0 B10R1.17 CCCCC1CCCCN1 F2167-1857 [0,0,0,1,0,0|3,0,0]=4 1 B10R1.17 CCCCC1CCCCN1 F8886-3808 [0,0,0,1,0,0|3,0,0]=4 2 B10R1.17 CCCCC1CCCNC1 F2167-1856 [0,0,0,1,0,0|3,0,0]=4 3 B10R1.17 CCCCC1CCCNC1 F8882-8889 [0,0,0,1,0,0|3,0,0]=4 4 B10R1.17 NCCCC1CCCOC1 F2147-8428 [0,0,0,1,0,0|3,0,0]=4 5 B10R1.17 NCCNC1CCSCC1 F8882-3433 [0,0,0,1,0,0|3,0,0]=4 6 B10R1.17 OCCCC1CCCNC1 F2147-8462 [0,0,0,1,0,0|3,0,0]=4 7 B10R1.17 OCCOC1CCCNC1 F8880-1181 [0,0,0,1,0,0|3,0,0]=4 8 B10R1.29 C#CCN[C@@H]1CNC[C@H]1O F1912-1200 [0,0,0,1,0,0|2,0,1]=4 9 B10R1.29 CCCN[C@@H]1CNC[C@H]1O F6545-6184 [0,0,0,1,0,0|2,0,0]=3 10 B10R1.29 NCCN[C@@H]1CNC[C@H]1O F6545-6185 [0,0,0,1,0,0|1,0,0]=2 11 B10R1.29 OCCN[C@@H]1COC[C@H]1O F6545-4801 [0,0,0,1,0,0|3,0,0]=4 12 B10R1.29 OCCS[C@@H]1CNC[C@H]1O F1912-2414 [0,0,0,1,0,0|3,0,0]=4 13 B10R1.85 C#CCN1CCCNCC1 F8881-6452 [0,0,0,1,0,0|2,0,1]=4 14 B10R1.85 CCCC1CCCNCC1 F8889-6452 [0,0,0,1,0,0|3,0,0]=4 15 B10R1.85 NCCN1CCCSCC1 F8884-6456 [0,0,0,1,0,0|2,0,0]=3 16 B10R1.85 OCCN1CCCSCC1 F8882-5840 [0,0,0,1,0,0|3,0,0]=4 17 B7R0.1 C#CCCCNCC F1913-1828 [2,0,0,0,0,0|1,0,1]=4 18 B9R1.8 CCCC1CCCNC1 F2167-1864 [1,0,0,1,0,0|2,0,0]=4 19 B9R1.8 CCCC1CCCNC1 F8881-5623 [1,0,0,1,0,0|2,0,0]=4 20 B9R1.8 FCCC1CCNCC1 F1907-0962 [1,0,0,1,0,0|2,0,0]=4 21 B9R1.12 CCCCC1CCNC1 F2167-8065 [1,0,0,1,0,0|2,0,0]=4 22 B9R1.12 CCNCC1CCCC1 F8885-5894 [1,0,0,1,0,0|2,0,0]=4 23 B9R1.12 CCNCC1CCCN1 F1911-1651 [1,0,0,1,0,0|1,0,0]=3 24 B9R1.12 CCSCC1CCCN1 F2167-0497 [1,0,0,1,0,0|2,0,0]=4 25 B9R1.12 FCCOC1CCNC1 F2167-7597 [1,0,0,1,0,0|2,0,0]=4 26 B9R1.12 NCCNC1CCOC1 F8886-7115 [1,0,0,1,0,0|1,0,0]=3 27 B9R1.17 CCNCCC1CCC1 F1911-1671 [1,0,0,1,0,0|2,0,0]=4 28 B9R1.33 CCN[C@@H]1CCC[C@H]1O F6545-4623 [1,0,0,1,0,0|2,0,0]=4 29 B9R1.33 CCOC1CNCC1O F8883-4739 [1,0,0,1,0,0|2,0,0]=4 30 B9R1.33 CCS[C@@H]1CNC[C@H]1O F1912-2407 [1,0,0,1,0,0|2,0,0]=4 31 B9R1.39 CCCNC1CCC1F F1910-8113 [1,0,0,1,0,0|2,0,0]=4 32 B9R1.39 CCCN[C@@H]1CC[C@H]1O F6619-0442 [1,0,0,1,0,0|2,0,0]=4 33 B9R1.39 NCCN[C@@H]1CC[C@H]1O F6619-0443 [1,0,0,1,0,0|1,0,0]=3 34 B9R1.39 OCCNC1CCC1F F1910-8134 [1,0,0,1,0,0|2,0,0]=4 35 B9R1.39 OCCN[C@@H]1CC[C@H]1O F6619-0483 [1,0,0,1,0,0|2,0,0]=4 36 B9R1.89 CCC1CCCCCN1 F8880-5088 [1,0,0,1,0,0|2,0,0]=4 37 B9R1.89 CCC1CCNCCO1 F1913-2476 [1,0,0,1,0,0|2,0,0]=4 38 B9R1.89 CCC1CCNCCO1 F1913-2477 [1,0,0,1,0,0|2,0,0]=4 39 B9R1.89 FCC1CCCNCC1 F1913-6939 [1,0,0,1,0,0|2,0,0]=4 40 B9R1.89 FCC1CCCNCC1 F1913-7547 [1,0,0,1,0,0|2,0,0]=4 41 B9R1.89 FCC1CCNCCO1 F1913-1758 [1,0,0,1,0,0|2,0,0]=4 42 B9R1.89 OCC1CCCNCC1 F8881-2497 [1,0,0,1,0,0|2,0,0]=4 43 B11R1.91 CC(N)CNC1CCCCC1 F1904-0445 [0,1,0,1,0,0|2,0,0]=4 44 B11R1.172 CC(N)CNCC1CCCO1 F1904-0464 [0,1,0,1,0,0|2,0,0]=4 45 B11R1.742 CC(F)CN1CCCNCC1 F1913-6459 [0,1,0,1,0,0|2,0,0]=4 46 B11R1.5 CCCN1CCNCCC1=O F2167-7680 [0,1,0,1,0,0|2,0,0]=4 47 B11R1.756 NCCNCC1(O)CCCC1 F6545-5488 [0,1,0,1,0,0|2,0,0]=4 48 B11R2.10 OC1CC2CNCCN2C1 F2147-2247 [0,0,0,2,0,0|2,0,0]=4 49 B11R2.20 C1CCN2CCNC[C@@H]2C1 F1913-7162 [0,0,0,2,0,0|2,0,0]=4 50 B11R2.20 C1CN2CCSCC2CN1 F2147-1146 [0,0,0,2,0,0|2,0,0]=4 51 B11R2.248 NCCN1CC2CCC1C2 F1913-2343 [0,0,0,2,0,0|2,0,0]=4 52 B11R2.402 CC12CCCN1CCNC2 F1913-5089 [0,0,0,2,0,0|2,0,0]=4 53 B11R2.18 C1CNC[C@@H]2CCCN2C1 F1913-7159 [0,0,0,2,0,0|2,0,0]=4 54 B11R2.3 NC1CNCC12CCCC2 F1907-1969 [0,0,0,2,0,0|2,0,0]=4 55 B11R2.385 C1CNC(CNC2CC2)C1 F1911-1653 [0,0,0,2,0,0|2,0,0]=4 56 B11R2.115 NC1CCCC1NC2CC2 F2185-0791 [0,0,0,2,0,0|2,0,0]=4