0 B8R0.4 C=CCCNCCOC E72576 [0,0,0,0,0,0|2,0,2]=4 1 B8R0.4 CCC#CCCCCC T72039 [0,0,0,0,0,0|1,0,2]=3 2 B8R0.4 CNCCCCCCO AT11159 [0,0,0,0,0,0|3,0,0]=3 3 B8R0.4 COCCNCCCO FD7300 [0,0,0,0,0,0|3,0,0]=3 4 B8R0.4 ClCCCCCCCCl T71360 [0,0,0,0,0,0|3,0,0]=3 5 B8R0.4 NCCCCCCCO AT22494 [0,0,0,0,0,0|3,0,0]=3 6 B8R0.4 OCCCOCCCCl D84666 [0,0,0,0,0,0|2,1,0]=3 7 B7R0.1 C=CCCCCCCl I11994 [1,0,0,0,0,0|1,0,2]=4 8 B7R0.1 C=CCCCCCO F14745 [1,0,0,0,0,0|1,0,2]=4 9 B7R0.1 CNCCCCCO AT11157 [1,0,0,0,0,0|2,0,0]=3 10 B7R0.1 CNCCCCCO AT11158 [1,0,0,0,0,0|2,0,0]=3 11 B7R0.1 COCCNCCO AT12488 [1,0,0,0,0,0|3,0,0]=4 12 B7R0.1 COCCOCCN F50617 [1,0,0,0,0,0|2,1,0]=4 13 B7R0.1 COCCOCCS AT10124 [1,0,0,0,0,0|2,1,0]=4 14 B7R0.1 C\C=C/CCCCC T72919 [1,0,0,0,0,0|0,0,2]=3 15 B7R0.1 ClCCSSCCCl AT21151 [1,0,0,0,0,0|3,0,0]=4 16 B7R0.1 NCCSCCCO AT25557 [1,0,0,0,0,0|2,0,0]=3 17 B7R0.1 NCCSSCCN AT21144 [1,0,0,0,0,0|3,0,0]=4 18 B7R0.1 O=CCCCCCCl 24359 [1,0,0,0,0,0|2,0,1]=4 19 B7R0.1 OCCCCCCI AT14272 [1,0,0,0,0,0|2,0,0]=3 20 B7R0.1 OCCCNCCO FD7298 [1,0,0,0,0,0|3,0,0]=4 21 B9R0.2 CC(C)CCCCCCO D98911 [0,1,0,0,0,0|2,0,0]=3 22 B9R0.18 CCCCC(C)CCCC T71863 [0,1,0,0,0,0|1,0,0]=2 23 B9R0.45 C=CCCCCCCCC T73018 [0,1,0,0,0,0|1,0,1]=3 24 B9R0.45 CC#CCCCCCCC H11435 [0,1,0,0,0,0|1,0,1]=3 25 B9R0.45 CCCC#CC#CCCC T70378 [0,1,0,0,0,0|1,0,2]=4 26 B9R0.45 C\C=C/CCCCCCC T70533 [0,1,0,0,0,0|1,0,1]=3 27 B9R0.45 NCCCCNCCCN T72522 [0,1,0,0,0,0|2,0,0]=3 28 B9R0.46 CCCCCC[C@@H](C)CC T72672 [0,1,0,0,0,0|1,0,0]=2 29 B9R0.46 CCCCCC[C@H](O)CO C16570 [0,1,0,0,0,0|2,0,0]=3 30 B9R0.46 CC[C@H](C)CCCCCO T71591 [0,1,0,0,0,0|2,0,0]=3 31 B9R0.46 OCCCCC[C@H](O)CO T72391 [0,1,0,0,0,0|3,0,0]=4 32 B9R1.5 C[C@H]1CCNCCN1C AC6586 [0,0,0,1,0,0|2,0,0]=3 33 B9R1.5 N[C@H]1CCCCC[C@@H]1O AT10930 [0,0,0,1,0,0|3,0,0]=4 34 B9R1.8 C=CC[C@H]1CCCCN1 A51152 [0,0,0,1,0,0|1,0,2]=4 35 