0 B7R1.3 BrC1=CCCCC1 SC-69986 [0,0,0,0,0,0|2,0,1]=3 1 B7R1.3 BrC1CCCOC1 SC-43426 [0,0,0,0,0,0|3,0,0]=3 2 B7R1.3 BrC1CCNCC1 SC-05213 [0,0,0,0,0,0|3,0,0]=3 3 B7R1.3 BrC1CCNCC1 SC-48705 [0,0,0,0,0,0|3,0,0]=3 4 B7R1.3 BrC1CCOCC1 SC-27394 [0,0,0,0,0,0|3,0,0]=3 5 B7R1.3 C=C1CCNCC1 SC-88353 [0,0,0,0,0,0|2,0,2]=4 6 B7R1.3 CC1=CCCCC1 SC-99243 [0,0,0,0,0,0|1,0,1]=2 7 B7R1.3 CC1=CCCNC1 SC-82898 [0,0,0,0,0,0|2,0,1]=3 8 B7R1.3 CC1=CCNCC1 SC-B8899 [0,0,0,0,0,0|2,0,1]=3 9 B7R1.3 CC1CCCCC1 SC-79075 [0,0,0,0,0,0|1,0,0]=1 10 B7R1.3 CC1CCCNC1 SC-46299 [0,0,0,0,0,0|2,0,0]=2 11 B7R1.3 CC1CCNCC1 SC-05890 [0,0,0,0,0,0|2,0,0]=2 12 B7R1.3 CC1CNCCO1 SC-49158 [0,0,0,0,0,0|2,0,0]=2 13 B7R1.3 CC1CNCCO1 SC-82780 [0,0,0,0,0,0|2,0,0]=2 14 B7R1.3 CC1CNCCO1 SC-A3535 [0,0,0,0,0,0|2,0,0]=2 15 B7R1.3 CC1COCCN1 SC-49161 [0,0,0,0,0,0|1,0,0]=1 16 B7R1.3 CN1CCNCC1 SC-00315 [0,0,0,0,0,0|3,0,0]=3 17 B7R1.3 CN1CCNCC1 SC-66326 [0,0,0,0,0,0|3,0,0]=3 18 B7R1.3 C[C@@H]1CNCCO1 SC-43965 [0,0,0,0,0,0|2,0,0]=2 19 B7R1.3 C[C@@H]1CNCCO1 SC-88816 [0,0,0,0,0,0|2,0,0]=2 20 B7R1.3 C[C@@H]1COCCN1 SC-53994 [0,0,0,0,0,0|1,0,0]=1 21 B7R1.3 C[C@H]1CCCNC1 SC-99949 [0,0,0,0,0,0|2,0,0]=2 22 B7R1.3 C[C@H]1CNCCO1 SC-44479 [0,0,0,0,0,0|2,0,0]=2 23 B7R1.3 C[C@H]1COCCN1 SC-21564 [0,0,0,0,0,0|1,0,0]=1 24 B7R1.3 C[C@H]1COCCN1 SC-69967 [0,0,0,0,0,0|1,0,0]=1 25 B7R1.3 C[SiH]1CCCCO1 SC-91060 [0,0,0,0,0,0|1,1,0]=2 26 B7R1.3 ClC1CCCCO1 SC-85266 [0,0,0,0,0,0|2,0,0]=2 27 B7R1.3 FC1CCCCC1 SC-09547 [0,0,0,0,0,0|2,0,0]=2 28 B7R1.3 FC1CCCNC1 SC-21265 [0,0,0,0,0,0|3,0,0]=3 29 B7R1.3 IC1CCOCC1 SC-98886 [0,0,0,0,0,0|3,0,0]=3 30 B7R1.3 NC1CCCNC1 SC-54118 [0,0,0,0,0,0|3,0,0]=3 31 B7R1.3 NC1CCCNC1 SC-77469 [0,0,0,0,0,0|3,0,0]=3 32 B7R1.3 NC1CCCOC1 SC-35742 [0,0,0,0,0,0|3,0,0]=3 33 B7R1.3 NC1CCCOC1 SC-49332 [0,0,0,0,0,0|3,0,0]=3 34 B7R1.3 NC1CCNCC1 SC-00743 [0,0,0,0,0,0|3,0,0]=3 35 B7R1.3 NC1CCNCC1 SC-03792 [0,0,0,0,0,0|3,0,0]=3 36 B7R1.3 NC1CCOCC1 SC-03529 [0,0,0,0,0,0|3,0,0]=3 37 B7R1.3 NC1CCOCC1 SC-04006 [0,0,0,0,0,0|3,0,0]=3 38 B7R1.3 NC1CCSCC1 SC-35455 [0,0,0,0,0,0|3,0,0]=3 39 B7R1.3 NC1CCSCC1 SC-49681 [0,0,0,0,0,0|3,0,0]=3 40 B7R1.3 NN1CCCCC1 SC-18780 [0,0,0,0,0,0|3,0,0]=3 41 B7R1.3 NN1CCOCC1 SC-27139 [0,0,0,0,0,0|4,0,0]=4 42 B7R1.3 N[C@@H]1CCCNC1 SC-03568 [0,0,0,0,0,0|3,0,0]=3 43 B7R1.3 N[C@@H]1CCCOC1 SC-71639 [0,0,0,0,0,0|3,0,0]=3 44 B7R1.3 N[C@@H]1CCCOC1 SC-96408 [0,0,0,0,0,0|3,0,0]=3 45 B7R1.3 N[C@H]1CCCNC1 SC-25042 [0,0,0,0,0,0|3,0,0]=3 46 B7R1.3 N[C@H]1CCCOC1 SC-94110 [0,0,0,0,0,0|3,0,0]=3 47 B7R1.3 O=C1C=CCCN1 SC-25185 [0,0,0,0,0,0|1,0,3]=4 48 B7R1.3 O=C1CCCCN1 SC-16274 [0,0,0,0,0,0|1,0,1]=2 49 B7R1.3 O=C1CCCCO1 SC-65111 [0,0,0,0,0,0|2,0,1]=3 50 B7R1.3 O=C1CCCNC1 SC-29391 [0,0,0,0,0,0|3,0,1]=4 51 B7R1.3 O=C1CCCNC1 SC-48015 [0,0,0,0,0,0|3,0,1]=4 52 B7R1.3 O=C1CCCOC1 SC-14944 [0,0,0,0,0,0|3,0,1]=4 53 B7R1.3 O=C1CCNCC1 SC-04236 [0,0,0,0,0,0|3,0,1]=4 54 B7R1.3 O=C1CCNCC1 SC-04379 [0,0,0,0,0,0|3,0,1]=4 55 B7R1.3 O=C1CCNCC1 SC-19352 [0,0,0,0,0,0|3,0,1]=4 56 B7R1.3 O=C1CCOCC1 SC-03251 [0,0,0,0,0,0|3,0,1]=4 57 B7R1.3 O=C1CCSCC1 SC-19697 [0,0,0,0,0,0|3,0,1]=4 58 B7R1.3 O=C1CNCCN1 SC-05365 [0,0,0,0,0,0|2,0,1]=3 59 B7R1.3 O=C1CNCCO1 SC-84883 [0,0,0,0,0,0|3,0,1]=4 60 B7R1.3 O=C1COCCN1 SC-24222 [0,0,0,0,0,0|2,0,1]=3 61 B7R1.3 O=C1CSCCN1 SC-28581 [0,0,0,0,0,0|2,0,1]=3 62 B7R1.3 OC1CC=CCC1 SC-87372 [0,0,0,0,0,0|2,0,2]=4 63 B7R1.3 OC1CCCCO1 SC-84303 [0,0,0,0,0,0|2,0,0]=2 64 B7R1.3 OC1CCCNC1 SC-06262 [0,0,0,0,0,0|3,0,0]=3 65 B7R1.3 OC1CCCNC1 SC-47771 [0,0,0,0,0,0|3,0,0]=3 66 B7R1.3 OC1CCCOC1 SC-19794 [0,0,0,0,0,0|3,0,0]=3 67 B7R1.3 OC1CCCOC1 SC-35801 [0,0,0,0,0,0|3,0,0]=3 68 B7R1.3 OC1CCNCC1 SC-05165 [0,0,0,0,0,0|3,0,0]=3 69 B7R1.3 OC1CCOCC1 SC-02372 [0,0,0,0,0,0|3,0,0]=3 70 B7R1.3 OC1CCSCC1 SC-35917 [0,0,0,0,0,0|3,0,0]=3 71 B7R1.3 ON1CCCCC1 SC-13334 [0,0,0,0,0,0|3,0,0]=3 72 B7R1.3 O[C@@H]1CCCNC1 SC-12564 [0,0,0,0,0,0|3,0,0]=3 73 B7R1.3 O[C@H]1CCCNC1 SC-19802 [0,0,0,0,0,0|3,0,0]=3 74 B7R1.3 SC1CCOCC1 SC-47759 [0,0,0,0,0,0|3,0,0]=3 75 B7R1.3 [C@H]1(C)CNCCN1 SC-16783 [0,0,0,0,0,0|1,0,0]=1 76 B6R1.1 C1=CCNCC1 SC-83515 [1,0,0,0,0,0|0,0,2]=3 77 B6R1.1 C1=COCCC1 SC-00342 [1,0,0,0,0,0|1,0,2]=4 78 B6R1.1 C1CCNCC1 SC-05687 [1,0,0,0,0,0|0,0,0]=1 79 B6R1.1 C1CCNNC1 SC-84334 [1,0,0,0,0,0|1,0,0]=2 80 B6R1.1 C1CCONC1 SC-82296 [1,0,0,0,0,0|1,0,0]=2 81 B6R1.1 C1CC[NH2+]CC1 SC-48018 [1,0,0,0,0,0|0,0,1]=2 82 B6R1.1 C1CNCCN1 SC-94121 [1,0,0,0,0,0|1,0,0]=2 83 B6R1.1 C1CNCNC1 SC-72269 [1,0,0,0,0,0|1,0,0]=2 84 B6R1.1 C1COCCN1 SC-19184 [1,0,0,0,0,0|1,0,0]=2 85 B6R1.1 C1CSCSC1 SC-46192 [1,0,0,0,0,0|2,0,0]=3 86 B8R1.2 BrCC1CCCCC1 SC-02918 [0,1,0,0,0,0|1,0,0]=2 87 B8R1.2 BrCC1CCCCO1 SC-20895 [0,1,0,0,0,0|1,0,0]=2 88 B8R1.2 BrCC1CCCOC1 SC-44714 [0,1,0,0,0,0|2,0,0]=3 89 B8R1.2 BrCC1CCOCC1 SC-00660 [0,1,0,0,0,0|2,0,0]=3 90 B8R1.2 C#CC1CCOCC1 SC-96268 [0,1,0,0,0,0|2,0,1]=4 91 B8R1.2 CCC1CNCCN1 SC-35798 [0,1,0,0,0,0|1,0,0]=2 92 B8R1.2 CCC1CNCCO1 SC-61843 [0,1,0,0,0,0|2,0,0]=3 93 B8R1.2 CCN1CCNCC1 