0 B8R0.4 C=CCCNCCOC E72576 [0,0,0,0,0,0|3,0,0]=3 1 B8R0.4 CCC#CCCCCC T72039 [0,0,0,0,0,0|1,0,3]=4 2 B8R0.4 CNCCCCCCO AT11159 [0,0,0,0,0,0|1,0,2]=3 3 B8R0.4 COCCNCCCO FD7300 [0,0,0,0,0,0|2,0,2]=4 4 B8R0.4 ClCCCCCCCCl T71360 [0,0,0,0,0,0|2,0,1]=3 5 B8R0.4 NCCCCCCCO AT22494 [0,0,0,0,0,0|1,0,2]=3 6 B8R0.4 OCCCOCCCCl D84666 [0,0,0,0,0,0|2,0,2]=4 7 B7R0.1 C=CCCCCCCl I11994 [1,0,0,0,0,0|1,0,1]=3 8 B7R0.1 C=CCCCCCO F14745 [1,0,0,0,0,0|1,0,1]=3 9 B7R0.1 C=CC\C=C\CCC T72633 [1,0,0,0,0,0|0,0,3]=4 10 B7R0.1 CNCCCCCO AT11157 [1,0,0,0,0,0|1,0,1]=3 11 B7R0.1 CNCCCCCO AT11158 [1,0,0,0,0,0|1,0,1]=3 12 B7R0.1 COCCNCCO AT12488 [1,0,0,0,0,0|2,0,1]=4 13 B7R0.1 COCCOCCN F50617 [1,0,0,0,0,0|3,0,0]=4 14 B7R0.1 COCCOCCS AT10124 [1,0,0,0,0,0|2,1,0]=4 15 B7R0.1 C\C=C/CCCCC T72919 [1,0,0,0,0,0|1,0,1]=3 16 B7R0.1 NCCSCCCO AT25557 [1,0,0,0,0,0|2,0,1]=4 17 B7R0.1 O=CCCCCCCl 24359 [1,0,0,0,0,0|1,0,0]=2 18 B7R0.1 OCCCCCCI AT14272 [1,0,0,0,0,0|1,0,1]=3 19 B7R0.1 OCCCNCCO FD7298 [1,0,0,0,0,0|2,0,1]=4 20 B9R0.2 CC(C)CCCCCCO D98911 [0,1,0,0,0,0|0,0,2]=3 21 B9R0.2 CNCCCCCC(=O)O AT21580 [0,1,0,0,0,0|1,0,0]=2 22 B9R0.2 NCCCCCCC(N)=O AC7480 [0,1,0,0,0,0|1,0,0]=2 23 B9R0.2 [N-]=[N+]=NCCCCC(=O)O D88530 [0,1,0,0,0,0|3,0,0]=4 24 B9R0.18 CCCCC(C)CCCC T71863 [0,1,0,0,0,0|1,0,1]=3 25 B9R0.45 C=CCCCCCCCC T73018 [0,1,0,0,0,0|1,0,0]=2 26 B9R0.45 CC#CCCCCCCC H11435 [0,1,0,0,0,0|1,0,1]=3 27 B9R0.45 C\C=C/CCCCCCC T70533 [0,1,0,0,0,0|1,0,0]=2 28 B9R0.45 NCCCCNCCCN T72522 [0,1,0,0,0,0|2,0,1]=4 29 B9R0.46 CCCCCC[C@@H](C)CC T72672 [0,1,0,0,0,0|1,0,1]=3 30 B9R0.46 CCCCCC[C@H](O)CO C16570 [0,1,0,0,0,0|0,0,2]=3 31 B9R0.46 CC[C@H](C)CCCCCO T71591 [0,1,0,0,0,0|0,0,2]=3 32 B9R0.46 OCCCCC[C@H](O)CO T72391 [0,1,0,0,0,0|1,0,2]=4 33 B9R1.5 CN1CCNCCC1=O AT20060 [0,0,0,1,0,0|2,0,0]=3 34 B9R1.5 C[C@@H]1OCCCNC1=O 73063 [0,0,0,1,0,0|2,0,0]=3 35 B9R1.5 C[C@H]1CCNCCN1C AC6586 [0,0,0,1,0,0|3,0,0]=4 36 B9R1.5 N[C@H]1CCCCC[C@@H]1O AT10930 [0,0,0,1,0,0|1,0,2]=4 37 B9R1.5 N[C@H]1CSCCNC1=O C16734 [0,0,0,1,0,0|3,0,0]=4 38 B9R1.5 O=C1CCCCC[C@@H]1Br AT20921 [0,0,0,1,0,0|1,0,0]=2 39 B9R1.5 O=C1CCCCC[C@@H]1Cl T71318 [0,0,0,1,0,0|1,0,0]=2 40 B9R1.5 O=C1CCNCC[C@@H]1Br C90706 [0,0,0,1,0,0|2,0,0]=3 41 B9R1.5 