B9R1.8 CCCC1CCNCC1 C75224 [0,0,0,1,0,0|2,0,0]=3 36 B9R1.8 CCC[C@H]1CCCCN1 F16887 [0,0,0,1,0,0|1,0,0]=2 37 B9R1.8 CCNC1CCNCC1 AC8313 [0,0,0,1,0,0|3,0,0]=4 38 B9R1.8 CNCC1CCCCC1 P19116 [0,0,0,1,0,0|2,0,0]=3 39 B9R1.8 CNCC1CCOCC1 71672 [0,0,0,1,0,0|3,0,0]=4 40 B9R1.8 CNC[C@H]1CCCCO1 F16332 [0,0,0,1,0,0|1,1,0]=3 41 B9R1.8 COC[C@H]1CCCCN1 31181 [0,0,0,1,0,0|2,0,0]=3 42 B9R1.8 COC[C@H]1CCCCN1 Y11003 [0,0,0,1,0,0|2,0,0]=3 43 B9R1.8 COC[C@H]1CCCNC1 C78400 [0,0,0,1,0,0|3,0,0]=4 44 B9R1.8 NCCC1CCNCC1 65278 [0,0,0,1,0,0|3,0,0]=4 45 B9R1.8 NCC[C@H]1CCCCN1 D76613 [0,0,0,1,0,0|2,0,0]=3 46 B9R1.8 NCC[C@H]1CCCCO1 SC1551 [0,0,0,1,0,0|1,1,0]=3 47 B9R1.8 NCC[C@H]1CCCNC1 D76642 [0,0,0,1,0,0|3,0,0]=4 48 B9R1.8 NCC[C@H]1CCCOC1 AT23688 [0,0,0,1,0,0|3,0,0]=4 49 B9R1.8 NCC[C@H]1CCCOC1 AT23689 [0,0,0,1,0,0|3,0,0]=4 50 B9R1.8 NCC[C@H]1COCCN1 A50776 [0,0,0,1,0,0|3,0,0]=4 51 B9R1.8 NCC[C@H]1COCCN1 C77968 [0,0,0,1,0,0|3,0,0]=4 52 B9R1.8 NNCC1CCCCC1 P11239 [0,0,0,1,0,0|3,0,0]=4 53 B9R1.8 OCCN1CCCCO1 72896 [0,0,0,1,0,0|2,1,0]=4 54 B9R1.8 OCC[C@H]1CCCOC1 AT23679 [0,0,0,1,0,0|3,0,0]=4 55 B9R1.8 OCC[C@H]1CNCCN1 27756 [0,0,0,1,0,0|3,0,0]=4 56 B9R1.8 OCC[C@H]1CNCCO1 A50782 [0,0,0,1,0,0|2,1,0]=4 57 B9R1.8 OCC[C@H]1COCCN1 A50775 [0,0,0,1,0,0|3,0,0]=4 58 B9R1.8 OCC[C@H]1COCCN1 C78196 [0,0,0,1,0,0|3,0,0]=4 59 B9R1.12 BrCCCN1CCCC1 D88134 [0,0,0,1,0,0|2,0,0]=3 60 B9R1.12 CCCC[C@H]1CCCN1 N12661 [0,0,0,1,0,0|2,0,0]=3 61 B9R1.12 CNCCC1CCCC1 P11107 [0,0,0,1,0,0|2,0,0]=3 62 B9R1.12 CNCC[C@H]1CCCO1 F20641 [0,0,0,1,0,0|3,0,0]=4 63 B9R1.12 NCCCC1CCCC1 F20043 [0,0,0,1,0,0|2,0,0]=3 64 B9R1.12 NCCOC1CCCC1 AC3097 [0,0,0,1,0,0|3,0,0]=4 65 B9R1.14 CO[C@H]1CNC[C@@H]1OC P14094 [0,0,0,1,0,0|3,0,0]=4 66 B9R1.14 CO[C@H]1CNC[C@@H]1OC P15733 [0,0,0,1,0,0|3,0,0]=4 67 B9R1.14 CO[C@H]1CNC[C@@H]1OC P18392 [0,0,0,1,0,0|3,0,0]=4 68 