1,0,0,0,0|2,0,1]=4 133 B9R1.69 NC1CCC(=O)NC1=O SC-52533 [0,1,0,0,0,0|2,0,1]=4 134 B9R1.69 NC1CCC(=O)NC1=O SC-72018 [0,1,0,0,0,0|2,0,1]=4 135 B9R1.69 NC1CCC(=O)NC1=O SC-85613 [0,1,0,0,0,0|2,0,1]=4 136 B9R1.69 N[C@@H]1CCC(=O)NC1=O SC-A2238 [0,1,0,0,0,0|2,0,1]=4 137 B9R1.69 N[C@H]1CCC(=O)NC1=O SC-A2241 [0,1,0,0,0,0|2,0,1]=4 138 B9R1.69 O=C1CCC(Br)C(=O)N1 SC-A3664 [0,1,0,0,0,0|2,0,1]=4 139 B7R0.2 C=CC(=O)NC(C)C SC-47047 [0,0,1,0,0,0|1,0,2]=4 140 B7R0.2 CC(C)C[C@@H](N)CO SC-15764 [0,0,1,0,0,0|2,0,1]=4 141 B7R0.2 CC(C)C[C@H](N)CO SC-08985 [0,0,1,0,0,0|2,0,1]=4 142 B7R0.2 CC(C)NC(=O)CBr SC-02491 [0,0,1,0,0,0|2,0,0]=3 143 B7R0.2 CCC(C)CC(=O)O SC-19132 [0,0,1,0,0,0|1,0,0]=2 144 B7R0.2 CCC(N)CC(=O)O SC-59260 [0,0,1,0,0,0|2,0,0]=3 145 B7R0.2 CCC(O)CC(C)=O SC-92943 [0,0,1,0,0,0|1,0,0]=2 146 B7R0.2 COC(=O)CC(C)Br SC-67097 [0,0,1,0,0,0|2,0,0]=3 147 B7R0.2 COC(=O)C[C@@H](C)N SC-88822 [0,0,1,0,0,0|2,0,0]=3 148 B7R0.2 COC(=O)C[C@@H](C)N SC-A1096 [0,0,1,0,0,0|2,0,0]=3 149 B7R0.2 NCC(O)CC(=O)O SC-50844 [0,0,1,0,0,0|3,0,0]=4 150 B7R0.2 N[C@H](CO)CC(=O)O SC-72100 [0,0,1,0,0,0|3,0,0]=4 151 B7R0.4 C#CCCCC(=O)O SC-73017 [0,0,1,0,0,0|1,0,2]=4 152 B7R0.4 CC(C)CCON=O SC-22768 [0,0,1,0,0,0|2,0,0]=3 153 B7R0.4 CCCC#CC(=O)O SC-96568 [0,0,1,0,0,0|1,0,2]=4 154 B7R0.4 CCCNCC(=O)O SC-97541 [0,0,1,0,0,0|2,0,0]=3 155 B7R0.4 CCCSCC(=O)O SC-45283 [0,0,1,0,0,0|2,0,0]=3 156 B7R0.4 CCC\C=C\C(C)=O SC-49007 [0,0,1,0,0,0|0,0,2]=3 157 B7R0.4 CNCCCC(=O)O SC-49793 [0,0,1,0,0,0|2,0,0]=3 158 B7R0.4 CNCCCC(=O)O SC-A2900 [0,0,1,0,0,0|2,0,0]=3 159 B7R0.4 CNCCCN(C)C SC-95620 [0,0,1,0,0,0|3,0,0]=4 160 B7R0.4 COCCCC(=O)O SC-51378 [0,0,1,0,0,0|2,0,0]=3 161 B7R0.4 COCCNC(N)=O SC-62189 [0,0,1,0,0,0|3,0,0]=4 162 B7R0.4 C\C=C\CCC(=O)O SC-21245 [0,0,1,0,0,0|1,0,2]=4 163 B7R0.4 NC(=O)CCCCBr SC-98143 [0,0,1,0,0,0|2,0,0]=3 164 B7R0.4 NCCCCC(=O)O SC-10120 [0,0,1,0,0,0|2,0,0]=3 165 B7R0.4 NCCCCC(=O)O SC-92391 [0,0,1,0,0,0|2,0,0]=3 166 B7R0.4 NCCCCC(N)=O SC-94858 [0,0,1,0,0,0|2,0,0]=3 167 B7R0.4 NCCCCC(N)=O SC-A4262 [0,0,1,0,0,0|2,0,0]=3 168 B7R0.4 NCCNCC(=O)O SC-21750 [0,0,1,0,0,0|3,0,0]=4 169 B7R0.4 O=C(Cl)CCCCBr SC-13447 [0,0,1,0,0,0|2,0,0]=3 170 B7R0.4 O=C(Cl)CCCCCl SC-16009 [0,0,1,0,0,0|2,0,0]=3 171 B7R0.4 O=C(O)CCCCBr SC-02338 [0,0,1,0,0,0|2,0,0]=3 172 B7R0.4 O=C([O-])COCCO SC-A2671 [0,0,1,0,0,0|3,0,0]=4 173 B7R0.7 CC#CC(=O)OCC SC-54369 [0,0,1,0,0,0|1,0,2]=4 174 B7R0.7 CC(CCO)CCO SC-15062 [0,0,1,0,0,0|1,0,2]=4 175 B7R0.7 CCC[C@H](N)CCO SC-A3499 [0,0,1,0,0,0|1,0,2]=4 176 B7R0.7 CCOC(=O)CC#N SC-22643 [0,0,1,0,0,0|2,0,1]=4 177 B7R0.7 CCOC(=O)CC=O SC-14726 [0,0,1,0,0,0|2,0,1]=4 178 B7R0.7 CCOC(=O)CCI SC-02730 [0,0,1,0,0,0|2,0,0]=3 179 B7R0.7 CCOC(=O)CCN SC-83852 [0,0,1,0,0,0|2,0,0]=3 180 B7R0.7 CCOC(=O)CCO SC-43709 [0,0,1,0,0,0|2,0,0]=3 181 B7R0.7 CCOC(=O)CCS SC-44443 [0,0,1,0,0,0|2,0,0]=3 182 B7R0.7 CCOC(=O)CNN SC-06315 [0,0,1,0,0,0|3,0,0]=4 183 B7R0.7 CCOC(=O)OCC SC-25934 [0,0,1,0,0,0|2,0,0]=3 184 B7R0.7 CCOC(=O)OCCl SC-35252 [0,0,1,0,0,0|3,0,0]=4 185 B7R0.7 COCC(=O)COC SC-43684 [0,0,1,0,0,0|2,0,0]=3 186 B7R0.7 O=C(CCCl)CCCl SC-03815 [0,0,1,0,0,0|2,0,0]=3 187 B7R0.7 [C-]#[N+]CC(=O)OCC SC-03259 [0,0,1,0,0,0|2,0,1]=4 188 B9R2.25 O=C1OC(=O)C2CC12 SC-26129 [0,0,0,1,0,0|2,0,1]=4 189 B9R2.39 BrC1CC2CCC1C2 SC-A3245 [0,0,0,1,0,0|1,0,1]=3 190 B9R2.39 CN1CC2CC1CN2 SC-A2612 [0,0,0,1,0,0|3,0,0]=4 191 B9R2.39 O=C1CC2CCC1C2 SC-50094 [0,0,0,1,0,0|0,0,0]=1 192 B9R2.39 O=C1NC2C=CC1C2 SC-17066 [0,0,0,1,0,0|1,0,2]=4 193 B9R2.39 [C@@H]12C=C[C@@H](C1)C(=O)N2 SC-14133 [0,0,0,1,0,0|1,0,2]=4 194 B9R2.39 [C@H]12CC[C@H](C1)C(=O)N2 SC-52249 [0,0,0,1,0,0|1,0,0]=2 195 B9R2.39 [C@H]12CNC(CN1C)C2 SC-94272 [0,0,0,1,0,0|3,0,0]=4 196 B9R2.109 O=C1CCCC2OC12 SC-A3025 [0,0,0,1,0,0|1,0,0]=2 197 B7R1.2 CC1=CC(=O)CC1 SC-18727 [0,0,0,0,1,0|0,0,2]=3 198 B7R1.2 CC1=CC(=O)OC1 SC-25541 [0,0,0,0,1,0|1,0,2]=4 199 B7R1.2 CC1CCC(=O)C1 SC-93748 [0,0,0,0,1,0|0,0,0]=1 200 B7R1.2 CC1CNC(=O)C1 SC-50248 [0,0,0,0,1,0|1,0,0]=2 201 B7R1.2 CC1COC(=O)C1 SC-60836 [0,0,0,0,1,0|1,0,0]=2 202 B7R1.2 CC1COC(=O)O1 SC-65189 [0,0,0,0,1,0|2,0,0]=3 203 B7R1.2 CN1CCC(N)C1 SC-48840 [0,0,0,0,1,0|2,0,1]=4 204 B7R1.2 