O=C1NCCCC[C@@H]1Br F50955 [0,0,0,1,0,0|2,0,0]=3 42 B9R1.8 C#CCC1CCNCC1 AT11974 [0,0,0,1,0,0|2,0,1]=4 43 B9R1.8 C#CC[C@H]1CCCNC1 AT11977 [0,0,0,1,0,0|2,0,1]=4 44 B9R1.8 C=CCN1CCSCC1 F16794 [0,0,0,1,0,0|3,0,0]=4 45 B9R1.8 C=CC[C@H]1CCCCN1 A51152 [0,0,0,1,0,0|2,0,0]=3 46 B9R1.8 CCCC1CCNCC1 C75224 [0,0,0,1,0,0|2,0,1]=4 47 B9R1.8 CCC[C@H]1CCCCN1 F16887 [0,0,0,1,0,0|1,0,1]=3 48 B9R1.8 CNCC1CCCCC1 P19116 [0,0,0,1,0,0|2,0,0]=3 49 B9R1.8 CNCC1CCOCC1 71672 [0,0,0,1,0,0|3,0,0]=4 50 B9R1.8 CNC[C@H]1CCCCO1 F16332 [0,0,0,1,0,0|1,0,2]=4 51 B9R1.8 COC[C@H]1CCCCN1 31181 [0,0,0,1,0,0|2,0,1]=4 52 B9R1.8 COC[C@H]1CCCCN1 Y11003 [0,0,0,1,0,0|2,0,1]=4 53 B9R1.8 COC[C@H]1CCCNC1 C78400 [0,0,0,1,0,0|3,0,0]=4 54 B9R1.8 N#CCC1CCNCC1 32762 [0,0,0,1,0,0|2,0,1]=4 55 B9R1.8 N#CC[C@H]1CCCOC1 AT23687 [0,0,0,1,0,0|2,0,1]=4 56 B9R1.8 NCCC1CCNCC1 65278 [0,0,0,1,0,0|2,0,1]=4 57 B9R1.8 NCC[C@H]1CCCCN1 D76613 [0,0,0,1,0,0|2,0,1]=4 58 B9R1.8 NCC[C@H]1CCCCO1 SC1551 [0,0,0,1,0,0|1,0,2]=4 59 B9R1.8 NCC[C@H]1CCCNC1 D76642 [0,0,0,1,0,0|2,0,1]=4 60 B9R1.8 NCC[C@H]1CCCOC1 AT23688 [0,0,0,1,0,0|2,0,1]=4 61 B9R1.8 NCC[C@H]1CCCOC1 AT23689 [0,0,0,1,0,0|2,0,1]=4 62 B9R1.8 NNCC1CCCCC1 P11239 [0,0,0,1,0,0|2,0,0]=3 63 B9R1.8 O=CCN1CCOCC1 F17543 [0,0,0,1,0,0|2,0,0]=3 64 B9R1.8 OCC[C@H]1CCCOC1 AT23679 [0,0,0,1,0,0|1,0,2]=4 65 B9R1.12 BrCCCN1CCCC1 D88134 [0,0,0,1,0,0|2,0,1]=4 66 B9R1.12 C=CCO[C@H]1CCNC1 AT22522 [0,0,0,1,0,0|3,0,0]=4 67 B9R1.12 C=CCO[C@H]1CCNC1 AT22523 [0,0,0,1,0,0|3,0,0]=4 68 B9R1.12 C=CCO[C@H]1CCNC1 AT22524 [0,0,0,1,0,0|3,0,0]=4 69 B9R1.12 CCCC[C@H]1CCCN1 N12661 [0,0,0,1,0,0|1,0,1]=3 70 B9R1.12 CNCCC1CCCC1 P11107 [0,0,0,1,0,0|2,0,0]=3 71 B9R1.12 CNCC[C@H]1CCCO1 F20641 [0,0,0,1,0,0|1,0,2]=4 72 B9R1.12 NCCCC1CCCC1 F20043 [0,0,0,1,0,0|1,0,1]=3 73 B9R1.12 NCCOC1CCCC1 AC3097 [0,0,0,1,0,0|2,0,1]=4 74 B9R1.15 CCC1CCCCC1C T72380 [0,0,0,1,0,0|1,0,1]=3 75 B9R1.15 CCC1CCCCC1O D90497 [0,0,0,1,0,0|0,0,2]=3 76 B9R1.15 CCN1CCCNC1=O AT26678 [0,0,0,1,0,0|2,0,0]=3 77 B9R1.15 CC[C@H]1CNCCC1=O O11002 [0,0,0,1,0,0|1,0,0]=2 78 B9R1.15 CN[C@H]1CNCC[C@H]1C 44571 [0,0,0,1,0,0|3,0,0]=4 79 B9R1.15 COC1CCCCC1N C77572 [0,0,0,1,0,0|2,0,1]=4 80 B9R1.15 COC1CNCCC1C 33459 [0,0,0,1,0,0|3,0,0]=4 81 B9R1.15 