B9R1.14 OC[C@@H]1CNC[C@@H]1CO AT10998 [0,0,0,1,0,0|3,0,0]=4 69 B9R1.14 OC[C@H]1CNC[C@@H]1CO AT10997 [0,0,0,1,0,0|3,0,0]=4 70 B9R1.15 CCC1CCCCC1C T72380 [0,0,0,1,0,0|1,0,0]=2 71 B9R1.15 CCC1CCCCC1O D90497 [0,0,0,1,0,0|2,0,0]=3 72 B9R1.15 CC[C@H]1CNCCC1=O O11002 [0,0,0,1,0,0|2,0,1]=4 73 B9R1.15 CN1CCOC[C@@H]1CN 27733 [0,0,0,1,0,0|2,1,0]=4 74 B9R1.15 CN1CCOC[C@@H]1CN 77625 [0,0,0,1,0,0|2,1,0]=4 75 B9R1.15 CN[C@H]1CNCC[C@H]1C 44571 [0,0,0,1,0,0|2,0,0]=3 76 B9R1.15 COC1CCCCC1N C77572 [0,0,0,1,0,0|3,0,0]=4 77 B9R1.15 COC1CNCCC1C 33459 [0,0,0,1,0,0|2,0,0]=3 78 B9R1.15 CO[C@H]1CCCC[C@@H]1N 89668 [0,0,0,1,0,0|3,0,0]=4 79 B9R1.15 CO[C@H]1CCCC[C@@H]1O A12017 [0,0,0,1,0,0|3,0,0]=4 80 B9R1.15 CO[C@H]1COCC[C@@H]1N AT20176 [0,0,0,1,0,0|2,1,0]=4 81 B9R1.15 CO[C@H]1COCC[C@@H]1N P15681 [0,0,0,1,0,0|2,1,0]=4 82 B9R1.15 NCC1CCCCC1O C77667 [0,0,0,1,0,0|3,0,0]=4 83 B9R1.15 N[C@H]1CCCC[C@@H]1CO C80022 [0,0,0,1,0,0|3,0,0]=4 84 B9R1.15 OCC1CNCCC1O 33707 [0,0,0,1,0,0|3,0,0]=4 85 B9R1.33 CN1CCC[C@@H]1CCN P11249 [0,0,0,1,0,0|3,0,0]=4 86 B9R1.33 CN1CCC[C@@H]1CCN P15959 [0,0,0,1,0,0|3,0,0]=4 87 B9R1.33 CN1CCC[C@@H]1CCN P17927 [0,0,0,1,0,0|3,0,0]=4 88 B9R1.83 OCCCOC[C@H]1CO1 AT11748 [0,0,0,1,0,0|2,1,0]=4 89 B9R1.89 CN[C@H]1CCCCNC1 97599 [0,0,0,1,0,0|2,0,0]=3 90 B9R1.89 CN[C@H]1CCCCNC1 97600 [0,0,0,1,0,0|2,0,0]=3 91 B9R1.89 O=CC1CCCCCC1 AT13628 [0,0,0,1,0,0|2,0,1]=4 92 B9R1.89 OC[C@H]1CCCNCC1 73020 [0,0,0,1,0,0|3,0,0]=4 93 B9R1.103 C1CSCCSCCS1 T72788 [0,0,0,1,0,0|2,0,0]=3 94 B6R0.6 CCNCCSC AT25567 [2,0,0,0,0,0|2,0,0]=4 95 B6R0.6 CNCCCOC F15969 [2,0,0,0,0,0|2,0,0]=4 96 B6R0.6 COCCCCN C77605 [2,0,0,0,0,0|2,0,0]=4 97 B6R0.6 NCCSCCO AT25550 [2,0,0,0,0,0|2,0,0]=4 98 B6R0.6 [2H]OCCCCC D99155 [2,0,0,0,0,0|2,0,0]=4 99 B8R0.1 CCCC[C@H](N)CCO D73273 [1,1,0,0,0,0|1,0,0]=3 100 B8R0.6 C#C[C@@H](O)CCCCC 51060 [1,1,0,0,0,0|0,0,2]=4 101 B8R0.6 C#C[C@@H](O)CCCCC T72294 [1,1,0,0,0,0|0,0,2]=4 102 B8R0.6 CC[C@H](C)CCCCO T72651 [1,1,0,0,0,0|1,0,0]=3 103 B8R0.7 CNCCCCN(C)C F51688 [1,1,0,0,0,0|2,0,0]=4 104 B8R0.7 [2H][C@H](Br)CCCCCC D99523 [1,1,0,0,0,0|1,0,0]=3 105 B8R0.7 [2H][C@H](O)CCCCCC D99646 [1,1,0,0,0,0|1,0,0]=3 106 B10R0.4 CC(C)CCCCCCC=O D86949 [0,2,0,0,0,0|1,0,1]=4 107 B10R0.4 CC(C)CCCCCCCO D98228 [0,2,0,0,0,0|1,0,0]=3 108 B10R0.22 [2H]C([2H])(I)CCCCCCC D98871 [0,2,0,0,0,0|2,0,0]=4 109 B10R0.22 [2H]C([2H])(O)CCCCCCC D98285 [0,2,0,0,0,0|2,0,0]=4 110 B10R0.74 CCCCCCC[C@H](O)CO T72466 [0,2,0,0,0,0|1,0,0]=3 111 B10R0.74 OCCCCCC[C@H](O)CO T72401 [0,2,0,0,0,0|2,0,0]=4 112 B10R0.91 CCCCC[C@@H](O)CCCC T70997 [0,2,0,0,0,0|1,0,0]=3 113 B10R0.71 CCOCCNCCOCC D88790 [0,2,0,0,0,0|1,0,0]=3 114 B10R0.71 NCCCNCCNCCN C11288 [0,2,0,0,0,0|2,0,0]=4 115 B10R0.71 OCCOCCCCCCCl D71999 [0,2,0,0,0,0|2,0,0]=4 116 B8R1.2 BrCC1CCNCC1 30601 [1,0,0,1,0,0|2,0,0]=4 117 B8R1.2 CC[C@H]1CCCCN1 N11156 [1,0,0,1,0,0|1,0,0]=3 118 B8R1.2 CC[C@H]1CNCCO1 D75750 [1,0,0,1,0,0|1,1,0]=4 119 B8R1.2 CC[C@H]1COCCN1 F19074 [1,0,0,1,0,0|1,1,0]=4 120 B8R1.2 CNC1CCCCC1 S12279 [1,0,0,1,0,0|1,0,0]=3 121 B8R1.2 CNC1CCNCC1 63132 [1,0,0,1,0,0|2,0,0]=4 122 B8R1.2 CNC1CCSCC1 AT10410 [1,0,0,1,0,0|2,0,0]=4 123 B8R1.2 CSC1CCNCC1 32247 [1,0,0,1,0,0|2,0,0]=4 124 B8R1.2 CSC1CCNCC1 P10626 [1,0,0,1,0,0|2,0,0]=4 125 B8R1.2 ICC1CCNCC1 AC3914 [1,0,0,1,0,0|2,0,0]=4 126 B8R1.2 SCC1CCOCC1 P16932 [1,0,0,1,0,0|2,0,0]=4 127 B8R1.5 CC1CCNCC1O 38881 [1,0,0,1,0,0|2,0,0]=4 128 B8R1.5 CC1COCCC1N F13602 [1,0,0,1,0,0|1,1,0]=4 129 B8R1.5 CC1NCCCC1O W19147 [1,0,0,1,0,0|2,0,0]=4 130 B8R1.5 CC1NCCSC1C AT25273 [1,0,0,1,0,0|2,0,0]=4 131 B8R1.5 C[C@@H]1CCNC[C@@H]1O 38884 [1,0,0,1,0,0|2,0,0]=4 132 B8R1.5 C[C@@H]1CNCC[C@@H]1O A11539 [1,0,0,1,0,0|2,0,0]=4 133 B8R1.5 