SC-05095 [0,1,0,0,0,0|3,0,0]=4 94 B8R1.2 CNC1CCCNC1 SC-00689 [0,1,0,0,0,0|2,0,0]=3 95 B8R1.2 CNC1CCCNC1 SC-52816 [0,1,0,0,0,0|2,0,0]=3 96 B8R1.2 CNC1CCCOC1 SC-35264 [0,1,0,0,0,0|2,0,0]=3 97 B8R1.2 CNC1CCNCC1 SC-04666 [0,1,0,0,0,0|2,0,0]=3 98 B8R1.2 COC1=CCCCC1 SC-28269 [0,1,0,0,0,0|1,0,1]=3 99 B8R1.2 COC1CCCNC1 SC-15522 [0,1,0,0,0,0|2,0,0]=3 100 B8R1.2 COC1CCCNC1 SC-45634 [0,1,0,0,0,0|2,0,0]=3 101 B8R1.2 COC1CCNCC1 SC-04308 [0,1,0,0,0,0|2,0,0]=3 102 B8R1.2 ICC1CCOCC1 SC-28261 [0,1,0,0,0,0|2,0,0]=3 103 B8R1.2 N#CC1CCCCC1 SC-73272 [0,1,0,0,0,0|1,0,1]=3 104 B8R1.2 N#CC1CCCCN1 SC-21123 [0,1,0,0,0,0|0,0,1]=2 105 B8R1.2 N#CC1CCNCC1 SC-04502 [0,1,0,0,0,0|2,0,1]=4 106 B8R1.2 N#CC1CCOCC1 SC-49321 [0,1,0,0,0,0|2,0,1]=4 107 B8R1.2 NCC1CCCCC1 SC-26900 [0,1,0,0,0,0|1,0,0]=2 108 B8R1.2 NCC1CCCCN1 SC-46326 [0,1,0,0,0,0|0,0,0]=1 109 B8R1.2 NCC1CCCCO1 SC-27902 [0,1,0,0,0,0|1,0,0]=2 110 B8R1.2 NCC1CCCOC1 SC-35931 [0,1,0,0,0,0|2,0,0]=3 111 B8R1.2 NCC1CCCOC1 SC-85451 [0,1,0,0,0,0|2,0,0]=3 112 B8R1.2 NCC1CCNCC1 SC-06464 [0,1,0,0,0,0|2,0,0]=3 113 B8R1.2 NCC1CCOCC1 SC-00740 [0,1,0,0,0,0|2,0,0]=3 114 B8R1.2 NCC1CNCCO1 SC-90824 [0,1,0,0,0,0|2,0,0]=3 115 B8R1.2 NC[C@@H]1COCCO1 SC-A3387 [0,1,0,0,0,0|2,0,0]=3 116 B8R1.2 NNC1CCCCC1 SC-12375 [0,1,0,0,0,0|2,0,0]=3 117 B8R1.2 NNC1CCCCC1 SC-58187 [0,1,0,0,0,0|2,0,0]=3 118 B8R1.2 NNC1CCOCC1 SC-12777 [0,1,0,0,0,0|3,0,0]=4 119 B8R1.2 NNC1CCOCC1 SC-50560 [0,1,0,0,0,0|3,0,0]=4 120 B8R1.2 O=CC1CCCCC1 SC-02305 [0,1,0,0,0,0|1,0,1]=3 121 B8R1.2 O=CC1CCCCN1 SC-29120 [0,1,0,0,0,0|0,0,1]=2 122 B8R1.2 O=CC1CCCOC1 SC-45114 [0,1,0,0,0,0|2,0,1]=4 123 B8R1.2 O=CC1CCNCC1 SC-21173 [0,1,0,0,0,0|2,0,1]=4 124 B8R1.2 O=CC1CCNCC1 SC-A3016 [0,1,0,0,0,0|2,0,1]=4 125 B8R1.2 O=CC1CCOCC1 SC-04900 [0,1,0,0,0,0|2,0,1]=4 126 B8R1.2 O=CC1CCSCC1 SC-96130 [0,1,0,0,0,0|2,0,1]=4 127 B8R1.2 O=CN1CCCCC1 SC-02942 [0,1,0,0,0,0|2,0,1]=4 128 B8R1.2 OCC1CCCCC1 SC-00039 [0,1,0,0,0,0|1,0,0]=2 129 B8R1.2 OCC1CCCCO1 SC-00052 [0,1,0,0,0,0|1,0,0]=2 130 B8R1.2 OCC1CCCNC1 SC-04704 [0,1,0,0,0,0|2,0,0]=3 131 B8R1.2 OCC1CCNCC1 SC-06048 [0,1,0,0,0,0|2,0,0]=3 132 B8R1.2 OCC1CCOCC1 SC-01198 [0,1,0,0,0,0|2,0,0]=3 133 B8R1.2 OCC1CNCCO1 SC-66184 [0,1,0,0,0,0|2,0,0]=3 134 B8R1.2 OCC1CNCCO1 SC-88687 [0,1,0,0,0,0|2,0,0]=3 135 B8R1.2 OCC1COCCN1 SC-25307 [0,1,0,0,0,0|1,0,0]=2 136 B8R1.2 OCC1COCCN1 SC-81449 [0,1,0,0,0,0|1,0,0]=2 137 B8R1.2 OCN1CCOCC1 SC-47895 [0,1,0,0,0,0|3,0,0]=4 138 B8R1.2 OC[C@@H]1CNCCN1 SC-72400 [0,1,0,0,0,0|1,0,0]=2 139 B8R1.2 OC[C@@H]1CNCCO1 SC-29296 [0,1,0,0,0,0|2,0,0]=3 140 B8R1.2 OC[C@@H]1CNCCO1 SC-66035 [0,1,0,0,0,0|2,0,0]=3 141 B8R1.2 OC[C@@H]1COCCN1 SC-91809 [0,1,0,0,0,0|1,0,0]=2 142 B8R1.2 OC[C@H]1CCCCN1 SC-83108 [0,1,0,0,0,0|0,0,0]=1 143 B8R1.2 OC[C@H]1CNCCN1 SC-72401 [0,1,0,0,0,0|1,0,0]=2 144 B8R1.2 OC[C@H]1CNCCO1 SC-14658 [0,1,0,0,0,0|2,0,0]=3 145 B8R1.2 OC[C@H]1CNCCO1 SC-93221 [0,1,0,0,0,0|2,0,0]=3 146 B8R1.2 OC[C@H]1COCCO1 SC-A2546 [0,1,0,0,0,0|2,0,0]=3 147 B8R1.2 ONC1CCCCC1 SC-A3793 [0,1,0,0,0,0|2,0,0]=3 148 B8R1.3 CC1=CCC(=O)CC1 SC-25236 [0,1,0,0,0,0|1,0,2]=4 149 B8R1.3 CC1=CCC(=O)CC1 SC-83877 [0,1,0,0,0,0|1,0,2]=4 150 B8R1.3 CC1CCC(N)CC1 SC-15967 [0,1,0,0,0,0|1,0,0]=2 151 B8R1.3 CC1CCC(N)CC1 SC-54542 [0,1,0,0,0,0|1,0,0]=2 152 B8R1.3 CN1CCC(=O)CC1 SC-01124 [0,1,0,0,0,0|2,0,1]=4 153 B8R1.3 CN1CCC(=O)CC1 SC-90211 [0,1,0,0,0,0|2,0,1]=4 154 B8R1.3 CN1CCC(Br)CC1 SC-24214 [0,1,0,0,0,0|2,0,0]=3 155 B8R1.3 CN1CCC(Cl)CC1 SC-05324 [0,1,0,0,0,0|2,0,0]=3 156 B8R1.3 C[C@H]1CN[C@H](C)CO1 SC-42238 [0,1,0,0,0,0|1,0,0]=2 157 B8R1.3 NC1CCC(=O)CC1 SC-51421 [0,1,0,0,0,0|2,0,1]=4 158 B8R1.3 NC1CCC(=O)CC1 SC-94303 [0,1,0,0,0,0|2,0,1]=4 159 B8R1.3 NC1CCC(O)CC1 SC-26489 [0,1,0,0,0,0|2,0,0]=3 160 B8R1.3 NC1CCC(O)CC1 SC-43558 [0,1,0,0,0,0|2,0,0]=3 161 B8R1.3 NC1CCC(O)CC1 SC-45530 [0,1,0,0,0,0|2,0,0]=3 162 B8R1.3 N[C@H]1CCC(=O)NC1 SC-A3084 [0,1,0,0,0,0|1,0,1]=3 163 B8R1.3 N[C@H]1CC[C@H](O)CC1 SC-03065 [0,1,0,0,0,0|2,0,0]=3 164 B8R1.3 N[C@H]1CC[C@H](O)CC1 SC-21292 [0,1,0,0,0,0|2,0,0]=3 165 B8R1.3 O=C1CCC(=O)NC1 SC-35404 [0,1,0,0,0,0|1,0,2]=4 166 B8R1.3 O=C1CCC(O)CC1 SC-22101 [0,1,0,0,0,0|2,0,1]=4 167 B8R1.3 O=C1CCC(O)CN1 SC-14920 [0,1,0,0,0,0|1,0,1]=3 168 B8R1.3 OC1CCC(O)CC1 SC-22723 [0,1,0,0,0,0|2,0,0]=3 169 B8R1.3 OC1COC(O)CO1 SC-52694 [0,1,0,0,0,0|3,0,0]=4 170 B8R1.3 OC1CSC(O)CS1 SC-22410 [0,1,0,0,0,0|3,0,0]=4 171 B8R1.3 O[C@H]1CC[C@H](O)CC1 SC-51814 [0,1,0,0,0,0|2,0,0]=3 172 B8R1.4 CC1CC(=O)CCN1 SC-14913 [0,1,0,0,0,0|0,0,1]=2 173 B8R1.4 CC1CC(=O)CCN1 SC-26346 [0,1,0,0,0,0|0,0,1]=2 174 B8R1.4 CC1CC(=O)CCO1 SC-43658 [0,1,0,0,0,0|1,0,1]=3 175 B8R1.4 CC1CC(O)CCO1 SC-15639 [0,1,0,0,0,0|1,0,0]=2 176 B8R1.4 CC1CCCC(=O)N1 SC-90092 [0,1,0,0,0,0|0,0,1]=2 177 B8R1.4 CC1CCNC(=O)C1 SC-65553 [0,1,0,0,0,0|1,0,1]=3 178 B8R1.4 CC1CCNC(C)C1 SC-05916 [0,1,0,0,0,0|0,0,0]=1 179 B8R1.4 CC1CN(C)CCN1 SC-93123 [0,1,0,0,0,0|1,0,0]=2 180 B8R1.4 CC1CNCC(=O)N1 SC-68745 [0,1,0,0,0,0|1,0,1]=3 181 B8R1.4 CC1CNCC(C)N1 SC-00302 [0,1,0,0,0,0|1,0,0]=2 