CO[C@H]1CCCC[C@@H]1N 89668 [0,0,0,1,0,0|2,0,1]=4 82 B9R1.15 CO[C@H]1CCCC[C@@H]1O A12017 [0,0,0,1,0,0|1,0,2]=4 83 B9R1.15 N#CC1CCCCC1N AT21039 [0,0,0,1,0,0|2,0,1]=4 84 B9R1.15 N#C[C@H]1CCNCC1=O AB9876 [0,0,0,1,0,0|2,0,1]=4 85 B9R1.15 NCC1CCCCC1O C77667 [0,0,0,1,0,0|1,0,2]=4 86 B9R1.15 N[C@H]1CCCC[C@@H]1CO C80022 [0,0,0,1,0,0|1,0,2]=4 87 B9R1.15 O=C1CCCC[C@@H]1CO F18113 [0,0,0,1,0,0|1,0,0]=2 88 B9R1.15 O=C[C@@H]1CCCCC1=O AT23975 [0,0,0,1,0,0|1,0,1]=3 89 B9R1.33 CN1CCC[C@@H]1CCN P11249 [0,0,0,1,0,0|2,0,1]=4 90 B9R1.33 CN1CCC[C@@H]1CCN P15959 [0,0,0,1,0,0|2,0,1]=4 91 B9R1.33 CN1CCC[C@@H]1CCN P17927 [0,0,0,1,0,0|2,0,1]=4 92 B9R1.33 COC[C@H]1CCCN1N 80504 [0,0,0,1,0,0|3,0,0]=4 93 B9R1.33 COC[C@H]1CCCN1N D87929 [0,0,0,1,0,0|3,0,0]=4 94 B9R1.33 COC[C@H]1CCNC1=O AT19084 [0,0,0,1,0,0|2,0,0]=3 95 B9R1.33 N#CCN1CCCC1=O W15995 [0,0,0,1,0,0|2,0,1]=4 96 B9R1.33 O=C1NCC[C@@H]1CCO AT19068 [0,0,0,1,0,0|2,0,0]=3 97 B9R1.33 O=C1OCCN1CCBr AT18747 [0,0,0,1,0,0|3,0,0]=4 98 B9R1.89 CN[C@H]1CCCCNC1 97599 [0,0,0,1,0,0|3,0,0]=4 99 B9R1.89 CN[C@H]1CCCCNC1 97600 [0,0,0,1,0,0|3,0,0]=4 100 B9R1.89 O=CC1CCCCCC1 AT13628 [0,0,0,1,0,0|0,0,0]=1 101 B9R1.89 OC[C@H]1CCCNCC1 73020 [0,0,0,1,0,0|1,0,2]=4 102 B6R0.6 CCNCCSC AT25567 [2,0,0,0,0,0|2,0,0]=4 103 B6R0.6 CNCCCOC F15969 [2,0,0,0,0,0|2,0,0]=4 104 B6R0.6 COCCCCN C77605 [2,0,0,0,0,0|2,0,0]=4 105 B6R0.6 O=CNCCCO AC9004 [2,0,0,0,0,0|2,0,0]=4 106 B6R0.6 [2H]OCCCCC D99155 [2,0,0,0,0,0|2,0,0]=4 107 B8R0.1 CCCC[C@H](N)CCO D73273 [1,1,0,0,0,0|0,0,1]=3 108 B8R0.6 C#C[C@@H](O)CCCCC 51060 [1,1,0,0,0,0|0,0,2]=4 109 B8R0.6 C#C[C@@H](O)CCCCC T72294 [1,1,0,0,0,0|0,0,2]=4 110 B8R0.6 CC[C@H](C)CCCCO T72651 [1,1,0,0,0,0|0,0,1]=3 111 B8R0.7 CC(=O)NCCCCN S12336 [1,1,0,0,0,0|2,0,0]=4 112 B8R0.7 CCCCC#CC(=O)O T71801 [1,1,0,0,0,0|0,0,2]=4 113 B8R0.7 CCCCNCC(=O)O D87235 [1,1,0,0,0,0|1,0,0]=3 114 B8R0.7 CNCCCNC(C)=O C78307 [1,1,0,0,0,0|2,0,0]=4 115 B8R0.7 NC(=O)CCCCCO AC6170 [1,1,0,0,0,0|1,0,0]=3 116 B8R0.7 O=C(O)CCOCCBr C70446 [1,1,0,0,0,0|2,0,0]=4 117 B8R0.7 O=C(O)CCOCCO C70447 [1,1,0,0,0,0|2,0,0]=4 118 B8R0.7 [2H][C@H](Br)CCCCCC D99523 [1,1,0,0,0,0|1,0,0]=3 119 B8R0.7 [2H][C@H](O)CCCCCC D99646 [1,1,0,0,0,0|0,0,1]=3 120 B10R0.4 