C[C@@H]1NCCN[C@H]1C AT24345 [1,0,0,1,0,0|2,0,0]=4 134 B8R1.5 C[C@H]1CCNC[C@@H]1O P12384 [1,0,0,1,0,0|2,0,0]=4 135 B8R1.5 C[C@H]1CCNC[C@@H]1O W19323 [1,0,0,1,0,0|2,0,0]=4 136 B8R1.5 NC1CCCCC1O F13372 [1,0,0,1,0,0|2,0,0]=4 137 B8R1.5 N[C@@H]1CCCC[C@@H]1F AT23366 [1,0,0,1,0,0|2,0,0]=4 138 B8R1.5 N[C@@H]1CCCC[C@@H]1O F53834 [1,0,0,1,0,0|2,0,0]=4 139 B8R1.8 CCC[C@H]1CCCN1 N12832 [1,0,0,1,0,0|1,0,0]=3 140 B8R1.8 CCN[C@H]1CCNC1 T71595 [1,0,0,1,0,0|2,0,0]=4 141 B8R1.8 CCN[C@H]1CCNC1 T72393 [1,0,0,1,0,0|2,0,0]=4 142 B8R1.8 CCN[C@H]1CCOC1 P12313 [1,0,0,1,0,0|2,0,0]=4 143 B8R1.8 CNCC1CCCC1 A11546 [1,0,0,1,0,0|1,0,0]=3 144 B8R1.8 COC[C@H]1CCCN1 C77885 [1,0,0,1,0,0|2,0,0]=4 145 B8R1.8 NCCC1CCCC1 23497 [1,0,0,1,0,0|1,0,0]=3 146 B8R1.8 NCC[C@H]1CCCO1 AT11471 [1,0,0,1,0,0|1,1,0]=4 147 B8R1.8 OCC[C@H]1CCCO1 56770 [1,0,0,1,0,0|1,1,0]=4 148 B8R1.8 OCC[C@H]1CCNC1 C16745 [1,0,0,1,0,0|2,0,0]=4 149 B8R1.8 OCC[C@H]1CCNC1 D84329 [1,0,0,1,0,0|2,0,0]=4 150 B8R1.10 CNCCC1CCC1 P12905 [1,0,0,1,0,0|1,0,0]=3 151 B8R1.10 CNCC[C@H]1CCN1 F50261 [1,0,0,1,0,0|2,0,0]=4 152 B8R1.10 COCC[C@H]1CCN1 F50258 [1,0,0,1,0,0|2,0,0]=4 153 B8R1.10 COCC[C@H]1CCN1 F50334 [1,0,0,1,0,0|2,0,0]=4 154 B8R1.11 CC1COCC1CCl 50130 [1,0,0,1,0,0|1,1,0]=4 155 B8R1.11 CC1COCC1CO 50120 [1,0,0,1,0,0|1,1,0]=4 156 B8R1.11 CO[C@H]1CCC[C@@H]1N AT13762 [1,0,0,1,0,0|2,0,0]=4 157 B8R1.11 CO[C@H]1CCC[C@@H]1O AT11485 [1,0,0,1,0,0|2,0,0]=4 158 B8R1.11 CO[C@H]1CCC[C@@H]1O AT11487 [1,0,0,1,0,0|2,0,0]=4 159 B8R1.11 CO[C@H]1CCC[C@@H]1O AT11488 [1,0,0,1,0,0|2,0,0]=4 160 B8R1.11 N[C@H]1CCC[C@H]1CO AT21374 [1,0,0,1,0,0|2,0,0]=4 161 B8R1.12 CO[C@H]1CC[C@@H]1CO D79583 [1,0,0,1,0,0|2,0,0]=4 162 B8R1.22 C[C@H]1CCCCCN1 AT22104 [1,0,0,1,0,0|1,0,0]=3 163 B8R1.22 C[C@H]1CCNCCN1 AT20047 [1,0,0,1,0,0|2,0,0]=4 164 B8R1.22 C[C@H]1CCNCCN1 AT20048 [1,0,0,1,0,0|2,0,0]=4 165 