182 B8R1.4 CC1COCC(C)N1 SC-87916 [0,1,0,0,0,0|1,0,0]=2 183 B8R1.4 CC1COCC(C)N1 SC-91963 [0,1,0,0,0,0|1,0,0]=2 184 B8R1.4 CN1CCCC(=O)C1 SC-88063 [0,1,0,0,0,0|2,0,1]=4 185 B8R1.4 CN1CCNC(=O)C1 SC-43594 [0,1,0,0,0,0|2,0,1]=4 186 B8R1.4 C[C@@H]1CNC[C@@H](C)O1 SC-53240 [0,1,0,0,0,0|2,0,0]=3 187 B8R1.4 C[C@H]1CN(C)CCN1 SC-A3639 [0,1,0,0,0,0|1,0,0]=2 188 B8R1.4 C[C@H]1CNC[C@@H](C)N1 SC-94350 [0,1,0,0,0,0|1,0,0]=2 189 B8R1.4 C[C@H]1CNC[C@@H](C)O1 SC-15727 [0,1,0,0,0,0|2,0,0]=3 190 B8R1.4 C[C@H]1CNC[C@H](C)O1 SC-50936 [0,1,0,0,0,0|2,0,0]=3 191 B8R1.4 C[C@H]1COCC(=O)N1 SC-82343 [0,1,0,0,0,0|1,0,1]=3 192 B8R1.4 C[C@H]1COC[C@H](C)N1 SC-67152 [0,1,0,0,0,0|1,0,0]=2 193 B8R1.4 NC1CCCC(O)C1 SC-19361 [0,1,0,0,0,0|2,0,0]=3 194 B8R1.4 N[C@@H]1CCC[C@@H](O)C1 SC-43595 [0,1,0,0,0,0|2,0,0]=3 195 B8R1.4 N[C@@H]1CCC[C@@H](O)C1 SC-47974 [0,1,0,0,0,0|2,0,0]=3 196 B8R1.4 N[C@@H]1CCC[C@H](O)C1 SC-43598 [0,1,0,0,0,0|2,0,0]=3 197 B8R1.4 N[C@H]1CCC[C@@H](N)C1 SC-A2329 [0,1,0,0,0,0|2,0,0]=3 198 B8R1.4 N[C@H]1CCC[C@@H](O)C1 SC-12531 [0,1,0,0,0,0|2,0,0]=3 199 B8R1.4 N[C@H]1CCC[C@@H](O)C1 SC-43597 [0,1,0,0,0,0|2,0,0]=3 200 B8R1.4 O=C1CC(O)CCN1 SC-14921 [0,1,0,0,0,0|1,0,1]=3 201 B8R1.4 O=C1CC(O)CCN1 SC-26449 [0,1,0,0,0,0|1,0,1]=3 202 B8R1.4 O=C1CCCC(=O)N1 SC-65454 [0,1,0,0,0,0|1,0,2]=4 203 B8R1.4 O=C1CCCC(O)C1 SC-52929 [0,1,0,0,0,0|2,0,1]=4 204 B8R1.5 CC1CCCCC1=O SC-20428 [0,1,0,0,0,0|1,0,0]=2 205 B8R1.5 CC1CCCNC1C SC-57854 [0,1,0,0,0,0|0,0,0]=1 206 B8R1.5 CC1CNCCN1C SC-02882 [0,1,0,0,0,0|1,0,0]=2 207 B8R1.5 C[C@H]1NCCNC1=O SC-05130 [0,1,0,0,0,0|1,0,1]=3 208 B8R1.5 NC1CCCCC1=O SC-22252 [0,1,0,0,0,0|2,0,0]=3 209 B8R1.5 NC1CCCCC1=O SC-84826 [0,1,0,0,0,0|2,0,0]=3 210 B8R1.5 NC1CCCCC1N SC-02306 [0,1,0,0,0,0|2,0,0]=3 211 B8R1.5 NC1CCCCC1O SC-45073 [0,1,0,0,0,0|2,0,0]=3 212 B8R1.5 NC1CCCC[C@@H]1O SC-44498 [0,1,0,0,0,0|2,0,0]=3 213 B8R1.5 NC1CCCNC1=O SC-14514 [0,1,0,0,0,0|1,0,1]=3 214 B8R1.5 NC1CCNCC1O SC-97873 [0,1,0,0,0,0|3,0,0]=4 215 B8R1.5 N[C@@H]1CCCC[C@H]1N SC-17287 [0,1,0,0,0,0|2,0,0]=3 216 B8R1.5 N[C@@H]1CCCC[C@H]1O SC-15016 [0,1,0,0,0,0|2,0,0]=3 217 B8R1.5 N[C@@H]1CCCC[C@H]1O SC-26535 [0,1,0,0,0,0|2,0,0]=3 218 B8R1.5 N[C@@H]1CCCNC1=O SC-48796 [0,1,0,0,0,0|1,0,1]=3 219 B8R1.5 N[C@@H]1COCC[C@H]1O SC-20565 [0,1,0,0,0,0|3,0,0]=4 220 B8R1.5 N[C@H]1CCCC[C@@H]1N SC-02456 [0,1,0,0,0,0|2,0,0]=3 221 B8R1.5 N[C@H]1CCCC[C@@H]1O SC-26530 [0,1,0,0,0,0|2,0,0]=3 222 B8R1.5 N[C@H]1CCCC[C@H]1O SC-26560 [0,1,0,0,0,0|2,0,0]=3 223 B8R1.5 N[C@H]1CCCC[C@H]1O SC-35500 [0,1,0,0,0,0|2,0,0]=3 224 B8R1.5 N[C@H]1CCCC[C@H]1O SC-70916 [0,1,0,0,0,0|2,0,0]=3 225 B8R1.5 N[C@H]1CCCC[C@H]1O SC-99850 [0,1,0,0,0,0|2,0,0]=3 226 B8R1.5 N[C@H]1CCCNC1=O SC-27263 [0,1,0,0,0,0|1,0,1]=3 227 B8R1.5 O=C1CCCCC1=O SC-46435 [0,1,0,0,0,0|2,0,1]=4 228 B8R1.5 O=C1CCCCC1Br SC-86496 [0,1,0,0,0,0|2,0,0]=3 229 B8R1.5 O=C1CCCCC1Cl SC-20977 [0,1,0,0,0,0|2,0,0]=3 230 B8R1.5 O=C1CCCCC1O SC-49144 [0,1,0,0,0,0|2,0,0]=3 231 B8R1.5 O=C1CCNCC1Br SC-94331 [0,1,0,0,0,0|3,0,0]=4 232 B8R1.5 O=C1CCOCC1Br SC-33711 [0,1,0,0,0,0|3,0,0]=4 233 B8R1.5 O=C1NCCCC1O SC-14922 [0,1,0,0,0,0|1,0,1]=3 234 B8R1.5 O[C@@H]1CCCC[C@H]1O SC-20091 [0,1,0,0,0,0|2,0,0]=3 235 B8R1.5 O[C@H]1CCCC[C@H]1O SC-95524 [0,1,0,0,0,0|2,0,0]=3 236 B8R1.5 [C@@H]1(N)CCCC[C@H]1N SC-26625 [0,1,0,0,0,0|2,0,0]=3 237 B8R1.5 [C@H]1(N)CCCC[C@H]1N SC-45540 [0,1,0,0,0,0|2,0,0]=3 238 B8R1.72 CC1(C)CCCNC1 SC-A4757 [0,1,0,0,0,0|2,0,0]=3 239 B8R1.72 CC1(C)CNCCN1 SC-28617 [0,1,0,0,0,0|1,0,0]=2 240 B8R1.72 CC1(C)CNCCO1 SC-61844 [0,1,0,0,0,0|2,0,0]=3 241 B8R1.72 CC1(C)CNCCO1 SC-68994 [0,1,0,0,0,0|2,0,0]=3 242 B8R1.72 CC1(N)CCNCC1 SC-72271 [0,1,0,0,0,0|2,0,0]=3 243 B8R1.72 CC1(O)CCCCC1 SC-44648 [0,1,0,0,0,0|1,0,0]=2 244 B8R1.72 C[N+]1([O-])CCOCC1 SC-18301 [0,1,0,0,0,0|3,0,0]=4 245 B8R1.72 C[N+]1([O-])CCOCC1 SC-20032 [0,1,0,0,0,0|3,0,0]=4 246 B8R1.72 C[N+]1([O-])CCOCC1 SC-27550 [0,1,0,0,0,0|3,0,0]=4 247 B8R1.72 C[Si]1(C)CCNCC1 SC-B7755 [0,1,0,0,0,0|2,1,0]=4 248 B8R1.72 FC1(F)CCCCC1 SC-88951 [0,1,0,0,0,0|2,0,0]=3 249 B8R1.72 FC1(F)CCCNC1 SC-04828 [0,1,0,0,0,0|3,0,0]=4 250 B8R1.72 FC1(F)CCCNC1 SC-91906 [0,1,0,0,0,0|3,0,0]=4 251 B8R1.72 FC1(F)CCNCC1 SC-43924 [0,1,0,0,0,0|3,0,0]=4 252 B8R1.72 FC1(F)CCNCC1 SC-48150 [0,1,0,0,0,0|3,0,0]=4 253 B8R1.72 O=S1(=O)CCCCN1 SC-48177 [0,1,0,0,0,0|2,0,0]=3 254 B8R1.72 O=S1(=O)CCCCO1 SC-15335 [0,1,0,0,0,0|3,0,0]=4 255 B6R0.1 CC[C@@H](N)COC SC-65714 [0,0,1,0,0,0|3,0,0]=4 256 B6R0.1 CC[C@H](N)COC SC-89974 [0,0,1,0,0,0|3,0,0]=4 257 B6R0.4 C=C(C)CNCC SC-47240 [0,0,1,0,0,0|2,0,1]=4 258 B6R0.4 CC(=O)CCCBr SC-91341 [0,0,1,0,0,0|2,0,1]=4 259 B6R0.4 CC(=O)NCCN SC-19651 [0,0,1,0,0,0|2,0,1]=4 260 B6R0.4 CC(C)NCCCl SC-96276 [0,0,1,0,0,0|1,0,0]=2 261 B6R0.4 CC(C)OCCBr SC-50384 [0,0,1,0,0,0|2,0,0]=3 262 B6R0.4 CCCCC(=O)Cl SC-46867 [0,0,1,0,0,0|2,0,1]=4 263 B6R0.4 CN(C)CCCBr SC-12824 [0,0,1,0,0,0|3,0,0]=4 264 B6R0.4 CN(C)CCCBr SC-48972 [0,0,1,0,0,0|3,0,0]=4 265 B6R0.4 CN(C)CCCCl SC-18516 [0,0,1,0,0,0|3,0,0]=4 266 