CN1CC[C@@H](O)C1 SC-49684 [0,0,0,0,1,0|1,0,2]=4 205 B7R1.2 CN1CC[C@H](O)C1 SC-23905 [0,0,0,0,1,0|1,0,2]=4 206 B7R1.2 C[C@H]1COC(=O)N1 SC-51056 [0,0,0,0,1,0|2,0,0]=3 207 B7R1.2 C[C@H]1COC(=O)O1 SC-04943 [0,0,0,0,1,0|2,0,0]=3 208 B7R1.2 NC1CCC(O)C1 SC-47773 [0,0,0,0,1,0|1,0,2]=4 209 B7R1.2 NC1CCC(O)C1 SC-47979 [0,0,0,0,1,0|1,0,2]=4 210 B7R1.2 NC1CCC(O)C1 SC-49660 [0,0,0,0,1,0|1,0,2]=4 211 B7R1.2 NC1CCC(O)C1 SC-51126 [0,0,0,0,1,0|1,0,2]=4 212 B7R1.2 NC1CCC(O)C1 SC-92977 [0,0,0,0,1,0|1,0,2]=4 213 B7R1.2 NC1CNC(=O)C1 SC-66063 [0,0,0,0,1,0|2,0,0]=3 214 B7R1.2 NC1COC(=O)C1 SC-34183 [0,0,0,0,1,0|2,0,0]=3 215 B7R1.2 N[C@@H]1CC[C@H](O)C1 SC-83316 [0,0,0,0,1,0|1,0,2]=4 216 B7R1.2 N[C@@H]1CNC(=O)C1 SC-A4379 [0,0,0,0,1,0|2,0,0]=3 217 B7R1.2 N[C@@H]1COC(=O)C1 SC-71558 [0,0,0,0,1,0|2,0,0]=3 218 B7R1.2 N[C@H]1CC[C@@H](O)C1 SC-42369 [0,0,0,0,1,0|1,0,2]=4 219 B7R1.2 N[C@H]1CC[C@@H](O)C1 SC-47775 [0,0,0,0,1,0|1,0,2]=4 220 B7R1.2 N[C@H]1CC[C@H](O)C1 SC-47774 [0,0,0,0,1,0|1,0,2]=4 221 B7R1.2 N[C@H]1CC[C@H](O)C1 SC-93243 [0,0,0,0,1,0|1,0,2]=4 222 B7R1.2 O=C1CC(O)CN1 SC-29049 [0,0,0,0,1,0|2,0,0]=3 223 B7R1.2 O=C1CCC(=O)C1 SC-15331 [0,0,0,0,1,0|1,0,1]=3 224 B7R1.2 O=C1CCC(=O)N1 SC-26697 [0,0,0,0,1,0|2,0,1]=4 225 B7R1.2 O=C1CNC(=O)C1 SC-88883 [0,0,0,0,1,0|2,0,1]=4 226 B7R1.2 O=C1COC(=O)C1 SC-86968 [0,0,0,0,1,0|2,0,1]=4 227 B7R1.2 O=C1C[C@@H](O)CN1 SC-02616 [0,0,0,0,1,0|2,0,0]=3 228 B7R1.2 O=C1C[C@H](O)CN1 SC-13587 [0,0,0,0,1,0|2,0,0]=3 229 B7R1.2 O=C1C[C@H](O)CO1 SC-06559 [0,0,0,0,1,0|2,0,0]=3 230 B7R1.4 C=C1CCOC1=O SC-19579 [0,0,0,0,1,0|1,0,2]=4 231 B7R1.4 CC1=CCCC1=O SC-15856 [0,0,0,0,1,0|0,0,2]=3 232 B7R1.4 CC1CCCC1=O SC-89605 [0,0,0,0,1,0|0,0,0]=1 233 B7R1.4 CC1CCNC1=O SC-21672 [0,0,0,0,1,0|1,0,0]=2 234 B7R1.4 CC1CCOC1=O SC-20996 [0,0,0,0,1,0|1,0,0]=2 235 B7R1.4 CN1CCNC1=O SC-89793 [0,0,0,0,1,0|2,0,0]=3 236 B7R1.4 NC1CCCC1O SC-21764 [0,0,0,0,1,0|1,0,2]=4 237 B7R1.4 NC1CCNC1=O SC-13910 [0,0,0,0,1,0|2,0,0]=3 238 B7R1.4 NC1CCNC1=O SC-53072 [0,0,0,0,1,0|2,0,0]=3 239 B7R1.4 N[C@@H]1CCNC1=O SC-65959 [0,0,0,0,1,0|2,0,0]=3 240 B7R1.4 N[C@@H]1CCNC1=O SC-A2225 [0,0,0,0,1,0|2,0,0]=3 241 B7R1.4 N[C@@H]1CCOC1=O SC-28003 [0,0,0,0,1,0|2,0,0]=3 242 B7R1.4 N[C@H]1CCC[C@@H]1O SC-27686 [0,0,0,0,1,0|1,0,2]=4 243 B7R1.4 N[C@H]1CCC[C@H]1N SC-83490 [0,0,0,0,1,0|2,0,1]=4 244 B7R1.4 N[C@H]1CCNC1=O SC-96457 [0,0,0,0,1,0|2,0,0]=3 245 B7R1.4 N[C@H]1CCOC1=O SC-01385 [0,0,0,0,1,0|2,0,0]=3 246 B7R1.4 N[C@H]1CCOC1=O SC-28113 [0,0,0,0,1,0|2,0,0]=3 247 B7R1.4 O=C1CCCC1Cl SC-21538 [0,0,0,0,1,0|1,0,0]=2 248 B7R1.4 O=C1NCCC1O SC-26159 [0,0,0,0,1,0|2,0,0]=3 249 B7R1.4 O=C1NCC[C@H]1O SC-87526 [0,0,0,0,1,0|2,0,0]=3 250 B7R1.4 O=C1OCCC1Br SC-15437 [0,0,0,0,1,0|2,0,0]=3 251 B7R1.4 O[C@@H]1CCC[C@H]1O SC-A2623 [0,0,0,0,1,0|1,0,2]=4 252 B7R1.4 [C@@H]1(N)CCC[C@H]1O SC-16146 [0,0,0,0,1,0|1,0,2]=4 253 B7R1.4 [C@H]1(N)CCC[C@H]1O SC-25435 [0,0,0,0,1,0|1,0,2]=4 254 B9R1.48 O=C1CCCCC(=O)C1 SC-14500 [0,0,0,0,0,1|1,0,1]=3 255 B9R1.48 O=C1CCCCC(=O)O1 SC-92931 [0,0,0,0,0,1|2,0,1]=4 256 B9R1.49 CN1CCCC(=O)CC1 SC-01972 [0,0,0,0,0,1|1,0,0]=2 257 B6R0.1 CCOC(=O)CBr SC-17870 [1,0,1,0,0,0|2,0,0]=4 258 B6R0.1 CCOC(=O)CCl SC-79310 [1,0,1,0,0,0|2,0,0]=4 259 B6R0.1 CCOC(=O)CN SC-09569 [1,0,1,0,0,0|2,0,0]=4 260 B6R0.1 CCOC(=O)CN SC-48652 [1,0,1,0,0,0|2,0,0]=4 261 B6R0.1 CCOC(=O)CO SC-50412 [1,0,1,0,0,0|2,0,0]=4 262 B6R0.1 CCOC(=O)CS SC-18381 [1,0,1,0,0,0|2,0,0]=4 263 B6R0.1 CC[C@@H](N)COC SC-65714 [1,0,1,0,0,0|2,0,0]=4 264 B6R0.1 CC[C@H](N)COC SC-89974 [1,0,1,0,0,0|2,0,0]=4 265 B6R0.1 CNCC(=O)OC SC-10432 [1,0,1,0,0,0|2,0,0]=4 266 B6R0.1 COC(=O)CCBr SC-18677 [1,0,1,0,0,0|2,0,0]=4 267 B6R0.1 COC(=O)CCN SC-21486 [1,0,1,0,0,0|2,0,0]=4 268 B6R0.1 COC(=O)CCO SC-21690 [1,0,1,0,0,0|2,0,0]=4 269 B6R0.1 COC(=O)CSC SC-20536 [1,0,1,0,0,0|2,0,0]=4 270 B6R0.1 COCC(=O)OC SC-62202 [1,0,1,0,0,0|2,0,0]=4 271 B6R0.2 CC(=O)CC(C)=O SC-77723 [1,0,1,0,0,0|1,0,1]=4 272 B6R0.2 CC(=O)NC(C)C SC-A3057 [1,0,1,0,0,0|1,0,0]=3 273 B6R0.2 CC(=O)OC(C)C SC-25616 [1,0,1,0,0,0|1,0,0]=3 274 B6R0.2 CN(C)CC(N)=O SC-89197 [1,0,1,0,0,0|2,0,0]=4 275 B6R0.2 C[C@@H](N)CC(=O)O SC-10059 [1,0,1,0,0,0|2,0,0]=4 276 B6R0.2 C[C@@H](N)CC(=O)O