C=CCCCCCOC(C)=O T72533 [0,2,0,0,0,0|0,0,2]=4 121 B10R0.4 CC(C)CCCCCCC=O D86949 [0,2,0,0,0,0|0,0,0]=2 122 B10R0.4 CC(C)CCCCCCCO D98228 [0,2,0,0,0,0|0,0,2]=4 123 B10R0.4 CCCCCC\C=C\C(=O)O A11728 [0,2,0,0,0,0|0,0,1]=3 124 B10R0.4 O=C(O)COCCOCCBr C90635 [0,2,0,0,0,0|2,0,0]=4 125 B10R0.4 O=C(O)COCCOCCCl D71995 [0,2,0,0,0,0|2,0,0]=4 126 B10R0.6 CCCCC[C@H](N)CC(=O)O D88166 [0,2,0,0,0,0|0,0,0]=2 127 B10R0.6 NCCCC[C@H](N)CC(=O)O FD10271 [0,2,0,0,0,0|1,0,0]=3 128 B10R0.6 NCCCC[C@H](N)CC(=O)O FD10272 [0,2,0,0,0,0|1,0,0]=3 129 B10R0.6 NCCCC[C@H](N)CC(=O)O FD10302 [0,2,0,0,0,0|1,0,0]=3 130 B10R0.22 [2H]C([2H])(I)CCCCCCC D98871 [0,2,0,0,0,0|1,0,1]=4 131 B10R0.22 [2H]C([2H])(O)CCCCCCC D98285 [0,2,0,0,0,0|0,0,2]=4 132 B10R0.74 CCCCCCC[C@H](O)CO T72466 [0,2,0,0,0,0|0,0,2]=4 133 B10R0.74 COC(=O)CCCCCC=O A51072 [0,2,0,0,0,0|0,0,1]=3 134 B10R0.74 COC(=O)CCCCCCN F19219 [0,2,0,0,0,0|1,0,0]=3 135 B10R0.74 OCCCCCC[C@H](O)CO T72401 [0,2,0,0,0,0|0,0,2]=4 136 B10R0.91 CCCCC[C@@H](O)CCCC T70997 [0,2,0,0,0,0|1,0,1]=4 137 B10R0.91 CCCCC[C@H](O)\C=C\C=O AC8369 [0,2,0,0,0,0|0,0,1]=3 138 B10R0.71 OCCOCCCCCCCl D71999 [0,2,0,0,0,0|0,0,2]=4 139 B8R1.2 BrCC1CCNCC1 30601 [1,0,0,1,0,0|2,0,0]=4 140 B8R1.2 CC[C@H]1CCCCN1 N11156 [1,0,0,1,0,0|1,0,0]=3 141 B8R1.2 CC[C@H]1CNCCO1 D75750 [1,0,0,1,0,0|1,0,1]=4 142 B8R1.2 CC[C@H]1COCCN1 F19074 [1,0,0,1,0,0|2,0,0]=4 143 B8R1.2 CNC1CCCCC1 S12279 [1,0,0,1,0,0|1,0,1]=4 144 B8R1.2 CO[C@@H]1C=CCCC1 D91600 [1,0,0,1,0,0|1,0,1]=4 145 B8R1.2 ICC1CCNCC1 AC3914 [1,0,0,1,0,0|2,0,0]=4 146 B8R1.2 O=CC1CCNCC1 62056 [1,0,0,1,0,0|1,0,0]=3 147 B8R1.2 SCC1CCOCC1 P16932 [1,0,0,1,0,0|1,1,0]=4 148 B8R1.5 CC1CCNCC1O 38881 [1,0,0,1,0,0|1,0,1]=4 149 B8R1.5 CC1COCCC1N F13602 [1,0,0,1,0,0|2,0,0]=4 150 B8R1.5 CC1NCCCC1O W19147 [1,0,0,1,0,0|1,0,1]=4 151 B8R1.5 CN1CCCCC1=O C16744 [1,0,0,1,0,0|1,0,0]=3 152 B8R1.5 CN1CCSCC1=O AT12016 [1,0,0,1,0,0|2,0,0]=4 153 B8R1.5 C[C@@H]1CCNC[C@@H]1O 38884 [1,0,0,1,0,0|1,0,1]=4 154 B8R1.5 C[C@@H]1CNCC[C@@H]1O A11539 [1,0,0,1,0,0|1,0,1]=4 155 B8R1.5 C[C@H]1CCNCC1=O P13522 [1,0,0,1,0,0|1,0,0]=3 156 B8R1.5 C[C@H]1CCNC[C@@H]1O P12384 [1,0,0,1,0,0|1,0,1]=4 157 B8R1.5 C[C@H]1CCNC[C@@H]1O W19323 [1,0,0,1,0,0|1,0,1]=4 158 B8R1.5 