B6R0.4 CN(C)CCCCl SC-53120 [0,0,1,0,0,0|3,0,0]=4 267 B6R0.4 CNCCN(C)C SC-29103 [0,0,1,0,0,0|3,0,0]=4 268 B6R0.4 COCCN(C)C SC-21743 [0,0,1,0,0,0|3,0,0]=4 269 B6R0.6 BrCCCCCBr SC-00350 [0,0,1,0,0,0|2,0,0]=3 270 B6R0.6 BrCCOCCBr SC-13704 [0,0,1,0,0,0|3,0,0]=4 271 B6R0.6 C#CCCCCN SC-A3767 [0,0,1,0,0,0|0,0,2]=3 272 B6R0.6 C#CCCCCO SC-87514 [0,0,1,0,0,0|1,0,2]=4 273 B6R0.6 C=CCCCCBr SC-27023 [0,0,1,0,0,0|1,0,2]=4 274 B6R0.6 CCCCCNC SC-25672 [0,0,1,0,0,0|2,0,0]=3 275 B6R0.6 CCCCON=O SC-70750 [0,0,1,0,0,0|3,0,0]=4 276 B6R0.6 CCOCCCO SC-00354 [0,0,1,0,0,0|2,0,0]=3 277 B6R0.6 CNCCCCO SC-13108 [0,0,1,0,0,0|2,0,0]=3 278 B6R0.6 CNCCCNC SC-47576 [0,0,1,0,0,0|3,0,0]=4 279 B6R0.6 CNCCCOC SC-51293 [0,0,1,0,0,0|3,0,0]=4 280 B6R0.6 COCCCCCl SC-01876 [0,0,1,0,0,0|2,0,0]=3 281 B6R0.6 COCCCOC SC-47077 [0,0,1,0,0,0|3,0,0]=4 282 B6R0.6 COCCOCCl SC-75748 [0,0,1,0,0,0|3,0,0]=4 283 B6R0.6 C\C=C\CCCO SC-48265 [0,0,1,0,0,0|1,0,2]=4 284 B6R0.6 ClCCNCCCl SC-18181 [0,0,1,0,0,0|3,0,0]=4 285 B6R0.6 ClCCNCCCl SC-52401 [0,0,1,0,0,0|3,0,0]=4 286 B6R0.6 FCCCCCBr SC-45318 [0,0,1,0,0,0|2,0,0]=3 287 B6R0.6 ICCCCCI SC-82357 [0,0,1,0,0,0|2,0,0]=3 288 B6R0.6 N#CCCCCCl SC-16304 [0,0,1,0,0,0|1,0,2]=4 289 B6R0.6 NCCCCCN SC-35536 [0,0,1,0,0,0|1,0,0]=2 290 B6R0.6 NCCCCCO SC-20467 [0,0,1,0,0,0|1,0,0]=2 291 B6R0.6 NCCNCCO SC-66587 [0,0,1,0,0,0|2,0,0]=3 292 B6R0.6 NCCOCCN SC-87302 [0,0,1,0,0,0|2,0,0]=3 293 B6R0.6 NCCOCCN SC-93964 [0,0,1,0,0,0|2,0,0]=3 294 B6R0.6 NCCOCCO SC-49862 [0,0,1,0,0,0|2,0,0]=3 295 B6R0.6 O=CCCCCCl SC-A3300 [0,0,1,0,0,0|2,0,1]=4 296 B6R0.6 OCCCCCBr SC-43699 [0,0,1,0,0,0|2,0,0]=3 297 B6R0.6 OCCCCCO SC-69222 [0,0,1,0,0,0|2,0,0]=3 298 B6R0.6 OCCOCCO SC-79348 [0,0,1,0,0,0|3,0,0]=4 299 B8R2.11 NC1C2CNCC12 SC-89870 [0,0,0,1,0,0|3,0,0]=4 300 B8R2.23 C1NCC2CC1O2 SC-51309 [0,0,0,1,0,0|2,0,0]=3 301 B8R2.23 C1NCC2CC1O2 SC-B3877 [0,0,0,1,0,0|2,0,0]=3 302 B8R2.23 C1OCC2CC1N2 SC-A2549 [0,0,0,1,0,0|1,0,0]=2 303 B8R2.34 C1=CC2CCC1C2 SC-49283 [0,0,0,1,0,0|1,0,1]=3 304 B8R2.34 C1CC2CC1CN2 SC-67774 [0,0,0,1,0,0|0,0,0]=1 305 B8R2.34 C1CC2CC1CN2 SC-A4189 [0,0,0,1,0,0|0,0,0]=1 306 B8R2.34 C1CC2CCC1N2 SC-70696 [0,0,0,1,0,0|2,0,0]=3 307 B8R2.34 C1NC2CNC1C2 SC-91646 [0,0,0,1,0,0|1,0,0]=2 308 B8R2.34 C1O[C@@H]2CN[C@H]1C2 SC-35864 [0,0,0,1,0,0|1,0,0]=2 309 B8R2.34 [C@@H]12CO[C@@H](CN1)C2 SC-51029 [0,0,0,1,0,0|1,0,0]=2 310 B8R2.34 [C@H]12CNC(CN1)C2 SC-21345 [0,0,0,1,0,0|1,0,0]=2 311 B8R2.34 [C@H]12CO[C@H](CN1)C2 SC-48245 [0,0,0,1,0,0|1,0,0]=2 312 B6R1.2 BrC1CCNC1 SC-24702 [0,0,0,0,1,0|2,0,0]=3 313 B6R1.2 BrC1CCOC1 SC-49709 [0,0,0,0,1,0|2,0,0]=3 314 B6R1.2 CC1=CCCC1 SC-46849 [0,0,0,0,1,0|0,0,2]=3 315 B6R1.2 CC1=CCCO1 SC-69814 [0,0,0,0,1,0|1,0,2]=4 316 B6R1.2 CC1=NCCC1 SC-07079 [0,0,0,0,1,0|0,0,2]=3 317 B6R1.2 CC1CCCN1 SC-89376 [0,0,0,0,1,0|0,0,0]=1 318 B6R1.2 CC1CCCN1 SC-A3822 [0,0,0,0,1,0|0,0,0]=1 319 B6R1.2 CC1CCNC1 SC-24125 [0,0,0,0,1,0|1,0,0]=2 320 B6R1.2 CC1CCNC1 SC-49333 [0,0,0,0,1,0|1,0,0]=2 321 B6R1.2 CN1CCCC1 SC-19022 [0,0,0,0,1,0|1,0,0]=2 322 B6R1.2 C[C@@H]1CCNC1 SC-23714 [0,0,0,0,1,0|1,0,0]=2 323 B6R1.2 C[C@@H]1CCNC1 SC-50232 [0,0,0,0,1,0|1,0,0]=2 324 B6R1.2 C[C@H]1CCCN1 SC-95860 [0,0,0,0,1,0|0,0,0]=1 325 B6R1.2 C[C@H]1CCNC1 SC-50233 [0,0,0,0,1,0|1,0,0]=2 326 B6R1.2 FC1CCCC1 SC-09548 [0,0,0,0,1,0|1,0,0]=2 327 B6R1.2 FC1CCNC1 SC-28940 [0,0,0,0,1,0|2,0,0]=3 328 B6R1.2 F[C@H]1CCNC1 SC-43922 [0,0,0,0,1,0|2,0,0]=3 329 B6R1.2 NC1=NCCC1 SC-68430 [0,0,0,0,1,0|1,0,2]=4 330 B6R1.2 NC1CC=CC1 SC-21605 [0,0,0,0,1,0|1,0,2]=4 331 B6R1.2 NC1CCCC1 SC-84758 [0,0,0,0,1,0|1,0,0]=2 332 B6R1.2 NC1CCNC1 SC-18208 [0,0,0,0,1,0|2,0,0]=3 333 B6R1.2 NC1CCNC1 SC-62350 [0,0,0,0,1,0|2,0,0]=3 334 B6R1.2 NC1CCOC1 SC-12746 [0,0,0,0,1,0|2,0,0]=3 335 B6R1.2 NC1CCOC1 SC-35465 [0,0,0,0,1,0|2,0,0]=3 336 B6R1.2 NN1CCCC1 SC-01559 [0,0,0,0,1,0|2,0,0]=3 337 B6R1.2 NN1CCCC1 SC-65336 [0,0,0,0,1,0|2,0,0]=3 338 B6R1.2 N[C@@H]1CCOC1 SC-14942 [0,0,0,0,1,0|2,0,0]=3 339 B6R1.2 N[C@@H]1CCOC1 SC-26567 [0,0,0,0,1,0|2,0,0]=3 340 B6R1.2 N[C@H]1CCOC1 SC-14943 [0,0,0,0,1,0|2,0,0]=3 341 B6R1.2 O=C1CCCN1 SC-85210 [0,0,0,0,1,0|1,0,1]=3 342 B6R1.2 O=C1CCNC1 SC-24328 [0,0,0,0,1,0|2,0,1]=4 343 B6R1.2 O=C1CCNC1 SC-50749 [0,0,0,0,1,0|2,0,1]=4 344 B6R1.2 O=C1CCNN1 SC-21405 [0,0,0,0,1,0|2,0,1]=4 345 B6R1.2 O=C1CCOC1 SC-21867 [0,0,0,0,1,0|2,0,1]=4 346 B6R1.2 O=C1NCCO1 SC-04833 [0,0,0,0,1,0|2,0,1]=4 347 B6R1.2 O=C1NCCS1 SC-27050 [0,0,0,0,1,0|2,0,1]=4 348 B6R1.2 OC1CC=CC1 SC-22908 [0,0,0,0,1,0|1,0,2]=4 349 B6R1.2 OC1CCCN1 SC-21341 [0,0,0,0,1,0|1,0,0]=2 350 B6R1.2 OC1CCNC1 SC-00623 [0,0,0,0,1,0|2,0,0]=3 351 B6R1.2 OC1CCNC1 SC-19629 [0,0,0,0,1,0|2,0,0]=3 352 B6R1.2 OC1CCNC1 SC-24957 [0,0,0,0,1,0|2,0,0]=3 353 B6R1.2 OC1CCNC1 SC-27708 [0,0,0,0,1,0|2,0,0]=3 354 B6R1.2 OC1CCOC1 SC-17875 [0,0,0,0,1,0|2,0,0]=3 355 B6R1.2 O[C@@H]1CCNC1 SC-00194 [0,0,0,0,1,0|2,0,0]=3 356 B6R1.2 O[C@@H]1CCNC1 SC-13984 [0,0,0,0,1,0|2,0,0]=3 357 B6R1.2 O[C@@H]1CCOC1 SC-07022 [0,0,0,0,1,0|2,0,0]=3 358 B6R1.2 O[C@@H]1CNOC1 