SC-44142 [1,0,1,0,0,0|2,0,0]=4 277 B6R0.2 C[C@H](N)CC(=O)O SC-21979 [1,0,1,0,0,0|2,0,0]=4 278 B6R0.2 C[C@H](O)CC(=O)O SC-B3327 [1,0,1,0,0,0|2,0,0]=4 279 B6R0.2 C[S+](C)CC(=O)[O-] SC-72907 [1,0,1,0,0,0|2,0,0]=4 280 B6R0.4 C=C(C)CNCC SC-47240 [1,0,1,0,0,0|2,0,0]=4 281 B6R0.4 CC(=O)CCCBr SC-91341 [1,0,1,0,0,0|1,0,0]=3 282 B6R0.4 CC(=O)NCCN SC-19651 [1,0,1,0,0,0|2,0,0]=4 283 B6R0.4 CC(C)NCCCl SC-96276 [1,0,1,0,0,0|2,0,0]=4 284 B6R0.4 CC(C)OCCBr SC-50384 [1,0,1,0,0,0|2,0,0]=4 285 B6R0.4 CCCCC(=O)Cl SC-46867 [1,0,1,0,0,0|1,0,0]=3 286 B6R0.4 CN(C)CCC=O SC-12823 [1,0,1,0,0,0|1,0,0]=3 287 B6R0.4 CN(C)CCCBr SC-12824 [1,0,1,0,0,0|2,0,0]=4 288 B6R0.4 CN(C)CCCBr SC-48972 [1,0,1,0,0,0|2,0,0]=4 289 B6R0.4 CN(C)CCCCl SC-18516 [1,0,1,0,0,0|2,0,0]=4 290 B6R0.4 CN(C)CCCCl SC-53120 [1,0,1,0,0,0|2,0,0]=4 291 B6R0.4 CNCCC(=O)O SC-27492 [1,0,1,0,0,0|2,0,0]=4 292 B6R0.4 CNCCC(=O)O SC-52914 [1,0,1,0,0,0|2,0,0]=4 293 B6R0.4 COCCC(=O)O SC-50255 [1,0,1,0,0,0|2,0,0]=4 294 B6R0.4 CSCCC(=O)O SC-96567 [1,0,1,0,0,0|2,0,0]=4 295 B6R0.4 NCCCC(=O)O SC-10045 [1,0,1,0,0,0|2,0,0]=4 296 B6R0.4 O=C(Cl)CCCBr SC-70369 [1,0,1,0,0,0|2,0,0]=4 297 B6R0.4 O=C(O)CCCCl SC-89723 [1,0,1,0,0,0|2,0,0]=4 298 B6R0.6 C=CCCCCBr SC-27023 [1,0,1,0,0,0|1,0,1]=4 299 B6R0.6 CCCCCNC SC-25672 [1,0,1,0,0,0|1,0,0]=3 300 B6R0.6 CCCCON=O SC-70750 [1,0,1,0,0,0|2,0,0]=4 301 B6R0.6 CCC\C=C\C=O SC-25240 [1,0,1,0,0,0|0,0,2]=4 302 B6R0.6 CNCCCCO SC-13108 [1,0,1,0,0,0|2,0,0]=4 303 B6R0.6 CNCCCNC SC-47576 [1,0,1,0,0,0|2,0,0]=4 304 B6R0.6 CNCCCOC SC-51293 [1,0,1,0,0,0|2,0,0]=4 305 B6R0.6 COCCCCCl SC-01876 [1,0,1,0,0,0|2,0,0]=4 306 B6R0.6 COCCCOC SC-47077 [1,0,1,0,0,0|2,0,0]=4 307 B6R0.6 C\C=C\CCCO SC-48265 [1,0,1,0,0,0|1,0,1]=4 308 B6R0.6 O=CCCCCCl SC-A3300 [1,0,1,0,0,0|1,0,0]=3 309 B6R1.1 C1=CCNCC1 SC-83515 [2,0,0,0,0,0|1,0,1]=4 310 B6R1.1 C1=COCCC1 SC-00342 [2,0,0,0,0,0|1,0,1]=4 311 B6R1.1 C1CCNCC1 SC-05687 [2,0,0,0,0,0|1,0,0]=3 312 B6R1.1 C1CCNNC1 SC-84334 [2,0,0,0,0,0|2,0,0]=4 313 B6R1.1 C1CCONC1 SC-82296 [2,0,0,0,0,0|2,0,0]=4 314 B6R1.1 C1CC[NH2+]CC1 SC-48018 [2,0,0,0,0,0|1,0,0]=3 315 B6R1.1 C1CNCCN1 SC-94121 [2,0,0,0,0,0|2,0,0]=4 316 B6R1.1 C1CNCNC1 SC-72269 [2,0,0,0,0,0|2,0,0]=4 317 B6R1.1 C1COCCN1 SC-19184 [2,0,0,0,0,0|2,0,0]=4 318 B6R1.1 C1CSCSC1 SC-46192 [2,0,0,0,0,0|2,0,0]=4 319 B8R0.2 CCC(C)C(N)C(=O)O SC-09610 [0,1,1,0,0,0|1,0,0]=3 320 B8R0.2 CCC(C)C(N)C(N)=O SC-24873 [0,1,1,0,0,0|1,0,0]=3 321 B8R0.2 COC(=O)C(Br)C(C)C SC-16269 [0,1,1,0,0,0|1,0,0]=3 322 B8R0.2 COC(=O)C(N)C(C)O SC-09896 [0,1,1,0,0,0|2,0,0]=4 323 B8R0.2 COC(=O)[C@@H](N)[C@@H](C)O SC-67026 [0,1,1,0,0,0|2,0,0]=4 324 B8R0.2 COC(=O)[C@H](N)[C@@H](C)O SC-83393 [0,1,1,0,0,0|2,0,0]=4 325 B8R0.2 [C@@H](N)(C(=O)O)[C@@H](C)OC SC-22105 [0,1,1,0,0,0|2,0,0]=4 326 B8R0.5 CC(C)OC(=O)OCCl SC-47001 [0,1,1,0,0,0|2,0,0]=4 327 B8R0.5 CCCC(=O)CC(C)C SC-99431 [0,1,1,0,0,0|0,0,0]=2 328 B8R0.5 CCOC(=O)CC(C)N SC-35852 [0,1,1,0,0,0|1,0,0]=3 329 B8R0.5 CCOC(=O)CC(C)O SC-08980 [0,1,1,0,0,0|1,0,0]=3 330 B8R0.5 CCOC(=O)CC(C)O SC-93699 [0,1,1,0,0,0|1,0,0]=3 331 B8R0.5 CCOC(=O)C[C@@H](C)O SC-08901 [0,1,1,0,0,0|1,0,0]=3 332 B8R0.5 CCOC(=O)C[C@H](C)N SC-A3124 [0,1,1,0,0,0|1,0,0]=3 333 B8R0.16 COC(CC(C)=O)OC SC-15190 [0,1,1,0,0,0|1,0,0]=3 334 B8R0.19 CCC(=O)CC(=O)OC SC-13642 [0,1,1,0,0,0|1,0,1]=4 335 B8R0.19 COC(=O)C[C@@H](O)CCl SC-08919 [0,1,1,0,0,0|2,0,0]=4 336 B8R0.23 C=C(CC(C)C)C(C)=O SC-A2921 [0,1,1,0,0,0|1,0,1]=4 337 B8R0.23 CC(=O)C(C)CC(=O)O SC-21504 [0,1,1,0,0,0|1,0,1]=4 338 B8R0.23 CC(=O)CC(O)[C@H](C)N SC-76554 [0,1,1,0,0,0|1,0,0]=3 339 B8R0.23 CC(C)OC(=O)C(C)N SC-24251 [0,1,1,0,0,0|1,0,0]=3 340 B8R0.23 CC(C)OC(=O)[C@H](C)N SC-70925 [0,1,1,0,0,0|1,0,0]=3 341 B8R0.24 CC(C)(C)NC(=O)CCl SC-71141 [0,1,1,0,0,0|2,0,0]=4 342 B8R0.24 CC(C)(C)OC(=O)CBr SC-23257 [0,1,1,0,0,0|2,0,0]=4 343 B8R0.24 CC(C)(C)OC(=O)CN SC-09572 [0,1,1,0,0,0|2,0,0]=4 344 B8R0.24 CC(C)(C)OC(=O)CN SC-12172 [0,1,1,0,0,0|2,0,0]=4 345 B8R0.24 CC(C)(C)OC(=O)CO SC-26023 [0,1,1,0,0,0|2,0,0]=4 346 B8R0.24 CC(C)(C)OC(=O)C[Zn+] SC-85194 [0,1,1,0,0,0|2,0,0]=4 347 B8R0.24 CCC(C)CS(N)(=O)=O SC-91047 [0,1,1,0,0,0|2,0,0]=4 348 B8R0.6 C#CCCCC(=O)OC SC-82496 [0,1,1,0,0,0|0,0,2]=4 349 B8R0.6 CCCSCC(=O)OC SC-44744 [0,1,1,0,0,0|1,0,0]=3 350 B8R0.6 COC(=O)CCCCBr SC-66180 [0,1,1,0,0,0|1,0,0]=3 351 B8R0.7 C#CCCCCC(=O)O SC-20440 [0,1,1,0,0,0|1,0,1]=4 352 B8R0.7 CC(C)OCCCCO SC-82574 [0,1,1,0,0,0|0,0,2]=4 353 B8R0.7 CCCCCCC(C)O SC-47133 [0,1,1,0,0,0|0,0,2]=4 354 B8R0.7 CCCCOCC(=O)O SC-22619 [0,1,1,0,0,0|1,0,0]=3 355 B8R0.7 CCCCSCC(=N)N SC-38959 [0,1,1,0,0,0|2,0,0]=4 356 B8R0.7 COCCOCC(=O)O SC-89730 [0,1,1,0,0,0|2,0,0]=4 357 B8R0.7 NCCCCCC(=O)O SC-10067 [0,1,1,0,0,0|1,0,0]=3 358 B8R0.7 O=C(O)CCCCCBr SC-04420 [0,1,1,0,0,0|1,0,0]=3 359 B8R0.7 O=C(O)CCCCCO SC-17400 [0,1,1,0,0,0|1,0,0]=3 360 B8R0.7 O=C(O)CCOCCBr SC-A2260 [0,1,1,0,0,0|2,0,0]=4 361 B8R0.7 O=C([O-])CCCCCO SC-82416 [0,1,1,0,0,0|1,0,0]=3 362 B8R0.8 CCCCC(=O)C(=O)[O-] SC-94857 [0,1,1,0,0,0|1,0,1]=4 363 B8R0.8 CCCCC(N)C(=O)O SC-10365 [0,1,1,0,0,0|1,0,0]=3 364 B8R0.8 CCCC[C@@H](N)C(=O)O SC-10363 [0,1,1,0,0,0|1,0,0]=3 365 B8R0.8 CSCCC(N)C(N)=O SC-15811 [0,1,1,0,0,0|2,0,0]=4 366 B8R0.8 CSCC[C@@H](N)C(=O)O SC-09743 [0,1,1,0,0,0|2,0,0]=4 367 B8R0.8 C[Se]CC[C@H](N)C(=O)O SC-19961 [0,1,1,0,0,0|2,0,0]=4 368 B8R0.8 NCCCC(N)C(=O)O SC-10385 [0,1,1,0,0,0|2,0,0]=4 369 B8R0.8 NCCCC(N)C(=O)O SC-48991 [0,1,1,0,0,0|2,0,0]=4 370 B8R0.8 NCCC[C@H](N)C(=O)O SC-18299 [0,1,1,0,0,0|2,0,0]=4 371 B8R0.9 CCC(=O)CCC(=O)O SC-58454 [0,1,1,0,0,0|1,0,1]=4 372 B8R0.9 COC(=O)CCC(C)=O SC-74448 [0,1,1,0,0,0|1,0,1]=4 373 B8R0.21 CCCCCS(=O)(=O)O SC-90285 [0,1,1,0,0,0|2,0,0]=4 374 B8R0.21 CCCCCS(=O)(=O)[O-] SC-15136 [0,1,1,0,0,0|2,0,0]=4 375 B8R0.28 CC(C)C\C=C\C(=O)O SC-96534 [0,1,1,0,0,0|0,0,2]=4 376 B8R0.1 CCC#CC(=O)OCC SC-70982 [0,1,1,0,0,0|1,0,1]=4 377 B8R0.1 CCOC(=O)CCCN SC-87395 [0,1,1,0,0,0|1,0,0]=3 378 B8R0.1 CCOC(=O)CCCO SC-99324 [0,1,1,0,0,0|1,0,0]=3 379 B8R0.3 CCOC(=O)C(=O)CC SC-46250 [0,1,1,0,0,0|1,0,1]=4 380 B8R0.3 CCOC(=O)C(N)CN SC-40715 [0,1,1,0,0,0|2,0,0]=4 381 B8R0.3 CCOC(=O)C(O)CC SC-84233 [0,1,1,0,0,0|1,0,0]=3 382 B8R0.3 CCOC(=O)[C@H](N)CO SC-09860 [0,1,1,0,0,0|2,0,0]=4 383 B8R0.3 O=CCC(O)C(O)CO SC-13541 [0,1,1,0,0,0|2,0,0]=4 384 B8R0.3 O=CC[C@H](O)[C@H](O)CO SC-09180 [0,1,1,0,0,0|2,0,0]=4 385 B8R0.3 [C@H](N)(CO)C(=O)OCC SC-09861 [0,1,1,0,0,0|2,0,0]=4 386 B8R1.2 BrCC1CCCCC1 SC-02918 [1,1,0,0,0,0|0,0,1]=3 387 B8R1.2 BrCC1CCCCO1 SC-20895 [1,1,0,0,0,0|1,0,1]=4 388 B8R1.2 BrCC1CCCOC1 SC-44714 [1,1,0,0,0,0|1,0,0]=3 389 B8R1.2 BrCC1CCOCC1 SC-00660 [1,1,0,0,0,0|1,0,1]=4 390 B8R1.2 CCC1CNCCN1 SC-35798 [1,1,0,0,0,0|2,0,0]=4 391 B8R1.2 CCC1CNCCO1 SC-61843 [1,1,0,0,0,0|2,0,0]=4 392 B8R1.2 CNC1CCCNC1 SC-00689 [1,1,0,0,0,0|1,0,0]=3 393 B8R1.2 CNC1CCCNC1 SC-52816 [1,1,0,0,0,0|1,0,0]=3 394 B8R1.2 CNC1CCCOC1 SC-35264 [1,1,0,0,0,0|1,0,0]=3 395 B8R1.2 CNC1CCNCC1 SC-04666 [1,1,0,0,0,0|1,0,1]=4 396 B8R1.2 COC1=CCCCC1 SC-28269 [1,1,0,0,0,0|0,0,2]=4 397 B8R1.2 COC1CCCNC1 SC-15522 [1,1,0,0,0,0|1,0,0]=3 398 B8R1.2 COC1CCCNC1 SC-45634 [1,1,0,0,0,0|1,0,0]=3 399 B8R1.2 COC1CCNCC1 SC-04308 [1,1,0,0,0,0|1,0,1]=4 400 B8R1.2 ICC1CCOCC1 SC-28261 [1,1,0,0,0,0|1,0,1]=4 401 B8R1.2 N#CC1CCCCC1 SC-73272 [1,1,0,0,0,0|0,0,2]=4 402 B8R1.2 NCC1CCCCC1 SC-26900 [1,1,0,0,0,0|0,0,1]=3 403 B8R1.2 NCC1CCCCN1 SC-46326 [1,1,0,0,0,0|1,0,1]=4 404 B8R1.2 NCC1CCCCO1 SC-27902 [1,1,0,0,0,0|1,0,1]=4 405 B8R1.2 NCC1CCCOC1 SC-35931 [1,1,0,0,0,0|1,0,0]=3 406 B8R1.2 NCC1CCCOC1 SC-85451 [1,1,0,0,0,0|1,0,0]=3 407 B8R1.2 NCC1CCNCC1 SC-06464 [1,1,0,0,0,0|1,0,1]=4 408 B8R1.2 NCC1CCOCC1 SC-00740 [1,1,0,0,0,0|1,0,1]=4 409 B8R1.2 NCC1CNCCO1 SC-90824 [1,1,0,0,0,0|2,0,0]=4 410 B8R1.2 NC[C@@H]1COCCO1 SC-A3387 [1,1,0,0,0,0|2,0,0]=4 411 B8R1.2 NNC1CCCCC1 SC-12375 [1,1,0,0,0,0|1,0,1]=4 412 B8R1.2 NNC1CCCCC1 SC-58187 [1,1,0,0,0,0|1,0,1]=4 413 B8R1.2 O=CC1=COCCC1 SC-46524 [1,1,0,0,0,0|1,0,1]=4 414 B8R1.2 O=CC1CCCCC1 SC-02305 [1,1,0,0,0,0|0,0,1]=3 415 B8R1.2 O=CC1CCCCN1 SC-29120 [1,1,0,0,0,0|1,0,1]=4 416 B8R1.2 O=CC1CCCOC1 SC-45114 [1,1,0,0,0,0|1,0,1]=4 417 B8R1.2 O=CC1CCNCC1 SC-21173 [1,1,0,0,0,0|1,0,1]=4 418 B8R1.2 O=CC1CCNCC1 SC-A3016 [1,1,0,0,0,0|1,0,1]=4 419 B8R1.2 O=CC1CCOCC1 SC-04900 [1,1,0,0,0,0|1,0,1]=4 420 B8R1.2 O=CC1CCSCC1 SC-96130 [1,1,0,0,0,0|1,0,1]=4 421 B8R1.2 O=CN1CCCCC1 SC-02942 [1,1,0,0,0,0|1,0,0]=3 422 B8R1.2 O=CN1CCNCC1 SC-46658 [1,1,0,0,0,0|2,0,0]=4 423 B8R1.2 OCC1CCCCC1 SC-00039 [1,1,0,0,0,0|0,0,1]=3 424 B8R1.2 OCC1CCCCO1 SC-00052 [1,1,0,0,0,0|1,0,1]=4 425 B8R1.2 OCC1CCCNC1 SC-04704 [1,1,0,0,0,0|1,0,0]=3 426 B8R1.2 OCC1CCNCC1 SC-06048 [1,1,0,0,0,0|1,0,1]=4 427 B8R1.2 OCC1CCOCC1 SC-01198 [1,1,0,0,0,0|1,0,1]=4 428 B8R1.2 OCC1CNCCO1 SC-66184 [1,1,0,0,0,0|2,0,0]=4 429 B8R1.2 OCC1CNCCO1 SC-88687 [1,1,0,0,0,0|2,0,0]=4 430 B8R1.2 OCC1COCCN1 SC-25307 [1,1,0,0,0,0|2,0,0]=4 431 B8R1.2 OCC1COCCN1 SC-81449 [1,1,0,0,0,0|2,0,0]=4 432 B8R1.2 OC[C@@H]1CNCCN1 SC-72400 [1,1,0,0,0,0|2,0,0]=4 433 B8R1.2 OC[C@@H]1CNCCO1 SC-29296 [1,1,0,0,0,0|2,0,0]=4 434 B8R1.2 OC[C@@H]1CNCCO1 SC-66035 [1,1,0,0,0,0|2,0,0]=4 435 B8R1.2 OC[C@@H]1COCCN1 SC-91809 [1,1,0,0,0,0|2,0,0]=4 436 B8R1.2 OC[C@H]1CCCCN1 SC-83108 [1,1,0,0,0,0|1,0,1]=4 437 B8R1.2 OC[C@H]1CNCCN1 SC-72401 [1,1,0,0,0,0|2,0,0]=4 438 B8R1.2 OC[C@H]1CNCCO1 SC-14658 [1,1,0,0,0,0|2,0,0]=4 439 B8R1.2 OC[C@H]1CNCCO1 SC-93221 [1,1,0,0,0,0|2,0,0]=4 440 B8R1.2 OC[C@H]1COCCO1 SC-A2546 [1,1,0,0,0,0|2,0,0]=4 441 B8R1.2 ONC1CCCCC1 SC-A3793 [1,1,0,0,0,0|0,0,2]=4 442 B8R1.3 CC1=CCC(=O)CC1 SC-25236 [1,1,0,0,0,0|0,0,2]=4 443 B8R1.3 CC1=CCC(=O)CC1 SC-83877 [1,1,0,0,0,0|0,0,2]=4 444 B8R1.3 CC1CCC(N)CC1 SC-15967 [1,1,0,0,0,0|0,0,1]=3 445 B8R1.3 CC1CCC(N)CC1 SC-54542 [1,1,0,0,0,0|0,0,1]=3 446 B8R1.3 CN1CCC(=O)CC1 SC-01124 [1,1,0,0,0,0|1,0,0]=3 447 B8R1.3 CN1CCC(=O)CC1 SC-90211 [1,1,0,0,0,0|1,0,0]=3 448 B8R1.3 CN1CCC(Br)CC1 SC-24214 [1,1,0,0,0,0|1,0,1]=4 449 B8R1.3 CN1CCC(Cl)CC1 SC-05324 [1,1,0,0,0,0|1,0,1]=4 450 B8R1.3 C[C@H]1CN[C@H](C)CO1 SC-42238 [1,1,0,0,0,0|2,0,0]=4 451 B8R1.3 NC1CCC(=O)CC1 SC-51421 [1,1,0,0,0,0|0,0,0]=2 452 B8R1.3 NC1CCC(=O)CC1 SC-94303 [1,1,0,0,0,0|0,0,0]=2 453 B8R1.3 NC1CCC(O)CC1 SC-26489 [1,1,0,0,0,0|0,0,2]=4 454 B8R1.3 NC1CCC(O)CC1 SC-43558 [1,1,0,0,0,0|0,0,2]=4 455 B8R1.3 NC1CCC(O)CC1 SC-45530 [1,1,0,0,0,0|0,0,2]=4 456 B8R1.3 N[C@H]1CCC(=O)NC1 SC-A3084 [1,1,0,0,0,0|1,0,0]=3 457 B8R1.3 N[C@H]1CC[C@H](O)CC1 SC-03065 [1,1,0,0,0,0|0,0,2]=4 458 B8R1.3 N[C@H]1CC[C@H](O)CC1 SC-21292 [1,1,0,0,0,0|0,0,2]=4 459 B8R1.3 O=C1CCC(=O)CC1 SC-15336 [1,1,0,0,0,0|0,0,1]=3 460 B8R1.3 O=C1CCC(=O)NC1 SC-35404 [1,1,0,0,0,0|1,0,1]=4 461 B8R1.3 O=C1CCC(O)CC1 SC-22101 [1,1,0,0,0,0|0,0,0]=2 462 B8R1.3 O=C1CCC(O)CN1 SC-14920 [1,1,0,0,0,0|1,0,0]=3 463 B8R1.3 OC1CCC(O)CC1 SC-22723 [1,1,0,0,0,0|0,0,2]=4 464 B8R1.3 O[C@H]1CC[C@H](O)CC1 SC-51814 [1,1,0,0,0,0|0,0,2]=4 465 B8R1.5 CC1CCCCC1=O SC-20428 [1,1,0,0,0,0|0,0,0]=2 466 B8R1.5 CC1CCCNC1C SC-57854 [1,1,0,0,0,0|1,0,0]=3 467 B8R1.5 CC1CNCCN1C SC-02882 [1,1,0,0,0,0|2,0,0]=4 468 B8R1.5 C[C@H]1NCCNC1=O SC-05130 [1,1,0,0,0,0|2,0,0]=4 469 B8R1.5 NC1CCCCC1=O SC-22252 [1,1,0,0,0,0|0,0,0]=2 470 B8R1.5 NC1CCCCC1=O SC-84826 [1,1,0,0,0,0|0,0,0]=2 471 B8R1.5 NC1CCCCC1N SC-02306 [1,1,0,0,0,0|1,0,1]=4 472 B8R1.5 NC1CCCCC1O SC-45073 [1,1,0,0,0,0|0,0,2]=4 473 B8R1.5 NC1CCCC[C@@H]1O SC-44498 [1,1,0,0,0,0|0,0,2]=4 474 B8R1.5 NC1CCCNC1=O SC-14514 [1,1,0,0,0,0|1,0,0]=3 475 B8R1.5 NC1CCNCC1O SC-97873 [1,1,0,0,0,0|2,0,0]=4 476 B8R1.5 N[C@@H]1CCCC[C@H]1N SC-17287 [1,1,0,0,0,0|1,0,1]=4 477 B8R1.5 N[C@@H]1CCCC[C@H]1O SC-15016 [1,1,0,0,0,0|0,0,2]=4 478 B8R1.5 N[C@@H]1CCCC[C@H]1O SC-26535 [1,1,0,0,0,0|0,0,2]=4 479 B8R1.5 N[C@@H]1CCCNC1=O SC-48796 [1,1,0,0,0,0|1,0,0]=3 480 B8R1.5 N[C@@H]1COCC[C@H]1O SC-20565 [1,1,0,0,0,0|2,0,0]=4 481 B8R1.5 N[C@H]1CCCC[C@@H]1N SC-02456 [1,1,0,0,0,0|1,0,1]=4 482 B8R1.5 N[C@H]1CCCC[C@@H]1O SC-26530 [1,1,0,0,0,0|0,0,2]=4 483 B8R1.5 N[C@H]1CCCC[C@H]1O SC-26560 [1,1,0,0,0,0|0,0,2]=4 484 B8R1.5 N[C@H]1CCCC[C@H]1O SC-35500 [1,1,0,0,0,0|0,0,2]=4 485 B8R1.5 N[C@H]1CCCC[C@H]1O SC-70916 [1,1,0,0,0,0|0,0,2]=4 486 B8R1.5 N[C@H]1CCCC[C@H]1O SC-99850 [1,1,0,0,0,0|0,0,2]=4 487 B8R1.5 N[C@H]1CCCNC1=O SC-27263 [1,1,0,0,0,0|1,0,0]=3 488 B8R1.5 O=C1CCCCC1=O SC-46435 [1,1,0,0,0,0|0,0,1]=3 489 B8R1.5 O=C1CCCCC1Br SC-86496 [1,1,0,0,0,0|0,0,0]=2 490 B8R1.5 O=C1CCCCC1Cl SC-20977 [1,1,0,0,0,0|0,0,0]=2 491 B8R1.5 O=C1CCCCC1O SC-49144 [1,1,0,0,0,0|0,0,0]=2 492 B8R1.5 O=C1CCNCC1Br SC-94331 [1,1,0,0,0,0|1,0,0]=3 493 B8R1.5 