C[C@H]1CCOCC1=O F53480 [1,0,0,1,0,0|1,0,0]=3 159 B8R1.5 NC1CCCCC1O F13372 [1,0,0,1,0,0|1,0,1]=4 160 B8R1.5 N[C@@H]1CCCC[C@@H]1F AT23366 [1,0,0,1,0,0|2,0,0]=4 161 B8R1.5 N[C@@H]1CCCC[C@@H]1O F53834 [1,0,0,1,0,0|1,0,1]=4 162 B8R1.5 N[C@H]1CCCNC1=O 51548 [1,0,0,1,0,0|2,0,0]=4 163 B8R1.5 O=C1CCNC[C@@H]1Br F13559 [1,0,0,1,0,0|2,0,0]=4 164 B8R1.5 O=C1CCNC[C@@H]1Br F13560 [1,0,0,1,0,0|2,0,0]=4 165 B8R1.5 O=C1CCNC[C@@H]1F P11685 [1,0,0,1,0,0|2,0,0]=4 166 B8R1.8 C=CC[C@H]1CCCN1 N15483 [1,0,0,1,0,0|1,0,1]=4 167 B8R1.8 CCC[C@H]1CCCN1 N12832 [1,0,0,1,0,0|1,0,0]=3 168 B8R1.8 CNCC1CCCC1 A11546 [1,0,0,1,0,0|1,0,1]=4 169 B8R1.8 COC[C@H]1CCCN1 C77885 [1,0,0,1,0,0|2,0,0]=4 170 B8R1.8 NCCC1CCCC1 23497 [1,0,0,1,0,0|1,0,0]=3 171 B8R1.8 NCC[C@H]1CCCO1 AT11471 [1,0,0,1,0,0|1,0,1]=4 172 B8R1.8 O=CCN1CCCC1 AC9721 [1,0,0,1,0,0|1,0,0]=3 173 B8R1.8 OCC[C@H]1CCCO1 56770 [1,0,0,1,0,0|1,0,1]=4 174 B8R1.8 OCC[C@H]1CCNC1 C16745 [1,0,0,1,0,0|1,0,1]=4 175 B8R1.8 OCC[C@H]1CCNC1 D84329 [1,0,0,1,0,0|1,0,1]=4 176 B8R1.10 CNCCC1CCC1 P12905 [1,0,0,1,0,0|1,0,1]=4 177 B8R1.10 CNCC[C@H]1CCN1 F50261 [1,0,0,1,0,0|2,0,0]=4 178 B8R1.10 COCC[C@H]1CCN1 F50258 [1,0,0,1,0,0|2,0,0]=4 179 B8R1.10 COCC[C@H]1CCN1 F50334 [1,0,0,1,0,0|2,0,0]=4 180 B8R1.11 CC1COCC1CCl 50130 [1,0,0,1,0,0|2,0,0]=4 181 B8R1.11 CC1COCC1CO 50120 [1,0,0,1,0,0|1,0,1]=4 182 B8R1.11 CC[C@H]1CCNC1=O AT18851 [1,0,0,1,0,0|1,0,0]=3 183 B8R1.11 CO[C@H]1CCCC1=O AT25997 [1,0,0,1,0,0|1,0,0]=3 184 B8R1.11 CO[C@H]1CCC[C@@H]1N AT13762 [1,0,0,1,0,0|2,0,0]=4 185 B8R1.11 CO[C@H]1CCC[C@@H]1O AT11485 [1,0,0,1,0,0|1,0,1]=4 186 B8R1.11 CO[C@H]1CCC[C@@H]1O AT11487 [1,0,0,1,0,0|1,0,1]=4 187 B8R1.11 CO[C@H]1CCC[C@@H]1O AT11488 [1,0,0,1,0,0|1,0,1]=4 188 B8R1.11 N[C@H]1CCC[C@H]1CO AT21374 [1,0,0,1,0,0|1,0,1]=4 189 B8R1.12 CO[C@H]1CC[C@@H]1CO D79583 [1,0,0,1,0,0|1,0,1]=4 190 B8R1.22 C[C@H]1CCCCCN1 AT22104 [1,0,0,1,0,0|1,0,0]=3 191 B8R1.22 C[C@H]1CCNCCN1 AT20047 [1,0,0,1,0,0|2,0,0]=4 192 B8R1.22 C[C@H]1CCNCCN1 AT20048 [1,0,0,1,0,0|2,0,0]=4 193 B8R1.22 C[C@H]1CCNCCN1 AT20119 [1,0,0,1,0,0|2,0,0]=4 194 B8R1.22 C[C@H]1CNCCCN1 70846 [1,0,0,1,0,0|2,0,0]=4 195 B8R1.22 C[C@H]1CNCCCN1 AT20050 [1,0,0,1,0,0|2,0,0]=4 196 B8R1.22 C[C@H]1COCCCN1 