SC-83248 [0,0,0,0,1,0|3,0,0]=4 359 B6R1.2 O[C@H]1CCOC1 SC-08982 [0,0,0,0,1,0|2,0,0]=3 360 B6R1.2 O[C@H]1CCOC1 SC-50082 [0,0,0,0,1,0|2,0,0]=3 361 B6R1.2 O[C@H]1CNOC1 SC-83247 [0,0,0,0,1,0|3,0,0]=4 362 B6R1.2 [C@@H]1(C)CCCN1 SC-48604 [0,0,0,0,1,0|0,0,0]=1 363 B6R1.2 [C@H]1(O)CCNC1 SC-24229 [0,0,0,0,1,0|2,0,0]=3 364 B8R1.22 CC1CCNCCN1 SC-52803 [0,0,0,0,0,1|0,0,0]=1 365 B8R1.22 CN1CCCNCC1 SC-19624 [0,0,0,0,0,1|2,0,0]=3 366 B8R1.22 NC1CCCCCC1 SC-51775 [0,0,0,0,0,1|2,0,0]=3 367 B8R1.22 NC1CCCCNC1 SC-A3641 [0,0,0,0,0,1|1,0,0]=2 368 B8R1.22 NC1CCCNCC1 SC-94792 [0,0,0,0,0,1|2,0,0]=3 369 B8R1.22 O=C1C=CCCCC1 SC-99582 [0,0,0,0,0,1|2,0,1]=4 370 B8R1.22 O=C1CCCNCC1 SC-20974 [0,0,0,0,0,1|2,0,1]=4 371 B8R1.22 O=C1CCCNCC1 SC-20993 [0,0,0,0,0,1|2,0,1]=4 372 B8R1.22 O=C1CCNCCN1 SC-05951 [0,0,0,0,0,1|1,0,1]=3 373 B8R1.22 O=C1CNCCCN1 SC-21981 [0,0,0,0,0,1|1,0,1]=3 374 B5R0.1 CC(N)CCO SC-82589 [1,0,1,0,0,0|1,0,0]=3 375 B5R0.1 CCCC(=N)N SC-19347 [1,0,1,0,0,0|1,0,1]=4 376 B5R0.1 CCCC(C)N SC-53929 [1,0,1,0,0,0|0,0,0]=2 377 B5R0.1 CCCC(C)O SC-03320 [1,0,1,0,0,0|1,0,0]=3 378 B5R0.1 CCCC(N)=O SC-46377 [1,0,1,0,0,0|1,0,1]=4 379 B5R0.1 CCNC(C)C SC-84122 [1,0,1,0,0,0|0,0,0]=2 380 B5R0.1 CN(C)CCBr SC-21756 [1,0,1,0,0,0|2,0,0]=4 381 B5R0.1 CN(C)CCBr SC-27529 [1,0,1,0,0,0|2,0,0]=4 382 B5R0.1 CN(C)CCCl SC-18600 [1,0,1,0,0,0|2,0,0]=4 383 B5R0.1 CN(C)CCCl SC-47184 [1,0,1,0,0,0|2,0,0]=4 384 B5R0.1 CN(C)CCO SC-87330 [1,0,1,0,0,0|2,0,0]=4 385 B5R0.1 COCC(C)N SC-48787 [1,0,1,0,0,0|1,0,0]=3 386 B5R0.1 COCC(C)O SC-00293 [1,0,1,0,0,0|2,0,0]=4 387 B5R0.1 COC[C@@H](C)N SC-47724 [1,0,1,0,0,0|1,0,0]=3 388 B5R0.1 COC[C@@H](C)O SC-04836 [1,0,1,0,0,0|2,0,0]=4 389 B5R0.1 C[C@@H](N)CCO SC-48293 [1,0,1,0,0,0|1,0,0]=3 390 B5R0.1 C[C@@H](O)CCO SC-05919 [1,0,1,0,0,0|2,0,0]=4 391 B5R0.1 C[C@H](O)CCO SC-02840 [1,0,1,0,0,0|2,0,0]=4 392 B5R0.2 C#CCCCN SC-48603 [1,0,1,0,0,0|0,0,2]=4 393 B5R0.2 C#CCCCN SC-99931 [1,0,1,0,0,0|0,0,2]=4 394 B5R0.2 C=CCCCN SC-28944 [1,0,1,0,0,0|0,0,2]=4 395 B5R0.2 CCCCNN SC-68008 [1,0,1,0,0,0|1,0,0]=3 396 B5R0.2 CCSCCCl SC-43710 [1,0,1,0,0,0|2,0,0]=4 397 B5R0.2 CNCCC#N SC-15494 [1,0,1,0,0,0|1,0,1]=4 398 B5R0.2 CNCCCO SC-94106 [1,0,1,0,0,0|1,0,0]=3 399 B5R0.2 CNCCNC SC-19090 [1,0,1,0,0,0|1,0,0]=3 400 B5R0.2 CNCCOC SC-15056 [1,0,1,0,0,0|1,0,0]=3 401 B5R0.2 CNCCSC SC-74374 [1,0,1,0,0,0|1,0,0]=3 402 B5R0.2 CNCCSC SC-83575 [1,0,1,0,0,0|1,0,0]=3 403 B5R0.2 COCCCBr SC-20920 [1,0,1,0,0,0|2,0,0]=4 404 B5R0.2 COCCNN SC-53129 [1,0,1,0,0,0|2,0,0]=4 405 B5R0.2 COCCNN SC-70814 [1,0,1,0,0,0|2,0,0]=4 406 B5R0.2 ClCCCCBr SC-17538 [1,0,1,0,0,0|2,0,0]=4 407 B5R0.2 FCCCCBr SC-43880 [1,0,1,0,0,0|2,0,0]=4 408 B5R0.2 ICCCCI SC-69402 [1,0,1,0,0,0|2,0,0]=4 409 B5R0.2 NCCCCCl SC-14246 [1,0,1,0,0,0|1,0,0]=3 410 B5R0.2 NCCCCN SC-20919 [1,0,1,0,0,0|1,0,0]=3 411 B5R0.2 NCCCCO SC-48186 [1,0,1,0,0,0|1,0,0]=3 412 B5R0.2 OCCCCBr SC-12645 [1,0,1,0,0,0|2,0,0]=4 413 B5R0.2 OCCCCCl SC-23109 [1,0,1,0,0,0|2,0,0]=4 414 B5R0.3 CC(CO)CBr SC-35572 [1,0,1,0,0,0|2,0,0]=4 415 B5R0.3 CCC(C)CO SC-08990 [1,0,1,0,0,0|1,0,0]=3 416 B5R0.3 CCC(N)CC SC-81736 [1,0,1,0,0,0|1,0,0]=3 417 B5R0.3 CCC(N)CO SC-21072 [1,0,1,0,0,0|2,0,0]=4 418 B5R0.3 CCC(O)CC SC-62307 [1,0,1,0,0,0|1,0,0]=3 419 B5R0.3 CC[PH](=O)CC SC-96905 [1,0,1,0,0,0|2,0,0]=4 420 B5R0.3 COC(C)CN SC-A4864 [1,0,1,0,0,0|2,0,0]=4 421 B5R0.3 CO[C@H](C)CO SC-71357 [1,0,1,0,0,0|2,0,0]=4 422 B5R0.3 [C@H](N)(CC)CO SC-08958 [1,0,1,0,0,0|2,0,0]=4 423 B7R0.3 CC(CCCO)NN SC-14213 [0,1,1,0,0,0|1,0,0]=3 424 B7R0.3 CCOCC(Cl)OC SC-94025 [0,1,1,0,0,0|2,0,0]=4 425 B7R0.3 CCSCC(C)NN SC-14211 [0,1,1,0,0,0|1,0,0]=3 426 B7R0.5 CCNC(=O)[C@H](C)O SC-12514 [0,1,1,0,0,0|1,0,1]=4 427 B7R0.7 CC(CCO)CCO SC-15062 [0,1,1,0,0,0|2,0,0]=4 428 B7R0.7 CCC[C@H](N)CCO SC-A3499 [0,1,1,0,0,0|2,0,0]=4 429 B7R0.7 CCOC(C)OCC SC-48313 [0,1,1,0,0,0|1,0,0]=3 430 B7R0.7 CCOC(C)OCC SC-76677 [0,1,1,0,0,0|1,0,0]=3 431 B7R0.10 CCC(Br)C(Br)CC SC-94097 [0,1,1,0,0,0|2,0,0]=4 432 B7R0.10 CC[C@H](C)[C@H](N)CO SC-08984 [0,1,1,0,0,0|2,0,0]=4 433 B7R0.10 CNC(C)C(=O)OC SC-82127 [0,1,1,0,0,0|1,0,1]=4 434 B7R0.10 CN[C@@H](C)C(=O)OC SC-84501 [0,1,1,0,0,0|1,0,1]=4 435 B7R0.11 CCCC(C)(Br)CBr SC-94098 [0,1,1,0,0,0|2,0,0]=4 436 B7R0.12 CNCC(OC)OC SC-26635 [0,1,1,0,0,0|2,0,0]=4 437 B7R0.12 COC(CCBr)OC SC-15080 [0,1,1,0,0,0|2,0,0]=4 438 B7R0.12 COCC(OC)OC SC-73556 [0,1,1,0,0,0|2,0,0]=4 439 B7R0.4 CNCCCN(C)C SC-95620 [0,1,1,0,0,0|2,0,0]=4 440 B7R0.4 NC(=O)CCCCBr SC-98143 [0,1,1,0,0,0|1,0,1]=4 441 B7R0.4 NCCCCC(N)=O SC-94858 [0,1,1,0,0,0|1,0,1]=4 442 B7R0.4 NCCCCC(N)=O SC-A4262 [0,1,1,0,0,0|1,0,1]=4 443 B7R0.6 CC(O)CCC(C)O SC-92842 [0,1,1,0,0,0|1,0,0]=3 444 B7R0.6 C[C@H](O)CC[C@H](C)O SC-03635 [0,1,1,0,0,0|1,0,0]=3 445 B7R0.8 CCNCC(C)(C)O SC-97759 [0,1,1,0,0,0|2,0,0]=4 446 B7R0.1 BrCCCCCCBr SC-05920 [0,1,1,0,0,0|1,0,0]=3 447 B7R0.1 C#CCCCCCCl SC-52143 [0,1,1,0,0,0|1,0,1]=4 448 B7R0.1 C#CCCCCCO SC-47536 [0,1,1,0,0,0|1,0,1]=4 449 B7R0.1 C=CCCCCCBr SC-44229 [0,1,1,0,0,0|1,0,1]=4 