O=C1CCOCC1Br SC-33711 [1,1,0,0,0,0|1,0,0]=3 494 B8R1.5 O=C1NCCCC1O SC-14922 [1,1,0,0,0,0|1,0,0]=3 495 B8R1.5 O[C@@H]1CCCC[C@H]1O SC-20091 [1,1,0,0,0,0|0,0,2]=4 496 B8R1.5 O[C@H]1CCCC[C@H]1O SC-95524 [1,1,0,0,0,0|0,0,2]=4 497 B8R1.5 [C@@H]1(N)CCCC[C@H]1N SC-26625 [1,1,0,0,0,0|1,0,1]=4 498 B8R1.5 [C@H]1(N)CCCC[C@H]1N SC-45540 [1,1,0,0,0,0|1,0,1]=4 499 B8R1.72 CC1(C)CCCNC1 SC-A4757 [1,1,0,0,0,0|1,0,0]=3 500 B8R1.72 CC1(C)CNCCN1 SC-28617 [1,1,0,0,0,0|2,0,0]=4 501 B8R1.72 CC1(C)CNCCO1 SC-61844 [1,1,0,0,0,0|2,0,0]=4 502 B8R1.72 CC1(C)CNCCO1 SC-68994 [1,1,0,0,0,0|2,0,0]=4 503 B8R1.72 CC1(N)CCNCC1 SC-72271 [1,1,0,0,0,0|1,0,1]=4 504 B8R1.72 CC1(O)CCCCC1 SC-44648 [1,1,0,0,0,0|0,0,1]=3 505 B8R1.72 FC1(F)CCCCC1 SC-88951 [1,1,0,0,0,0|1,0,1]=4 506 B8R1.72 FC1(F)CCCNC1 SC-04828 [1,1,0,0,0,0|2,0,0]=4 507 B8R1.72 FC1(F)CCCNC1 SC-91906 [1,1,0,0,0,0|2,0,0]=4 508 B8R1.72 O=S1(=O)CCCCN1 SC-48177 [1,1,0,0,0,0|2,0,0]=4 509 B8R1.72 O=S1(=O)CCCCO1 SC-15335 [1,1,0,0,0,0|2,0,0]=4 510 B8R1.72 O=S1(=O)CCNCC1 SC-04097 [1,1,0,0,0,0|2,0,0]=4 511 B8R1.72 O=S1(=O)CCNCC1 SC-05623 [1,1,0,0,0,0|2,0,0]=4 512 B8R1.1 CN1CCC(CN)C1 SC-29935 [0,1,0,0,1,0|2,0,0]=4 513 B8R1.1 CN1CCC(CN)C1 SC-51576 [0,1,0,0,1,0|2,0,0]=4 514 B8R1.1 CN1CCC(CO)C1 SC-48010 [0,1,0,0,1,0|2,0,0]=4 515 B8R1.1 CN1CC[C@@H](CO)C1 SC-A3243 [0,1,0,0,1,0|2,0,0]=4 516 B8R1.1 NCC1CCC(=O)N1 SC-53656 [0,1,0,0,1,0|1,0,0]=3 517 B8R1.1 NC[C@@H]1CCC(=O)N1 SC-44056 [0,1,0,0,1,0|1,0,0]=3 518 B8R1.1 O=C1CC(CO)CN1 SC-66045 [0,1,0,0,1,0|1,0,0]=3 519 B8R1.1 O=C1CC[C@@H](CO)N1 SC-09020 [0,1,0,0,1,0|1,0,0]=3 520 B8R1.1 O=C1CC[C@@H](CO)O1 SC-03496 [0,1,0,0,1,0|1,0,0]=3 521 B8R1.1 O=C1CC[C@H](CO)N1 SC-19648 [0,1,0,0,1,0|1,0,0]=3 522 B8R1.1 O=C1N[C@@H](CO)CO1 SC-33166 [0,1,0,0,1,0|2,0,0]=4 523 B8R1.1 [C@H]1(CBr)CCC(=O)N1 SC-23592 [0,1,0,0,1,0|1,0,0]=3 524 B8R1.18 CC1CC(=O)OC1=O SC-97577 [0,1,0,0,1,0|1,0,1]=4 525 B8R1.18 CC1OC(=O)OC1C SC-21491 [0,1,0,0,1,0|2,0,0]=4 526 B8R1.50 CC1=C(O)C(=O)CC1 SC-74535 [0,1,0,0,1,0|0,0,2]=4 527 B8R1.50 CC1C(=O)CCC1=O SC-62325 [0,1,0,0,1,0|1,0,1]=4 528 B8R1.50 CN1C(=O)CCC1O SC-88414 [0,1,0,0,1,0|2,0,0]=4 529 B8R1.51 CC1(C)C=CC(=O)C1 SC-91103 [0,1,0,0,1,0|0,0,2]=4 530 B8R1.51 CC1(C)CCC(=O)O1 SC-21203 [0,1,0,0,1,0|1,0,0]=3 531 B8R1.51 CC1(C)CNC(=O)C1 SC-70558 [0,1,0,0,1,0|1,0,0]=3 532 B8R1.51 CC1CCS(=O)(=O)O1 SC-21616 [0,1,0,0,1,0|2,0,0]=4 533 B8R1.51 NC1CCS(=O)(=O)C1 SC-43760 [0,1,0,0,1,0|2,0,0]=4 534 B8R1.11 C=CN1CCCC1=O SC-47246 [0,1,0,0,1,0|1,0,1]=4 535 B8R1.11 CN1CCC[C@H]1CO SC-03638 [0,1,0,0,1,0|2,0,0]=4 536 B8R1.11 N#CC1CCCC1=O SC-46105 [0,1,0,0,1,0|0,0,1]=3 537 B8R1.11 N[C@H]1CCC[C@H]1CO SC-20351 [0,1,0,0,1,0|1,0,1]=4 538 B8R1.19 CC1(C)CCOC1=O SC-15803 [0,1,0,0,1,0|1,0,0]=3 539 B10R1.8 CCC1CC(=O)CC(=O)C1 SC-54604 [0,2,0,0,0,0|0,0,1]=3 540 B10R1.10 CCOC1=CC(=O)CCC1 SC-70370 [0,2,0,0,0,0|0,0,2]=4 541 B10R1.113 CC(=O)N1CCC[C@H](O)C1 SC-88350 [0,2,0,0,0,0|2,0,0]=4 542 B10R1.113 CN1CCCC(C(=O)O)C1 SC-53949 [0,2,0,0,0,0|1,0,1]=4 543 B10R1.113 C[C@@H]1CCN[C@@H](C(=O)[O-])C1 SC-15310 [0,2,0,0,0,0|1,0,1]=4 544 B10R1.113 NC1CCCC(C(=O)O)C1 SC-15059 [0,2,0,0,0,0|1,0,1]=4 545 B10R1.113 N[C@@H]1CCC[C@H](C(=O)O)C1 SC-48763 [0,2,0,0,0,0|1,0,1]=4 546 B10R1.113 N[C@@H]1CCC[C@H](C(=O)O)C1 SC-48783 [0,2,0,0,0,0|1,0,1]=4 547 B10R1.113 N[C@H]1CCC[C@@H](C(=O)O)C1 SC-68749 [0,2,0,0,0,0|1,0,1]=4 548 B10R1.113 O=C1CC(C(=O)O)CCN1 SC-95916 [0,2,0,0,0,0|1,0,1]=4 549 B10R1.113 O=C1CCCC(C(=O)O)C1 SC-47920 [0,2,0,0,0,0|0,0,1]=3 550 B10R1.113 O=C1CCCC(C(=O)O)N1 SC-49024 [0,2,0,0,0,0|1,0,1]=4 551 B10R1.113 O=C1CCC[C@@H](C(=O)O)N1 SC-22183 [0,2,0,0,0,0|1,0,1]=4 552 B10R1.171 CC1(C)CC(C=O)CCO1 SC-83548 [0,2,0,0,0,0|1,0,1]=4 553 B10R1.329 CC1(C)CC(=O)CC(=O)C1 SC-17394 [0,2,0,0,0,0|0,0,1]=3 554 B10R1.329 CC1(C)CC(=O)CC(=O)N1 SC-84619 [0,2,0,0,0,0|1,0,1]=4 555 B10R1.329 CC1(C)CC(=O)NC(=O)C1 SC-99802 [0,2,0,0,0,0|1,0,1]=4 556 B10R1.329 CC1(C)CC(=O)OC(=O)C1 SC-A4598 [0,2,0,0,0,0|1,0,1]=4 557 B10R1.329 CC1CC(=O)CC(C)(C)C1 SC-95744 [0,2,0,0,0,0|0,0,0]=2 558 B10R1.63 CC1(C)CCC(=O)CC1=O SC-52762 [0,2,0,0,0,0|1,0,1]=4 559 B8R1.34 O=C(O)CC1CCC1 SC-26391 [0,0,1,1,0,0|1,0,0]=3 560 B8R1.34 O=C(O)CC1COC1 