AT11435 [1,0,0,1,0,0|2,0,0]=4 197 B8R1.22 F[C@H]1CCCNCC1 72531 [1,0,0,1,0,0|2,0,0]=4 198 B8R1.22 I[C@H]1CCCOCC1 55131 [1,0,0,1,0,0|2,0,0]=4 199 B8R1.22 N[C@H]1CCCCNC1 F13105 [1,0,0,1,0,0|2,0,0]=4 200 B8R1.22 O[C@H]1CCCCNC1 73004 [1,0,0,1,0,0|1,0,1]=4 201 B8R1.22 O[C@H]1CCCOCC1 55130 [1,0,0,1,0,0|1,0,1]=4 202 B8R1.36 CCCCC[C@H]1CO1 T72538 [1,0,0,1,0,0|0,0,1]=3 203 B8R1.49 C1CNCCCNC1 C90170 [1,0,0,1,0,0|2,0,0]=4 204 B10R1.10 CCC[C@H]1CC(=O)CCN1 C75784 [0,1,0,1,0,0|1,0,0]=3 205 B10R1.18 CC(=O)CN1CCOCC1 F30141 [0,1,0,1,0,0|2,0,0]=4 206 B10R1.18 CC(=O)OC1CCNCC1 95803 [0,1,0,1,0,0|2,0,0]=4 207 B10R1.18 C[C@H](N)CC1CCCCC1 N13140 [0,1,0,1,0,0|1,0,1]=4 208 B10R1.18 NC(=O)CC1CCNCC1 AC9776 [0,1,0,1,0,0|1,0,0]=3 209 B10R1.18 NC(=O)CC1CCOCC1 C14576 [0,1,0,1,0,0|1,0,0]=3 210 B10R1.18 NC(=O)CN1CCNCC1 O10537 [0,1,0,1,0,0|2,0,0]=4 211 B10R1.18 NC(=O)NC1CCNCC1 AT22990 [0,1,0,1,0,0|2,0,0]=4 212 B10R1.18 O=C(Cl)OC1CCOCC1 C77597 [0,1,0,1,0,0|2,0,0]=4 213 B10R1.18 O=C(O)CN1CCSCC1 AT25287 [0,1,0,1,0,0|2,0,0]=4 214 B10R1.18 O=C(O)CN1CCSCC1 W18219 [0,1,0,1,0,0|2,0,0]=4 215 B10R1.18 O=C(O)C[C@H]1CCCCN1 AC1465 [0,1,0,1,0,0|1,0,0]=3 216 B10R1.18 O=C(O)C[C@H]1CCCNC1 AC3441 [0,1,0,1,0,0|1,0,0]=3 217 B10R1.18 O=C(O)C[C@H]1CNCCN1 S11349 [0,1,0,1,0,0|2,0,0]=4 218 B10R1.18 O=C(O)C[C@H]1COCCN1 77662 [0,1,0,1,0,0|2,0,0]=4 219 B10R1.18 O=C(O)C[C@H]1COCCN1 77663 [0,1,0,1,0,0|2,0,0]=4 220 B10R1.18 O=C(O)C[C@H]1COCCN1 77664 [0,1,0,1,0,0|2,0,0]=4 221 B10R1.18 O=C(O)C[C@H]1COCCO1 39095 [0,1,0,1,0,0|2,0,0]=4 222 B10R1.39 CCN1CCC[C@H]1C(N)=O T72395 [0,1,0,1,0,0|1,0,0]=3 223 B10R1.61 CC(C)N1CCNCC1=O C71601 [0,1,0,1,0,0|2,0,0]=4 224 B10R1.61 CC1CCCCC1B(O)O D96319 [0,1,0,1,0,0|1,0,1]=4 225 B10R1.61 CC1CNCCC1C(=O)O 33568 [0,1,0,1,0,0|1,0,0]=3 226 B10R1.61 CN1CCNC[C@H]1C(=O)O C14452 [0,1,0,1,0,0|2,0,0]=4 227 B10R1.61 CN1CCNC[C@H]1C(=O)O F13276 [0,1,0,1,0,0|2,0,0]=4 228 B10R1.61 C[C@@H]1CCCN[C@@H]1C(=O)O 92901 [0,1,0,1,0,0|1,0,0]=3 229 B10R1.61 C[C@@H]1CCCN[C@@H]1C(=O)O AT11559 [0,1,0,1,0,0|1,0,0]=3 230 B10R1.61 C[C@@H]1NCCC[C@@H]1C(=O)O AT23064 [0,1,0,1,0,0|1,0,0]=3 231 B10R1.61 C[C@H](O)C1=C(Br)CCCC1 E70225 [0,1,0,1,0,0|1,0,1]=4 232 B10R1.61 C[C@H]1CCCC=C1C(=O)O AT26703 [0,1,0,1,0,0|0,0,2]=4 233 B10R1.61 NC(=O)C1CCCCC1N AT21040 [0,1,0,1,0,0|1,0,0]=3 234 B10R1.61 NC1CCCCC1C(=O)O 71292 [0,1,0,1,0,0|1,0,0]=3 235 B10R1.61 N[C@H]1COCC[C@H]1C(=O)O AT19404 [0,1,0,1,0,0|2,0,0]=4 236 B10R1.61 O=C1CCCC[C@H]1C(F)F F53615 [0,1,0,1,0,0|1,0,0]=3 237 B10R1.64 CC(=O)CN1CCC[C@@H]1C F50240 [0,1,0,1,0,0|1,0,0]=3 238 B10R1.64 CC(=O)CN1CCC[C@@H]1C F50307 [0,1,0,1,0,0|1,0,0]=3 239 B10R1.64 CC(=O)CN1CCC[C@@H]1C F50425 [0,1,0,1,0,0|1,0,0]=3 240 B10R1.64 CC(=O)N[C@H]1CCC[C@@H]1O AC4019 [0,1,0,1,0,0|2,0,0]=4 241 B10R1.66 NC(=O)COC1CCCC1 AC6964 [0,1,0,1,0,0|1,0,0]=3 242 B10R1.133 C=CC[C@H]1CCC[C@]1(C)O F50030 [0,1,0,1,0,0|1,0,0]=3 243 B10R1.348 O=C(O)[C@@H]1CCCCCN1 98384 [0,1,0,1,0,0|1,0,0]=3 244 B10R1.348 O=C(O)[C@H]1CCCNCC1 98343 [0,1,0,1,0,0|1,0,0]=3 245 B10R1.11 N[C@@H](CCO)C1CCCC1 N12965 [0,1,0,1,0,0|0,0,2]=4 246 B10R1.19 CCN1CCCNCC1=O AT20058 [0,1,0,1,0,0|1,0,0]=3 247 B10R1.19 N#C[C@H]1CCCCCC1=O AC9253 [0,1,0,1,0,0|0,0,1]=3 248 B10R1.29 CCCC[C@H]1CCCC1=O O10708 [0,1,0,1,0,0|0,0,0]=2 249 B10R1.29 CNCCN1CCOC1=O AT18746 [0,1,0,1,0,0|2,0,0]=4 250 B10R1.29 COCC[C@H]1CCNC1=O AT19072 [0,1,0,1,0,0|1,0,0]=3 251 B10R1.29 N#CCC[C@H]1CCCC1=O AC8276 [0,1,0,1,0,0|0,0,1]=3 252 B10R1.29 NCCCN1CCOC1=O AT18744 [0,1,0,1,0,0|2,0,0]=4 253 B10R1.29 O=C1OCCN1CCCO AT18745 [0,1,0,1,0,0|2,0,0]=4 254 B10R1.85 NCCN1CCCCCC1 C11320 [0,1,0,1,0,0|1,0,1]=4 255 B10R1.85 OCCC1CCCCCC1 E10088 [0,1,0,1,0,0|0,0,2]=4 256 B10R1.377 NC1(CCO)CCCCC1 F51933 [0,1,0,1,0,0|0,0,2]=4 257 B10R1.4 C=CC[C@H]1CCCOC1=O F13527 [0,1,0,1,0,0|0,0,2]=4 258 B10R1.4 NCCN1CCCCC1=O 71801 [0,1,0,1,0,0|1,0,0]=3 259 B10R1.4 O=C1CCCCN1CCO D96983 [0,1,0,1,0,0|1,0,0]=3 260 B10R1.4 O=C1NCCN[C@H]1CCO D86969 [0,1,0,1,0,0|2,0,0]=4 261 B10R1.17 CCCCC1CCNCC1 30336 [0,1,0,1,0,0|1,0,1]=4 262 B10R1.17 CNCCC1CCCCC1 P10203 [0,1,0,1,0,0|1,0,1]=4 263 B10R1.17 CNCCN1CCCCC1 S11703 [0,1,0,1,0,0|2,0,0]=4 264 B10R1.17 COCC[C@H]1CCCCN1 32735 [0,1,0,1,0,0|1,0,1]=4 265 B10R1.17 O=CCO[C@@H]1CCCCO1 C16249 [0,1,0,1,0,0|1,0,0]=3 266 B10R1.17 OCCCC1CCNCC1 I11792 [0,1,0,1,0,0|0,0,2]=4 267 B10R1.30 CCN1C[C@H](C)NCC1=O F19820 [0,1,0,1,0,0|2,0,0]=4 268 B10R1.5 C=CCN1CCC[C@@H]1CN O10189 [0,1,0,1,0,0|2,0,0]=4 269 