B8R1.22 C[C@H]1CCNCCN1 AT20119 [1,0,0,1,0,0|2,0,0]=4 166 B8R1.22 C[C@H]1CNCCCN1 70846 [1,0,0,1,0,0|2,0,0]=4 167 B8R1.22 C[C@H]1CNCCCN1 AT20050 [1,0,0,1,0,0|2,0,0]=4 168 B8R1.22 C[C@H]1COCCCN1 AT11435 [1,0,0,1,0,0|1,1,0]=4 169 B8R1.22 F[C@H]1CCCNCC1 72531 [1,0,0,1,0,0|2,0,0]=4 170 B8R1.22 I[C@H]1CCCOCC1 55131 [1,0,0,1,0,0|1,1,0]=4 171 B8R1.22 N[C@H]1CCCCNC1 F13105 [1,0,0,1,0,0|2,0,0]=4 172 B8R1.22 O[C@H]1CCCCNC1 73004 [1,0,0,1,0,0|2,0,0]=4 173 B8R1.22 O[C@H]1CCCOCC1 55130 [1,0,0,1,0,0|1,1,0]=4 174 B8R1.36 CCCCC[C@H]1CO1 T72538 [1,0,0,1,0,0|1,0,0]=3 175 B8R1.49 C1CNCCCNC1 C90170 [1,0,0,1,0,0|2,0,0]=4 176 B10R1.10 CCCN1CCC[C@H](O)C1 AC5777 [0,1,0,1,0,0|2,0,0]=4 177 B10R1.10 CCC[C@H]1CC(=O)CCN1 C75784 [0,1,0,1,0,0|1,0,1]=4 178 B10R1.18 CC(C)C[C@H]1CNCCO1 F16046 [0,1,0,1,0,0|1,1,0]=4 179 B10R1.18 CC(C)C[C@H]1COCCN1 77680 [0,1,0,1,0,0|2,0,0]=4 180 B10R1.18 CN(C)C[C@H]1CCCCN1 72858 [0,1,0,1,0,0|2,0,0]=4 181 B10R1.18 CN(C)C[C@H]1CCCCN1 C77790 [0,1,0,1,0,0|2,0,0]=4 182 B10R1.18 CN(C)C[C@H]1CCCCN1 D76620 [0,1,0,1,0,0|2,0,0]=4 183 B10R1.18 C[C@H](N)CC1CCCCC1 N13140 [0,1,0,1,0,0|1,0,0]=3 184 B10R1.61 CC(C)[C@@H]1CNCCN1C AT24770 [0,1,0,1,0,0|2,0,0]=4 185 B10R1.11 N[C@@H](CCO)C1CCCC1 N12965 [0,1,0,1,0,0|2,0,0]=4 186 B10R1.21 COCCO[C@H]1CCNC1 63514 [0,1,0,1,0,0|1,1,0]=4 187 B10R1.29 CCCC[C@H]1CCCC1=O O10708 [0,1,0,1,0,0|1,0,1]=4 188 B10R1.85 NCCN1CCCCCC1 C11320 [0,1,0,1,0,0|2,0,0]=4 189 B10R1.85 OCCC1CCCCCC1 E10088 [0,1,0,1,0,0|1,0,0]=3 190 B10R1.377 CCC[N+]1(C)CCCCC1 T73061 [0,1,0,1,0,0|2,0,0]=4 191 B10R1.377 NC1(CCO)CCCCC1 F51933 [0,1,0,1,0,0|2,0,0]=4 192 B10R1.4 CCO[C@H]1COCC[C@H]1N D79025 [0,1,0,1,0,0|1,1,0]=4 193 B10R1.17 BrCCCN1CCOCC1 N11755 [0,1,0,1,0,0|2,0,0]=4 194 B10R1.17 CCCCC1CCNCC1 30336 [0,1,0,1,0,0|1,0,0]=3 195 B10R1.17 CNCCC1CCCCC1 P10203 [0,1,0,1,0,0|1,0,0]=3 196 