SC-70807 [0,0,1,1,0,0|2,0,0]=4 561 B8R1.34 O=C(O)CN1CCC1 SC-A4384 [0,0,1,1,0,0|2,0,0]=4 562 B8R1.40 COC(=O)CC1CC1 SC-93890 [0,0,1,1,0,0|1,0,0]=3 563 B8R1.40 NCC(=O)OC1CC1 SC-19491 [0,0,1,1,0,0|2,0,0]=4 564 B8R1.40 NNC(=O)CC1CC1 SC-91241 [0,0,1,1,0,0|2,0,0]=4 565 B8R1.42 CC(=O)OC1(C)CC1 SC-91864 [0,0,1,1,0,0|1,0,0]=3 566 B8R1.83 COC(=O)[C@@H]1O[C@H]1C SC-49429 [0,0,1,1,0,0|2,0,0]=4 567 B8R1.7 CC(=O)C1CCCC1 SC-69830 [0,0,1,1,0,0|0,0,0]=2 568 B8R1.7 CC(C)[C@@H]1CCCN1 SC-A3785 [0,0,1,1,0,0|1,0,1]=4 569 B8R1.7 NC(=O)C1CCCN1 SC-24789 [0,0,1,1,0,0|2,0,0]=4 570 B8R1.7 NC(=O)C1CCNC1 SC-A3191 [0,0,1,1,0,0|2,0,0]=4 571 B8R1.7 NC(=O)[C@@H]1CCCN1 SC-06632 [0,0,1,1,0,0|2,0,0]=4 572 B8R1.7 O=C(Cl)C1CCCC1 SC-45320 [0,0,1,1,0,0|1,0,0]=3 573 B8R1.7 O=C(Cl)N1CCCC1 SC-72914 [0,0,1,1,0,0|2,0,0]=4 574 B8R1.7 O=C(O)C1CCCC1 SC-18675 [0,0,1,1,0,0|1,0,0]=3 575 B8R1.7 O=C(O)C1CCCN1 SC-09807 [0,0,1,1,0,0|2,0,0]=4 576 B8R1.7 O=C(O)C1CCCO1 SC-A4307 [0,0,1,1,0,0|2,0,0]=4 577 B8R1.7 O=C(O)C1CCOC1 SC-21248 [0,0,1,1,0,0|2,0,0]=4 578 B8R1.7 O=C(O)[C@@H]1CCCN1 SC-09806 [0,0,1,1,0,0|2,0,0]=4 579 B8R1.7 O=C(O)[C@@H]1CCNC1 SC-48463 [0,0,1,1,0,0|2,0,0]=4 580 B8R1.7 O=C(O)[C@@H]1CCOC1 SC-25192 [0,0,1,1,0,0|2,0,0]=4 581 B8R1.7 O=C(O)[C@H]1CCCN1 SC-09805 [0,0,1,1,0,0|2,0,0]=4 582 B8R1.7 O=C(O)[C@H]1CCCO1 SC-07092 [0,0,1,1,0,0|2,0,0]=4 583 B8R1.7 O=C(O)[C@H]1CCNC1 SC-25206 [0,0,1,1,0,0|2,0,0]=4 584 B8R1.7 [C@H]1(C(=O)O)CCNC1 SC-48462 [0,0,1,1,0,0|2,0,0]=4 585 B8R1.7 [C@H]1(C(N)=O)CCCN1 SC-13550 [0,0,1,1,0,0|2,0,0]=4 586 B8R1.22 NC1CCCCCC1 SC-51775 [0,0,1,1,0,0|1,0,1]=4 587 B8R1.22 O=C1C=CCCCC1 SC-99582 [0,0,1,1,0,0|0,0,2]=4 588 B8R1.22 O=C1CCCNCC1 SC-20974 [0,0,1,1,0,0|1,0,0]=3 589 B8R1.22 O=C1CCCNCC1 SC-20993 [0,0,1,1,0,0|1,0,0]=3 590 B8R1.22 O=C1CCNCCN1 SC-05951 [0,0,1,1,0,0|2,0,0]=4 591 B8R1.22 O=C1CNCCCN1 SC-21981 [0,0,1,1,0,0|2,0,0]=4 592 B8R1.35 O=C(O)CCC1CC1 SC-31428 [0,0,1,1,0,0|1,0,0]=3 593 B8R1.8 BrCCC1CCCC1 SC-51481 [0,0,1,1,0,0|1,0,1]=4 594 B8R1.8 N#CCC1CCCC1 SC-40258 [0,0,1,1,0,0|1,0,1]=4 595 B8R1.8 NCCC1CCCC1 SC-44893 [0,0,1,1,0,0|1,0,1]=4 596 B8R1.8 NCCC1CCCC1 SC-A3050 [0,0,1,1,0,0|1,0,1]=4 597 B8R1.8 O=C=NC1CCCC1 SC-27896 [0,0,1,1,0,0|1,0,1]=4 598 B8R1.8 OCCC1CCCC1 SC-41116 [0,0,1,1,0,0|0,0,2]=4 599 B8R1.37 CCOC(=N)C1CC1 SC-67732 [0,0,1,1,0,0|2,0,0]=4 600 B8R1.37 CCOC(=O)C1CC1 SC-27163 [0,0,1,1,0,0|1,0,0]=3 601 B8R1.37 CCOC(=O)C1CO1 SC-74138 [0,0,1,1,0,0|2,0,0]=4 602 B8R1.37 N#CCC(=O)C1CC1 SC-22503 [0,0,1,1,0,0|1,0,1]=4 603 B8R2.23 C1NCC2CC1O2 SC-51309 [1,0,0,1,0,0|2,0,0]=4 604 B8R2.23 C1NCC2CC1O2 SC-B3877 [1,0,0,1,0,0|2,0,0]=4 605 B8R2.23 C1OCC2CC1N2 SC-A2549 [1,0,0,1,0,0|2,0,0]=4 606 B8R2.34 C1=CC2CCC1C2 SC-49283 [1,0,0,1,0,0|0,0,1]=3 607 B8R2.34 C1CC2CC1CN2 SC-67774 [1,0,0,1,0,0|1,0,0]=3 608 B8R2.34 C1CC2CC1CN2 SC-A4189 [1,0,0,1,0,0|1,0,0]=3 609 B8R2.34 C1CC2CCC1N2 SC-70696 [1,0,0,1,0,0|1,0,1]=4 610 B8R2.34 C1NC2CNC1C2 SC-91646 [1,0,0,1,0,0|2,0,0]=4 611 B8R2.34 C1O[C@@H]2CN[C@H]1C2 SC-35864 [1,0,0,1,0,0|2,0,0]=4 612 B8R2.34 [C@@H]12CO[C@@H](CN1)C2 SC-51029 [1,0,0,1,0,0|2,0,0]=4 613 B8R2.34 [C@H]12CNC(CN1)C2 SC-21345 [1,0,0,1,0,0|2,0,0]=4 614 B8R2.34 [C@H]12CO[C@H](CN1)C2 SC-48245 [1,0,0,1,0,0|2,0,0]=4 615 B10R2.71 O=C1CC2CCC(C1)O2 SC-51298 [0,0,0,1,0,1|1,0,0]=3 616 B10R2.71 [C@H]12CC[C@H](CC(=O)C1)N2 SC-21470 [0,0,0,1,0,1|1,0,0]=3 617 B10R2.62 CN1CC2CCC1CN2 SC-99966 [0,1,0,1,0,0|2,0,0]=4 618 B10R2.62 O=C1CN2CCC1CC2 SC-17709 [0,1,0,1,0,0|1,0,0]=3 619 B10R2.62 O=C1NC2CCC1CC2 SC-32435 [0,1,0,1,0,0|1,0,0]=3 620 B10R2.62 OC1CC2CCC1CC2 SC-A3538 [0,1,0,1,0,0|0,0,2]=4 621 B6R0.3 CC(C)C(=O)CBr SC-21776 [0,0,1,0,1,0|1,0,0]=3 622 B6R0.3 CC(C)C(=O)NN SC-82184 [0,0,1,0,1,0|2,0,0]=4 623 B6R0.3 CC(CBr)C(=O)O SC-53016 [0,0,1,0,1,0|2,0,0]=4 624 B6R0.3 CC(CN)C(=O)O SC-10095 [0,0,1,0,1,0|2,0,0]=4 625 B6R0.3 CC(CN)C(=O)O SC-16443 [0,0,1,0,1,0|2,0,0]=4 626 B6R0.3 CCC(F)C(=O)O SC-82839 [0,0,1,0,1,0|2,0,0]=4 627 B6R0.3 CCC(N)C(=O)O SC-25570 [0,0,1,0,1,0|2,0,0]=4 628 B6R0.3 CCC(N)C(N)=O SC-67619 [0,0,1,0,1,0|2,0,0]=4 629 B6R0.3 CCC(S)C(=O)O SC-90417 [0,0,1,0,1,0|2,0,0]=4 630 B6R0.3 CCN(O)C(C)=O SC-69302 [0,0,1,0,1,0|2,0,0]=4 631 B6R0.3 