450 B7R0.1 CCCCCN=C=S SC-05979 [0,1,1,0,0,0|1,0,1]=4 451 B7R0.1 CCCCOCCCl SC-41513 [0,1,1,0,0,0|1,0,0]=3 452 B7R0.1 CCCCSCC#N SC-96134 [0,1,1,0,0,0|0,0,2]=4 453 B7R0.1 COCCOCCBr SC-82752 [0,1,1,0,0,0|2,0,0]=4 454 B7R0.1 ClCCCCCCBr SC-99457 [0,1,1,0,0,0|1,0,0]=3 455 B7R0.1 ClCCCCCCCl SC-26774 [0,1,1,0,0,0|1,0,0]=3 456 B7R0.1 ClCCCCCCI SC-51061 [0,1,1,0,0,0|1,0,0]=3 457 B7R0.1 NCCCCCCO SC-47381 [0,1,1,0,0,0|0,0,0]=2 458 B7R0.1 NCC[Se][Se]CCN SC-76208 [0,1,1,0,0,0|2,0,0]=4 459 B7R0.1 O=CCCCCCO SC-94633 [0,1,1,0,0,0|1,0,1]=4 460 B7R0.1 OCCCCCCBr SC-23167 [0,1,1,0,0,0|1,0,0]=3 461 B7R1.1 BrCC1CCCC1 SC-04017 [0,1,0,0,1,0|0,0,0]=2 462 B7R1.1 BrCC1CCCO1 SC-00526 [0,1,0,0,1,0|1,0,0]=3 463 B7R1.1 C#CC1CCCC1 SC-82441 [0,1,0,0,1,0|0,0,1]=3 464 B7R1.1 CCC1CCCN1 SC-29181 [0,1,0,0,1,0|0,0,0]=2 465 B7R1.1 CNC1CCCC1 SC-52894 [0,1,0,0,1,0|0,0,0]=2 466 B7R1.1 CNC1CCCC1 SC-A3381 [0,1,0,0,1,0|0,0,0]=2 467 B7R1.1 CNC1CCOC1 SC-81912 [0,1,0,0,1,0|1,0,0]=3 468 B7R1.1 CN[C@@H]1CCOC1 SC-A2281 [0,1,0,0,1,0|1,0,0]=3 469 B7R1.1 COC1=NCCC1 SC-72634 [0,1,0,0,1,0|0,0,2]=4 470 B7R1.1 COC1CCNC1 SC-12454 [0,1,0,0,1,0|1,0,0]=3 471 B7R1.1 COC1CCNC1 SC-24177 [0,1,0,0,1,0|1,0,0]=3 472 B7R1.1 CO[C@@H]1CCNC1 SC-25526 [0,1,0,0,1,0|1,0,0]=3 473 B7R1.1 CO[C@@H]1CCNC1 SC-51990 [0,1,0,0,1,0|1,0,0]=3 474 B7R1.1 CO[C@H]1CCNC1 SC-25506 [0,1,0,0,1,0|1,0,0]=3 475 B7R1.1 ICC1CCOC1 SC-26534 [0,1,0,0,1,0|1,0,0]=3 476 B7R1.1 N#CC1CCCC1 SC-84423 [0,1,0,0,1,0|0,0,1]=3 477 B7R1.1 N#CC1CCCN1 SC-70822 [0,1,0,0,1,0|0,0,1]=3 478 B7R1.1 N#CC1CCNC1 SC-88576 [0,1,0,0,1,0|1,0,1]=4 479 B7R1.1 N#CC1CCOC1 SC-28637 [0,1,0,0,1,0|1,0,1]=4 480 B7R1.1 N#C[C@H]1CCCN1 SC-72638 [0,1,0,0,1,0|0,0,1]=3 481 B7R1.1 N#C[C@H]1CCNC1 SC-B8851 [0,1,0,0,1,0|1,0,1]=4 482 B7R1.1 NCC1CCCC1 SC-22285 [0,1,0,0,1,0|0,0,0]=2 483 B7R1.1 NCC1CCCC1 SC-25234 [0,1,0,0,1,0|0,0,0]=2 484 B7R1.1 NCC1CCCN1 SC-98158 [0,1,0,0,1,0|0,0,0]=2 485 B7R1.1 NCC1CCOC1 SC-12415 [0,1,0,0,1,0|1,0,0]=3 486 B7R1.1 NC[C@@H]1CCCO1 SC-28608 [0,1,0,0,1,0|1,0,0]=3 487 B7R1.1 NNC1CCCC1 SC-12771 [0,1,0,0,1,0|1,0,0]=3 488 B7R1.1 NNC1CCCC1 SC-62645 [0,1,0,0,1,0|1,0,0]=3 489 B7R1.1 O=CC1CCCC1 SC-21778 [0,1,0,0,1,0|0,0,1]=3 490 B7R1.1 O=CC1CCCC1 SC-44728 [0,1,0,0,1,0|0,0,1]=3 491 B7R1.1 O=CC1CCNC1 SC-85271 [0,1,0,0,1,0|1,0,1]=4 492 B7R1.1 OCC1C=CCN1 SC-92889 [0,1,0,0,1,0|0,0,2]=4 493 B7R1.1 OCC1CC=CC1 SC-45771 [0,1,0,0,1,0|0,0,2]=4 494 B7R1.1 OCC1CCCC1 SC-03842 [0,1,0,0,1,0|0,0,0]=2 495 B7R1.1 OCC1CCCN1 SC-12006 [0,1,0,0,1,0|0,0,0]=2 496 B7R1.1 OCC1CCCO1 SC-94849 [0,1,0,0,1,0|1,0,0]=3 497 B7R1.1 OCC1CCOC1 SC-21250 [0,1,0,0,1,0|1,0,0]=3 498 B7R1.1 OC[C@@H]1CCCN1 SC-02696 [0,1,0,0,1,0|0,0,0]=2 499 B7R1.1 OC[C@@H]1CCCN1 SC-48321 [0,1,0,0,1,0|0,0,0]=2 500 B7R1.1 OC[C@@H]1CCCO1 SC-20330 [0,1,0,0,1,0|1,0,0]=3 501 B7R1.1 OC[C@@H]1CCNC1 SC-48002 [0,1,0,0,1,0|1,0,0]=3 502 B7R1.1 OC[C@H]1CCCN1 SC-06270 [0,1,0,0,1,0|0,0,0]=2 503 B7R1.2 CC1CCC(=O)C1 SC-93748 [0,1,0,0,1,0|0,0,1]=3 504 B7R1.2 CC1CNC(=O)C1 SC-50248 [0,1,0,0,1,0|1,0,1]=4 505 B7R1.2 CC1COC(=O)C1 SC-60836 [0,1,0,0,1,0|1,0,1]=4 506 B7R1.2 CN1CCC(N)C1 SC-48840 [0,1,0,0,1,0|1,0,0]=3 507 B7R1.2 CN1CC[C@@H](O)C1 SC-49684 [0,1,0,0,1,0|1,0,0]=3 508 B7R1.2 CN1CC[C@H](O)C1 SC-23905 [0,1,0,0,1,0|1,0,0]=3 509 B7R1.2 C[C@H]1COC(=O)N1 SC-51056 [0,1,0,0,1,0|1,0,1]=4 510 B7R1.2 NC1CCC(O)C1 SC-47773 [0,1,0,0,1,0|1,0,0]=3 511 B7R1.2 NC1CCC(O)C1 SC-47979 [0,1,0,0,1,0|1,0,0]=3 512 B7R1.2 NC1CCC(O)C1 SC-49660 [0,1,0,0,1,0|1,0,0]=3 513 B7R1.2 NC1CCC(O)C1 SC-51126 [0,1,0,0,1,0|1,0,0]=3 514 B7R1.2 NC1CCC(O)C1 SC-92977 [0,1,0,0,1,0|1,0,0]=3 515 B7R1.2 NC1CNC(=O)C1 SC-66063 [0,1,0,0,1,0|1,0,1]=4 516 B7R1.2 N[C@@H]1CC[C@H](O)C1 SC-83316 [0,1,0,0,1,0|1,0,0]=3 517 B7R1.2 N[C@@H]1CNC(=O)C1 SC-A4379 [0,1,0,0,1,0|1,0,1]=4 518 B7R1.2 N[C@H]1CC[C@@H](O)C1 SC-42369 [0,1,0,0,1,0|1,0,0]=3 519 B7R1.2 N[C@H]1CC[C@@H](O)C1 SC-47775 [0,1,0,0,1,0|1,0,0]=3 520 B7R1.2 N[C@H]1CC[C@H](O)C1 SC-47774 [0,1,0,0,1,0|1,0,0]=3 521 B7R1.2 N[C@H]1CC[C@H](O)C1 SC-93243 [0,1,0,0,1,0|1,0,0]=3 522 B7R1.2 O=C1CC(O)CN1 SC-29049 [0,1,0,0,1,0|1,0,1]=4 523 B7R1.2 O=C1C[C@@H](O)CN1 SC-02616 [0,1,0,0,1,0|1,0,1]=4 524 B7R1.2 O=C1C[C@H](O)CN1 SC-13587 [0,1,0,0,1,0|1,0,1]=4 525 B7R1.4 CC1CCCC1=O SC-89605 [0,1,0,0,1,0|0,0,1]=3 526 B7R1.4 CC1CCNC1=O SC-21672 [0,1,0,0,1,0|1,0,1]=4 527 B7R1.4 CC1CCOC1=O SC-20996 [0,1,0,0,1,0|1,0,1]=4 528 B7R1.4 F[C@@H]1CNC[C@H]1F SC-89287 [0,1,0,0,1,0|2,0,0]=4 529 B7R1.4 NC1CCCC1O SC-21764 [0,1,0,0,1,0|1,0,0]=3 530 B7R1.4 NC1CCNC1=O SC-13910 [0,1,0,0,1,0|1,0,1]=4 531 B7R1.4 NC1CCNC1=O SC-53072 [0,1,0,0,1,0|1,0,1]=4 532 B7R1.4 N[C@@H]1CCNC1=O SC-65959 [0,1,0,0,1,0|1,0,1]=4 533 B7R1.4 N[C@@H]1CCNC1=O SC-A2225 [0,1,0,0,1,0|1,0,1]=4 534 B7R1.4 N[C@@H]1COC[C@@H]1N SC-33569 [0,1,0,0,1,0|2,0,0]=4 535 B7R1.4 N[C@H]1CCC[C@@H]1O SC-27686 [0,1,0,0,1,0|1,0,0]=3 536 B7R1.4 N[C@H]1CCC[C@H]1N SC-83490 [0,1,0,0,1,0|1,0,0]=3 537 B7R1.4 N[C@H]1CCNC1=O SC-96457 [0,1,0,0,1,0|1,0,1]=4 538 B7R1.4 N[C@H]1COC[C@@H]1O