B10R1.17 CNCCN1CCCCC1 S11703 [0,1,0,1,0,0|2,0,0]=4 197 B10R1.17 COCC[C@H]1CCCCN1 32735 [0,1,0,1,0,0|1,0,0]=3 198 B10R1.17 NCCCN1CCNCC1 C78275 [0,1,0,1,0,0|2,0,0]=4 199 B10R1.17 OCCCC1CCNCC1 I11792 [0,1,0,1,0,0|2,0,0]=4 200 B10R1.17 OCCC[C@H]1COCCN1 F13510 [0,1,0,1,0,0|2,0,0]=4 201 B10R1.5 CCN1CCC[C@@H]1CCN F50256 [0,1,0,1,0,0|2,0,0]=4 202 B10R1.5 CCN1CCC[C@@H]1CCN F50332 [0,1,0,1,0,0|2,0,0]=4 203 B10R1.161 CNC1CCCCCCC1 L10188 [0,1,0,1,0,0|1,0,0]=3 204 B10R1.1 CCCC1CCC(N)CC1 T71534 [0,1,0,1,0,0|1,0,0]=3 205 B10R1.1 NCCC1CCC(N)CC1 D88527 [0,1,0,1,0,0|2,0,0]=4 206 B10R1.15 CC[C@@H](C)[C@@H]1COCCN1 77682 [0,1,0,1,0,0|2,0,0]=4 207 B10R1.15 CC[C@@H](C)[C@@H]1COCCN1 77683 [0,1,0,1,0,0|2,0,0]=4 208 B10R1.15 CC[C@H](N)C1CCOCC1 53163 [0,1,0,1,0,0|2,0,0]=4 209 B10R1.15 CC[C@H](O)C1CCOCC1 AC9165 [0,1,0,1,0,0|2,0,0]=4 210 B10R1.15 N[C@@H](CO)C1CCCCC1 N11205 [0,1,0,1,0,0|2,0,0]=4 211 B10R1.27 CN[C@@H](C)CC1CCCC1 D84278 [0,1,0,1,0,0|2,0,0]=4 212 B10R2.61 O[C@@H]1C[C@H]2CCC[C@@H]1N2 P15058 [0,0,0,2,0,0|2,0,0]=4 213 B10R2.61 O[C@H]1C[C@H]2CCC[C@@H]1N2 P15059 [0,0,0,2,0,0|2,0,0]=4 214 B10R2.6 C1CC[C@@H](C2CC2)NC1 85768 [0,0,0,2,0,0|1,0,0]=3 215 B10R2.6 C1CN[C@H](C2CC2)CN1 D76639 [0,0,0,2,0,0|2,0,0]=4 216 B10R2.7 C1CC2CCOC2CN1 W19472 [0,0,0,2,0,0|1,1,0]=4 217 B10R2.7 C1CC2COCC2CN1 85311 [0,0,0,2,0,0|1,1,0]=4 218 B10R2.7 C1CCN2CCN[C@@H]2C1 D78691 [0,0,0,2,0,0|2,0,0]=4 219 B10R2.7 C1CC[C@@H]2CCC[C@@H]2C1 T72488 [0,0,0,2,0,0|1,0,0]=3 220 B10R2.7 C1CC[C@@H]2CCC[C@H]2C1 T72307 [0,0,0,2,0,0|1,0,0]=3 221 B10R2.7 C1CNC2CCCC2C1 CS1329 [0,0,0,2,0,0|1,0,0]=3 222 B10R2.7 C1CNC2CNCC2C1 O12035 [0,0,0,2,0,0|2,0,0]=4 223 B10R2.7 C1C[C@H]2CNCCN2C1 52494 [0,0,0,2,0,0|2,0,0]=4 224 B10R2.7 C1C[C@H]2CNCCN2C1 P14107 [0,0,0,2,0,0|2,0,0]=4 225 B10R2.320 NC1CC2OCCCC12 33458 [0,0,0,2,0,0|1,1,0]=4 226 B10R2.320 