CC[C@@H](C)C(=O)O SC-92309 [0,0,1,0,1,0|1,0,0]=3 632 B6R0.3 CC[C@@H](N)C(=O)O SC-10051 [0,0,1,0,1,0|2,0,0]=4 633 B6R0.3 CC[C@@H](O)C(=O)O SC-53865 [0,0,1,0,1,0|2,0,0]=4 634 B6R0.3 CC[C@H](N)C(=O)O SC-10052 [0,0,1,0,1,0|2,0,0]=4 635 B6R0.3 CC[C@H](N)C(N)=O SC-15825 [0,0,1,0,1,0|2,0,0]=4 636 B6R0.3 CN(C)C(=O)CCl SC-25918 [0,0,1,0,1,0|2,0,0]=4 637 B6R0.3 CN(C)C(=O)CN SC-26411 [0,0,1,0,1,0|2,0,0]=4 638 B6R0.3 CN[C@H](C)C(=O)O SC-45134 [0,0,1,0,1,0|2,0,0]=4 639 B6R0.3 COC(=O)C(C)Cl SC-18837 [0,0,1,0,1,0|2,0,0]=4 640 B6R0.3 COC(=O)C(C)N SC-09296 [0,0,1,0,1,0|2,0,0]=4 641 B6R0.3 COC(=O)C(C)N SC-54087 [0,0,1,0,1,0|2,0,0]=4 642 B6R0.3 COC(=O)C(C)O SC-01713 [0,0,1,0,1,0|2,0,0]=4 643 B6R0.3 COC(=O)[C@H](C)Cl SC-06555 [0,0,1,0,1,0|2,0,0]=4 644 B6R0.3 COC(=O)[C@H](C)N SC-09297 [0,0,1,0,1,0|2,0,0]=4 645 B6R0.3 COC(C)C(=O)O SC-49776 [0,0,1,0,1,0|2,0,0]=4 646 B6R0.3 CON(C)C(C)=O SC-20924 [0,0,1,0,1,0|2,0,0]=4 647 B6R0.3 CO[C@@H](C)C(=O)O SC-89341 [0,0,1,0,1,0|2,0,0]=4 648 B6R0.3 CO[C@H](C)C(=O)O SC-A3340 [0,0,1,0,1,0|2,0,0]=4 649 B6R0.3 C[C@@H](CN)C(=O)O SC-69436 [0,0,1,0,1,0|2,0,0]=4 650 B6R0.3 C[C@H](CN)C(=O)O SC-90232 [0,0,1,0,1,0|2,0,0]=4 651 B6R0.3 C[C@H](CN)C(=O)O SC-A1203 [0,0,1,0,1,0|2,0,0]=4 652 B6R0.3 [C@@H](N)(CC)C(N)=O SC-49088 [0,0,1,0,1,0|2,0,0]=4 653 B6R1.2 BrC1CCNC1 SC-24702 [1,0,0,0,1,0|2,0,0]=4 654 B6R1.2 BrC1CCOC1 SC-49709 [1,0,0,0,1,0|2,0,0]=4 655 B6R1.2 CC1=CCCC1 SC-46849 [1,0,0,0,1,0|0,0,1]=3 656 B6R1.2 CC1=CCCO1 SC-69814 [1,0,0,0,1,0|1,0,1]=4 657 B6R1.2 CC1=NCCC1 SC-07079 [1,0,0,0,1,0|1,0,1]=4 658 B6R1.2 CC1CCCN1 SC-89376 [1,0,0,0,1,0|1,0,0]=3 659 B6R1.2 CC1CCCN1 SC-A3822 [1,0,0,0,1,0|1,0,0]=3 660 B6R1.2 CC1CCNC1 SC-24125 [1,0,0,0,1,0|1,0,0]=3 661 B6R1.2 CC1CCNC1 SC-49333 [1,0,0,0,1,0|1,0,0]=3 662 B6R1.2 CN1CCCC1 SC-19022 [1,0,0,0,1,0|1,0,0]=3 663 B6R1.2 C[C@@H]1CCNC1 SC-23714 [1,0,0,0,1,0|1,0,0]=3 664 B6R1.2 C[C@@H]1CCNC1 SC-50232 [1,0,0,0,1,0|1,0,0]=3 665 B6R1.2 C[C@H]1CCCN1 SC-95860 [1,0,0,0,1,0|1,0,0]=3 666 B6R1.2 C[C@H]1CCNC1 SC-50233 [1,0,0,0,1,0|1,0,0]=3 667 B6R1.2 FC1CCCC1 SC-09548 [1,0,0,0,1,0|1,0,0]=3 668 B6R1.2 FC1CCNC1 SC-28940 [1,0,0,0,1,0|2,0,0]=4 669 B6R1.2 F[C@H]1CCNC1 SC-43922 [1,0,0,0,1,0|2,0,0]=4 670 B6R1.2 NC1=NCCC1 SC-68430 [1,0,0,0,1,0|2,0,0]=4 671 B6R1.2 NC1CC=CC1 SC-21605 [1,0,0,0,1,0|1,0,1]=4 672 B6R1.2 NC1CCCC1 SC-84758 [1,0,0,0,1,0|1,0,0]=3 673 B6R1.2 NC1CCNC1 SC-18208 [1,0,0,0,1,0|2,0,0]=4 674 B6R1.2 NC1CCNC1 SC-62350 [1,0,0,0,1,0|2,0,0]=4 675 B6R1.2 NC1CCOC1 SC-12746 [1,0,0,0,1,0|2,0,0]=4 676 B6R1.2 NC1CCOC1 SC-35465 [1,0,0,0,1,0|2,0,0]=4 677 B6R1.2 NN1CCCC1 SC-01559 [1,0,0,0,1,0|2,0,0]=4 678 B6R1.2 NN1CCCC1 SC-65336 [1,0,0,0,1,0|2,0,0]=4 679 B6R1.2 N[C@@H]1CCOC1 SC-14942 [1,0,0,0,1,0|2,0,0]=4 680 B6R1.2 N[C@@H]1CCOC1 SC-26567 [1,0,0,0,1,0|2,0,0]=4 681 B6R1.2 N[C@H]1CCOC1 SC-14943 [1,0,0,0,1,0|2,0,0]=4 682 B6R1.2 O=C1C=CCC1 SC-07348 [1,0,0,0,1,0|0,0,2]=4 683 B6R1.2 O=C1CCCN1 SC-85210 [1,0,0,0,1,0|1,0,0]=3 684 B6R1.2 O=C1CCNC1 SC-24328 [1,0,0,0,1,0|1,0,0]=3 685 B6R1.2 O=C1CCNC1 SC-50749 [1,0,0,0,1,0|1,0,0]=3 686 B6R1.2 O=C1CCNN1 SC-21405 [1,0,0,0,1,0|2,0,0]=4 687 B6R1.2 O=C1CCOC1 SC-21867 [1,0,0,0,1,0|1,0,0]=3 688 B6R1.2 O=C1NCCO1 SC-04833 [1,0,0,0,1,0|2,0,0]=4 689 B6R1.2 O=C1NCCS1 SC-27050 [1,0,0,0,1,0|2,0,0]=4 690 B6R1.2 OC1CC=CC1 SC-22908 [1,0,0,0,1,0|1,0,1]=4 691 B6R1.2 OC1CCCN1 SC-21341 [1,0,0,0,1,0|2,0,0]=4 692 B6R1.2 OC1CCNC1 SC-00623 [1,0,0,0,1,0|2,0,0]=4 693 B6R1.2 OC1CCNC1 SC-19629 [1,0,0,0,1,0|2,0,0]=4 694 B6R1.2 OC1CCNC1 SC-24957 [1,0,0,0,1,0|2,0,0]=4 695 B6R1.2 OC1CCNC1 SC-27708 [1,0,0,0,1,0|2,0,0]=4 696 B6R1.2 OC1CCOC1 SC-17875 [1,0,0,0,1,0|2,0,0]=4 697 B6R1.2 O[C@@H]1CCNC1 SC-00194 [1,0,0,0,1,0|2,0,0]=4 698 B6R1.2 O[C@@H]1CCNC1 SC-13984 [1,0,0,0,1,0|2,0,0]=4 699 B6R1.2 O[C@@H]1CCOC1 SC-07022 [1,0,0,0,1,0|2,0,0]=4 700 B6R1.2 O[C@H]1CCOC1 SC-08982 [1,0,0,0,1,0|2,0,0]=4 701 B6R1.2 O[C@H]1CCOC1 SC-50082 [1,0,0,0,1,0|2,0,0]=4 702 B6R1.2 [C@@H]1(C)CCCN1 SC-48604 [1,0,0,0,1,0|1,0,0]=3 703 B6R1.2 [C@H]1(O)CCNC1 SC-24229 [1,0,0,0,1,0|2,0,0]=4 704 B6R1.5 NC1CC(=O)C1 SC-50311 [0,0,0,0,2,0|1,0,0]=3 705 B6R1.5 NC1CC(=O)C1 SC-67476 [0,0,0,0,2,0|1,0,0]=3