B10R1.5 CCN1CCC[C@@H]1CCN F50256 [0,1,0,1,0,0|1,0,1]=4 270 B10R1.5 CCN1CCC[C@@H]1CCN F50332 [0,1,0,1,0,0|1,0,1]=4 271 B10R1.5 COC[C@H]1CCCN1C=O T72745 [0,1,0,1,0,0|1,0,0]=3 272 B10R1.161 CNC1CCCCCCC1 L10188 [0,1,0,1,0,0|1,0,1]=4 273 B10R1.161 O=NN1CCCCCCC1 T72064 [0,1,0,1,0,0|1,0,0]=3 274 B10R1.1 CCCC1CCC(N)CC1 T71534 [0,1,0,1,0,0|1,0,1]=4 275 B10R1.1 NCCC1CCC(N)CC1 D88527 [0,1,0,1,0,0|1,0,1]=4 276 B10R1.15 N[C@@H](CO)C1CCCCC1 N11205 [0,1,0,1,0,0|0,0,2]=4 277 B10R1.15 O=C[C@@H](F)C1CCOCC1 C93349 [0,1,0,1,0,0|1,0,0]=3 278 B10R1.27 CN[C@@H](C)CC1CCCC1 D84278 [0,1,0,1,0,0|2,0,0]=4 279 B10R1.94 CN1CC[C@H](CCN)C1=O AT19080 [0,1,0,1,0,0|2,0,0]=4 280 B10R2.178 O=C1CCC2CCC1C2 AT22812 [0,0,0,2,0,0|0,0,0]=2 281 B10R2.6 C1CC[C@@H](C2CC2)NC1 85768 [0,0,0,2,0,0|1,0,1]=4 282 B10R2.7 C1=CCC2CNCC2C1 F13335 [0,0,0,2,0,0|2,0,0]=4 283 B10R2.7 C1=CCC2CNCC2C1 P11375 [0,0,0,2,0,0|2,0,0]=4 284 B10R2.7 C1=CC[C@H]2CNC[C@H]2C1 F14019 [0,0,0,2,0,0|2,0,0]=4 285 B10R2.7 C1CC[C@@H]2CCC[C@@H]2C1 T72488 [0,0,0,2,0,0|1,0,1]=4 286 B10R2.7 C1CC[C@@H]2CCC[C@H]2C1 T72307 [0,0,0,2,0,0|1,0,1]=4 287 B10R2.7 C1CN=C2NCC[C@H]2C1 D78608 [0,0,0,2,0,0|2,0,0]=4 288 B10R2.7 C1CNC2CCCC2C1 CS1329 [0,0,0,2,0,0|1,0,1]=4 289 B10R2.320 O=C1NC2CCCCC12 F18199 [0,0,0,2,0,0|1,0,0]=3 290 B10R2.408 C1CC2CNCC(C1)C2 32763 [0,0,0,2,0,0|2,0,0]=4 291 B10R2.484 C1CCC2(CC1)CNC2 P11103 [0,0,0,2,0,0|2,0,0]=4 292 B10R2.484 C1CCC2(CC1)COC2 F52388 [0,0,0,2,0,0|2,0,0]=4 293 B10R2.3 O=C1CCC12CCCC2 84855 [0,0,0,2,0,0|0,0,0]=2 294 B10R2.3 O[C@H]1CCC12CCCC2 84854 [0,0,0,2,0,0|0,0,2]=4 295 B10R2.4 O=CC1CC12CCOC2 AT21237 [0,0,0,2,0,0|1,0,0]=3 296 B10R2.32 O=C1CCN2CCC[C@@H]12 F14126 [0,0,0,2,0,0|1,0,0]=3 297 B10R2.32 O=C1COC2OCCC12 91362 [0,0,0,2,0,0|2,0,0]=4 298 B10R2.15 O=C1NCCOC12CC2 P18024 [0,0,0,2,0,0|2,0,0]=4 299 B10R2.20 CN1C2CCC1C(=O)C2 F13958 [0,0,0,2,0,0|1,0,0]=3 300 B10R2.41 CN1C2C=CCC1CC2 C75478 [0,0,0,2,0,0|2,0,0]=4 301 B10R2.41 CN1C2CCCC1CC2 F14365 [0,0,0,2,0,0|2,0,0]=4 302 B10R2.109 OCC1CCC2CC2C1 AT14844 [0,0,0,2,0,0|0,0,2]=4 303 B10R2.190 O=C1OCCC12CCC2 33776 [0,0,0,2,0,0|1,0,0]=3 304 B10R2.2 O=C1CC2CCOC2O1 D74390 [0,0,0,2,0,0|2,0,0]=4 305 B10R2.60 O=C1CC2CC1CC2=O AC5793 [0,0,0,2,0,0|1,0,1]=4