NC1CC2OCCCC12 70860 [0,0,0,2,0,0|1,1,0]=4 227 B10R2.408 C1CC2CNCC(C1)C2 32763 [0,0,0,2,0,0|2,0,0]=4 228 B10R2.408 C1CC2COCC(C1)N2 D72966 [0,0,0,2,0,0|2,0,0]=4 229 B10R2.484 C1CC2(C1)CNCCN2 67458 [0,0,0,2,0,0|2,0,0]=4 230 B10R2.484 C1CC2(C1)CNCCO2 W16011 [0,0,0,2,0,0|1,1,0]=4 231 B10R2.484 C1CCC2(CC1)CNC2 P11103 [0,0,0,2,0,0|2,0,0]=4 232 B10R2.484 C1CCC2(CC1)COC2 F52388 [0,0,0,2,0,0|2,0,0]=4 233 B10R2.484 C1CCC2(CNC2)OC1 S11518 [0,0,0,2,0,0|1,1,0]=4 234 B10R2.3 O[C@H]1CCC12CCCC2 84854 [0,0,0,2,0,0|2,0,0]=4 235 B10R2.32 CN1CC[C@@H]2CNC[C@@H]21 31633 [0,0,0,2,0,0|2,0,0]=4 236 B10R2.32 CN1CC[C@@H]2CNC[C@@H]21 AC1005 [0,0,0,2,0,0|2,0,0]=4 237 B10R2.32 CN1CC[C@@H]2CNC[C@@H]21 AC1077 [0,0,0,2,0,0|2,0,0]=4 238 B10R2.32 NC1CCN2CCCC12 C77499 [0,0,0,2,0,0|2,0,0]=4 239 B10R2.32 OC1CCC2CNCC12 C14365 [0,0,0,2,0,0|2,0,0]=4 240 B10R2.32 OC1CCC2CNCC12 F14273 [0,0,0,2,0,0|2,0,0]=4 241 B10R2.32 OC1CCN2CCCC12 D96831 [0,0,0,2,0,0|2,0,0]=4 242 B10R2.32 O[C@H]1CC[C@H]2CNC[C@@H]12 C77606 [0,0,0,2,0,0|2,0,0]=4 243 B10R2.32 O[C@H]1CC[C@H]2CNC[C@@H]12 P14020 [0,0,0,2,0,0|2,0,0]=4 244 B10R2.136 C1CCN(C2CNC2)C1 E10002 [0,0,0,2,0,0|2,0,0]=4 245 B10R2.483 C1CC[N+]2(C1)CCCC2 F16216 [0,0,0,2,0,0|1,0,0]=3 246 B10R2.483 C1CC[N+]2(C1)CCCC2 T70192 [0,0,0,2,0,0|1,0,0]=3 247 B10R2.483 C1CC[N+]2(C1)CCCC2 T70937 [0,0,0,2,0,0|1,0,0]=3 248 B10R2.41 CN1C2CCCC1CC2 F14365 [0,0,0,2,0,0|2,0,0]=4 249 B10R2.41 O[C@@H]1[C@H]2CC[C@@H]1CNC2 P12921 [0,0,0,2,0,0|2,0,0]=4 250 B10R2.41 O[C@H]1[C@H]2CC[C@@H]1CNC2 P12576 [0,0,0,2,0,0|2,0,0]=4 251 B10R2.109 OCC1CCC2CC2C1 AT14844 [0,0,0,2,0,0|2,0,0]=4 252 B10R2.192 C1CC(NC2COC2)C1 AT22670 [0,0,0,2,0,0|2,0,0]=4 253 B10R2.411 C1CC1COC2CNC2 57775 [0,0,0,2,0,0|1,1,0]=4 254 B10R2.411 C1CC1COC2CNC2 AT24449 [0,0,0,2,0,0|1,1,0]=4 255 B10R2.475 C1CNCCC2(C1)CC2 AT20039 [0,0,0,2,0,0|2,0,0]=4