SC-44041 [0,1,0,0,1,0|2,0,0]=4 539 B7R1.4 O=C1CCCC1Cl SC-21538 [0,1,0,0,1,0|1,0,1]=4 540 B7R1.4 O=C1NCCC1O SC-26159 [0,1,0,0,1,0|1,0,1]=4 541 B7R1.4 O=C1NCC[C@H]1O SC-87526 [0,1,0,0,1,0|1,0,1]=4 542 B7R1.4 O[C@@H]1CCC[C@H]1O SC-A2623 [0,1,0,0,1,0|1,0,0]=3 543 B7R1.4 [C@@H]1(N)CCC[C@H]1O SC-16146 [0,1,0,0,1,0|1,0,0]=3 544 B7R1.4 [C@H]1(N)CCC[C@H]1O SC-25435 [0,1,0,0,1,0|1,0,0]=3 545 B7R1.14 CC1(C)CCCN1 SC-89406 [0,1,0,0,1,0|0,0,0]=2 546 B7R1.14 CC1(C)CCNC1 SC-B8345 [0,1,0,0,1,0|1,0,0]=3 547 B7R1.14 CC1(C)COCN1 SC-A4039 [0,1,0,0,1,0|1,0,0]=3 548 B7R1.14 CC1(C)NCCS1 SC-13595 [0,1,0,0,1,0|1,0,0]=3 549 B7R1.14 CC1(O)CCNC1 SC-65706 [0,1,0,0,1,0|1,0,0]=3 550 B7R1.14 C[C@]1(O)CCNC1 SC-91785 [0,1,0,0,1,0|1,0,0]=3 551 B7R1.14 ClC1(Cl)CCCC1 SC-51368 [0,1,0,0,1,0|1,0,0]=3 552 B7R1.14 FC1(F)CCNC1 SC-01510 [0,1,0,0,1,0|2,0,0]=4 553 B7R1.14 FC1(F)CCNC1 SC-85141 [0,1,0,0,1,0|2,0,0]=4 554 B7R1.14 O=S1(=O)CCCC1 SC-46369 [0,1,0,0,1,0|2,0,0]=4 555 B7R1.14 O=S1(=O)CCCN1 SC-82164 [0,1,0,0,1,0|2,0,0]=4 556 B9R1.5 OC1CCCCCC1O SC-45470 [0,1,0,0,0,1|2,0,0]=4 557 B9R1.49 CN1CCCC(=O)CC1 SC-01972 [0,1,0,0,0,1|2,0,0]=4 558 B9R1.148 CC1(C)CNCCNC1 SC-91930 [0,1,0,0,0,1|1,0,0]=3 559 B9R1.148 FC1(F)CCCCCC1 SC-88944 [0,1,0,0,0,1|2,0,0]=4 560 B9R1.1 CC1CCC(CO)CN1 SC-A2864 [0,2,0,0,0,0|0,0,0]=2 561 B9R1.1 CCN1CCC(O)CC1 SC-18669 [0,2,0,0,0,0|2,0,0]=4 562 B9R1.1 CN1CCC(C#N)CC1 SC-25157 [0,2,0,0,0,0|2,0,0]=4 563 B9R1.1 CN1CCC(NN)CC1 SC-12829 [0,2,0,0,0,0|2,0,0]=4 564 B9R1.1 CNC1CCC(=O)CC1 SC-92932 [0,2,0,0,0,0|1,0,1]=4 565 B9R1.1 CNC1CCC(O)CC1 SC-84448 [0,2,0,0,0,0|1,0,0]=3 566 B9R1.1 CNC1CCN(C)CC1 SC-21253 [0,2,0,0,0,0|2,0,0]=4 567 B9R1.1 COC1CCC(=O)CC1 SC-51182 [0,2,0,0,0,0|1,0,1]=4 568 B9R1.1 COC1CCC(N)CC1 SC-47584 [0,2,0,0,0,0|1,0,0]=3 569 B9R1.1 COC1CCC(N)CC1 SC-47593 [0,2,0,0,0,0|1,0,0]=3 570 B9R1.1 COC1CCC(N)CC1 SC-96500 [0,2,0,0,0,0|1,0,0]=3 571 B9R1.1 COC1CCC(N)CC1 SC-98601 [0,2,0,0,0,0|1,0,0]=3 572 B9R1.1 COC1CCC(O)CC1 SC-52814 [0,2,0,0,0,0|1,0,0]=3 573 B9R1.1 CO[C@H]1CC[C@@H](N)CC1 SC-88965 [0,2,0,0,0,0|1,0,0]=3 574 B9R1.1 NC1CCC(CO)CC1 SC-47767 [0,2,0,0,0,0|1,0,0]=3 575 B9R1.1 NC1CCC(CO)CC1 SC-47772 [0,2,0,0,0,0|1,0,0]=3 576 B9R1.1 NCC1CCC(=O)NC1 SC-A2876 [0,2,0,0,0,0|1,0,1]=4 577 B9R1.1 NC[C@H]1CC[C@@H](O)CC1 SC-B7291 [0,2,0,0,0,0|1,0,0]=3 578 B9R1.1 O=C1CCC(CO)CC1 SC-66212 [0,2,0,0,0,0|1,0,1]=4 579 B9R1.2 CCC1CC(=O)CCN1 SC-35111 [0,2,0,0,0,0|0,0,1]=3 580 B9R1.2 CCN1CCCC(N)C1 SC-83319 [0,2,0,0,0,0|2,0,0]=4 581 B9R1.2 CCN1CCN[C@H](C)C1 SC-94381 [0,2,0,0,0,0|1,0,0]=3 582 B9R1.2 CCN1CCN[C@H](C)C1 SC-95248 [0,2,0,0,0,0|1,0,0]=3 583 B9R1.2 CN1CCOC(CN)C1 SC-71487 [0,2,0,0,0,0|2,0,0]=4 584 B9R1.2 O=C1CCCC(CO)N1 SC-21439 [0,2,0,0,0,0|0,0,1]=3 585 B9R1.6 CC(=O)C1CCNCC1 SC-48315 [0,2,0,0,0,0|2,0,0]=4 586 B9R1.6 CC(=O)C1CCOCC1 SC-66039 [0,2,0,0,0,0|2,0,0]=4 587 B9R1.6 CC(C)C1COCCN1 SC-14189 [0,2,0,0,0,0|1,0,0]=3 588 B9R1.6 CC(O)C1CCCCC1 SC-22092 [0,2,0,0,0,0|1,0,0]=3 589 B9R1.6 CN(C)C1CCNCC1 SC-04881 [0,2,0,0,0,0|2,0,0]=4 590 B9R1.6 CN(C)C1CCNCC1 SC-25499 [0,2,0,0,0,0|2,0,0]=4 591 B9R1.6 O=C(Cl)C1CCCCC1 SC-22783 [0,2,0,0,0,0|1,0,1]=4 592 B9R1.6 O=C(O)C1CCCCC1 SC-22688 [0,2,0,0,0,0|1,0,1]=4 593 B9R1.6 O=C(O)C1CCCCN1 SC-03317 [0,2,0,0,0,0|0,0,1]=3 594 B9R1.6 O=C(O)C1CCCCN1 SC-04307 [0,2,0,0,0,0|0,0,1]=3 595 B9R1.6 O=C(O)C1CCCCN1 SC-05144 [0,2,0,0,0,0|0,0,1]=3 596 B9R1.6 O=C(O)C1CCCCO1 SC-27357 [0,2,0,0,0,0|1,0,1]=4 597 B9R1.6 O=C(O)C1CNCCN1 SC-21327 [0,2,0,0,0,0|1,0,1]=4 598 B9R1.6 O=C(O)C1COCCN1 SC-22999 [0,2,0,0,0,0|1,0,1]=4 599 B9R1.6 O=C(O)C1COCCN1 SC-25354 [0,2,0,0,0,0|1,0,1]=4 600 B9R1.6 O=C(O)C1COCCN1 SC-27629 [0,2,0,0,0,0|1,0,1]=4 601 B9R1.6 O=C(O)C1CSCCN1 SC-47973 [0,2,0,0,0,0|1,0,1]=4 602 B9R1.6 O=C(O)[C@@H]1CNCCN1 SC-08890 [0,2,0,0,0,0|1,0,1]=4 603 B9R1.6 O=C(O)[C@@H]1CNCCN1 SC-12480 [0,2,0,0,0,0|1,0,1]=4 604 B9R1.6 O=C(O)[C@@H]1CSCCN1 SC-82353 [0,2,0,0,0,0|1,0,1]=4 605 B9R1.6 O=C(O)[C@H]1CCCCN1 SC-01680 [0,2,0,0,0,0|0,0,1]=3 606 B9R1.6 O=C(O)[C@H]1CNCCN1 SC-00676 [0,2,0,0,0,0|1,0,1]=4 607 B9R1.6 O=C(O)[C@H]1CNCCN1 SC-12519 [0,2,0,0,0,0|1,0,1]=4 608 B9R1.6 O=C(O)[C@H]1CSCCN1 SC-33694 [0,2,0,0,0,0|1,0,1]=4 609 B9R1.6 OB(O)C1CCCCC1 SC-86762 [0,2,0,0,0,0|2,0,0]=4 610 B9R1.8 BrCCC1CCOCC1 SC-99287 [0,2,0,0,0,0|2,0,0]=4 611 B9R1.8 BrCCC1OCCCO1 SC-89023 [0,2,0,0,0,0|2,0,0]=4 612 B9R1.8 CCNC1CCOCC1 SC-45632 [0,2,0,0,0,0|2,0,0]=4 613 B9R1.8 CCOC1=CCCCC1 SC-68423 [0,2,0,0,0,0|1,0,1]=4 614 B9R1.8 COCC1CCCCN1 SC-48480 [0,2,0,0,0,0|0,0,0]=2 615 B9R1.8 COCC1CCNCC1 SC-B8194 [0,2,0,0,0,0|2,0,0]=4 616 B9R1.8 COCC1CNCCO1 SC-99967 [0,2,0,0,0,0|2,0,0]=4 617 B9R1.8 ClCCN1CCCCC1 SC-12781 [0,2,0,0,0,0|2,0,0]=4 618 B9R1.8 N#CCC1CCCCC1 SC-72238 [0,2,0,0,0,0|1,0,0]=3 619 B9R1.8 N#CCC1CCNCC1 SC-A3150 [0,2,0,0,0,0|2,0,0]=4 620 B9R1.8 N#CCC1CCOCC1 SC-53285 [0,2,0,0,0,0|2,0,0]=4 621 B9R1.8 NCCC1=CCCCC1 SC-62304 [0,2,0,0,0,0|1,0,1]=4 622 B9R1.8 NCCC1CCOCC1 SC-06091 [0,2,0,0,0,0|2,0,0]=4 623 B9R1.8 NCCN1CCCCC1 SC-69190 [0,2,0,0,0,0|2,0,0]=4 624 B9R1.8 NNCC1CCCCC1 SC-58983 [0,2,0,0,0,0|1,0,0]=3 625 B9R1.8 O=CCC1CCCCC1 SC-12759 [0,2,0,0,0,0|1,0,0]=3 626 B9R1.8 O=CCC1CCOCC1 SC-88269 [0,2,0,0,0,0|2,0,0]=4 627 B9R1.8 OCCC1CCCCN1 SC-01221 [0,2,0,0,0,0|0,0,0]=2 628 B9R1.8 OCCC1CCNCC1 SC-05824 [0,2,0,0,0,0|2,0,0]=4 629 B9R1.8 OCCC1CCNCC1 SC-A3238 [0,2,0,0,0,0|2,0,0]=4 630 B9R1.8 OCCC1CNCCO1 SC-24452 [0,2,0,0,0,0|2,0,0]=4 631 B9R1.8 [NH3+]NCC1CCCCC1 SC-41857 [0,2,0,0,0,0|1,0,0]=3 632 B9R1.15 CN1CCOCC1CN SC-A2840 [0,2,0,0,0,0|1,0,0]=3 633 B9R1.15 C[C@H]1CCCN[C@@H]1CO SC-91585 [0,2,0,0,0,0|0,0,0]=2 634 B9R1.15 N#CC1CCCCC1=O SC-77521 [0,2,0,0,0,0|1,0,1]=4 635 B9R1.118 C#CC1(O)CCCCC1 SC-26687 [0,2,0,0,0,0|1,0,1]=4 636 B9R1.118 CC1(CO)CCCCC1 SC-94042 [0,2,0,0,0,0|1,0,0]=3 637 B9R1.118 NC1(CO)CCOCC1 SC-92851 [0,2,0,0,0,0|2,0,0]=4 638 B9R1.118 NCC1(O)CCCCC1 SC-39594 [0,2,0,0,0,0|1,0,0]=3 639 B9R1.118 NCC1(O)CCOCC1 SC-98054 [0,2,0,0,0,0|2,0,0]=4 640 B9R1.10 CC1(C)CCC(=O)CC1 SC-20004 [0,2,0,0,0,0|1,0,1]=4 641 B9R1.10 CC1(C)OCC(N)CO1 SC-21221 [0,2,0,0,0,0|2,0,0]=4 642 B9R1.10 CN1CCC(C)(O)CC1 SC-97562 [0,2,0,0,0,0|2,0,0]=4 643 B9R1.10 NC1CCC(F)(F)CC1 SC-14792 [0,2,0,0,0,0|2,0,0]=4 644 B9R1.10 NC1CCC(F)(F)CC1 SC-47761 [0,2,0,0,0,0|2,0,0]=4 645 B9R1.10 OC1CCC(F)(F)CC1 SC-43770 [0,2,0,0,0,0|2,0,0]=4 646 B9R1.69 CC1CC(=O)CCN1C SC-21165 [0,2,0,0,0,0|0,0,1]=3 647 B9R1.69 CC1CN(C)C(=O)CN1 SC-24030 [0,2,0,0,0,0|1,0,1]=4 648 B9R1.69 CC1CN(C)CCC1=O SC-21048 [0,2,0,0,0,0|2,0,0]=4 649 B9R1.3 CC1C(=O)CCCC1=O SC-24698 [0,2,0,0,0,0|1,0,1]=4 650 B9R1.34 CC1CC(=O)CC(C)N1 SC-49668 [0,2,0,0,0,0|0,0,1]=3 651 B9R1.34 CC1CC(=O)CC(C)O1 SC-43659 [0,2,0,0,0,0|1,0,1]=4 652 B9R1.34 CC1NC(C)NC(C)N1 SC-89168 [0,2,0,0,0,0|2,0,0]=4 653 B9R1.34 C[C@@H]1CC(=O)C[C@@H](C)N1 SC-88301 [0,2,0,0,0,0|0,0,1]=3 654 B9R1.34 C[C@H]1CC(=O)C[C@@H](C)N1 SC-88300 [0,2,0,0,0,0|0,0,1]=3 655 B9R1.66 CC1(C)CC(=O)CCO1 SC-22069 [0,2,0,0,0,0|1,0,1]=4 656 B9R1.66 CC1(C)CC(N)CCO1 SC-A4709 [0,2,0,0,0,0|1,0,0]=3 657 B9R1.66 CC1(C)CCCC(=O)C1 SC-67598 [0,2,0,0,0,0|1,0,1]=4 658 B9R1.40 CC1(C)CCCC[C@@H]1N SC-89246 [0,2,0,0,0,0|1,0,0]=3 659 B9R1.40 CC1(C)CCCC[C@H]1N SC-89247 [0,2,0,0,0,0|1,0,0]=3 660 B7R1.6 CCOC1CNC1 SC-28573 [0,0,1,1,0,0|2,0,0]=4 661 B7R1.6 CCOC1CNC1 SC-48702 [0,0,1,1,0,0|2,0,0]=4 662 B7R1.6 NCCC1CCC1 SC-B8576 [0,0,1,1,0,0|2,0,0]=4 663 B7R1.10 COC1CC(O)C1 SC-A4338 [0,0,1,1,0,0|2,0,0]=4 664 B7R1.25 COC1(C)CNC1 SC-50109 [0,0,1,1,0,0|2,0,0]=4 665 B7R1.18 CC(=O)C1CCC1 SC-74316 [0,0,1,1,0,0|1,0,1]=4 666 B7R1.18 CC(O)C1CCC1 SC-22088 [0,0,1,1,0,0|1,0,0]=3 667 B7R1.20 CC(=O)CC1CC1 SC-21396 [0,0,1,1,0,0|1,0,1]=4 668 B7R1.24 C1CNCCNC1 SC-04887 [0,0,1,1,0,0|1,0,0]=3 669 B7R2.13 C1CC2CC2N1 SC-A3242 [1,0,0,1,0,0|0,0,0]=2 670 B7R2.13 C1CC2OC2C1 SC-15327 [1,0,0,1,0,0|1,0,0]=3 671 B7R2.13 C1NCC2CC12 SC-88257 [1,0,0,1,0,0|0,0,0]=2 672 B9R2.68 C1CC2CNCC1O2 SC-25409 [0,0,0,1,0,1|1,0,0]=3 673 B9R2.68 C1CC2CNCC1O2 SC-89187 [0,0,0,1,0,1|1,0,0]=3 674 B9R2.68 C1CC2CNCC1O2 SC-89272 [0,0,0,1,0,1|1,0,0]=3 675 B9R2.68 C1CC2COCC1N2 SC-93545 [0,0,0,1,0,1|2,0,0]=4 676 B9R2.49 C1CC2CNC1CN2 SC-70248 [0,1,0,1,0,0|0,0,0]=2 677 B9R2.49 C1CN2CCC1CC2 SC-84874 [0,1,0,1,0,0|2,0,0]=4 678 B9R2.174 C1CC2(CCN1)CC2 SC-53625 [0,1,0,1,0,0|2,0,0]=4 679 B9R2.174 C1COC2(CC2)CN1 SC-68616 [0,1,0,1,0,0|2,0,0]=4 680 B9R2.174 C1COCC2(CC2)N1 SC-35219 [0,1,0,1,0,0|1,0,0]=3 681 B9R2.174 C1COCC2(CC2)N1 SC-94949 [0,1,0,1,0,0|1,0,0]=3 682 B9R2.39 BrC1CC2CCC1C2 SC-A3245 [0,1,0,1,0,0|1,0,0]=3 683 B9R2.39 CN1CC2CC1CN2 SC-A2612 [0,1,0,1,0,0|1,0,0]=3 684 B9R2.39 O=C1CC2CCC1C2 SC-50094 [0,1,0,1,0,0|1,0,0]=3 685 B9R2.39 [C@H]12CC[C@H](C1)C(=O)N2 SC-52249 [0,1,0,1,0,0|0,0,1]=3 686 B9R2.39 [C@H]12CNC(CN1C)C2 SC-94272 [0,1,0,1,0,0|1,0,0]=3 687 B9R2.95 CC1(C)C2CNCC21 SC-53789 [0,1,0,1,0,0|2,0,0]=4 688 B5R1.1 C1=CCCC1 SC-18920 [1,0,0,0,1,0|0,0,2]=4 689 B5R1.1 C1=CNCC1 SC-88946 [1,0,0,0,1,0|0,0,2]=4 690 B5R1.1 C1CSCN1 SC-91699 [1,0,0,0,1,0|1,0,0]=3 691 B5R1.2 BrC1CCC1 SC-50402 [0,0,0,0,2,0|1,0,0]=3 692 B5R1.2 CC1CCN1 SC-70091 [0,0,0,0,2,0|0,0,0]=2 693 B5R1.2 CC1CCN1 SC-A3607 [0,0,0,0,2,0|0,0,0]=2 694 B5R1.2 CC1CCN1 SC-A3960 [0,0,0,0,2,0|0,0,0]=2 695 B5R1.2 CC1CNC1 SC-50429 [0,0,0,0,2,0|1,0,0]=3 696 B5R1.2 FC1CNC1 SC-47665 [0,0,0,0,2,0|2,0,0]=4 697 B5R1.2 FC1CNC1 SC-51742 [0,0,0,0,2,0|2,0,0]=4 698 B5R1.2 IC1CCC1 SC-92367 [0,0,0,0,2,0|1,0,0]=3 699 B5R1.2 IC1COC1 SC-43780 [0,0,0,0,2,0|2,0,0]=4 700 B5R1.2 NC1CCC1 SC-20422 [0,0,0,0,2,0|1,0,0]=3 701 B5R1.2 NC1CNC1 SC-82511 [0,0,0,0,2,0|2,0,0]=4 702 B5R1.2 NC1COC1 SC-20809 [0,0,0,0,2,0|2,0,0]=4 703 B5R1.2 O=C1CCC1 SC-00523 [0,0,0,0,2,0|1,0,1]=4 704 B5R1.2 O=C1CCN1 SC-44172 [0,0,0,0,2,0|1,0,1]=4 705 B5R1.2 OC1CNC1 SC-04637 [0,0,0,0,2,0|2,0,0]=4 706 B5R1.2 OC1CNC1 SC-19998 [0,0,0,0,2,0|2,0,0]=4 707 B5R1.2 OC1COC1 SC-25466 [0,0,0,0,2,0|2,0,0]=4 708 B5R1.2 OC1CSC1 SC-36448 [0,0,0,0,2,0|2,0,0]=4 709 B5R1.2 SC1COC1 SC-B7217 [0,0,0,0,2,0|2,0,0]=4 710 B9R1.50 O=C1CCCCCCN1 SC-84294 [0,0,0,0,0,2|1,0,1]=4