0 B9R0.45 BrCCCCCCCCBr AMY11217 [0,0,0,0,0,0|2,0,1]=3 1 B9R0.45 C=CCCCCCCC=C AM84562 [0,0,0,0,0,0|1,0,2]=3 2 B9R0.45 CCCCCCCCC=O AMY15728 [0,0,0,0,0,0|0,0,0]=0 3 B9R0.45 NCCCOCCCCO AMY21928 [0,0,0,0,0,0|2,0,2]=4 4 B9R0.45 OCCCCCCCCCl AM62618 [0,0,0,0,0,0|1,0,2]=3 5 B8R0.4 BrCCCCCCCBr AMY11216 [1,0,0,0,0,0|2,0,0]=3 6 B8R0.4 CCCCCCCCBr AMY9377 [1,0,0,0,0,0|1,0,0]=2 7 B8R0.4 CCCCCCCCN AMY21876 [1,0,0,0,0,0|1,0,0]=2 8 B8R0.4 CCCCNCCCC AM20100543 [1,0,0,0,0,0|1,0,1]=3 9 B8R0.4 CCCCNCCCC AMY21922 [1,0,0,0,0,0|1,0,1]=3 10 B8R0.4 CCCCOCCCC AMY14888 [1,0,0,0,0,0|1,0,1]=3 11 B8R0.4 CCCCOCCCC AMY30969 [1,0,0,0,0,0|1,0,1]=3 12 B8R0.4 CCCCOCCCN AMY21912 [1,0,0,0,0,0|2,0,0]=3 13 B8R0.4 CCNCCCNCC AM20070653 [1,0,0,0,0,0|2,0,1]=4 14 B8R0.4 CC\C=C/CCOC=O AM806738 [1,0,0,0,0,0|1,0,2]=4 15 B8R0.4 COCCNCCCO AMY15137 [1,0,0,0,0,0|2,0,1]=4 16 B8R0.4 NCCCCCCCO AMY18876 [1,0,0,0,0,0|1,0,1]=3 17 B8R0.4 NCCCCNCCO AMY30916 [1,0,0,0,0,0|2,0,1]=4 18 B8R0.4 NCCCNCCCN AMY14287 [1,0,0,0,0,0|3,0,0]=4 19 B8R0.4 OCCCCCCCBr AM20070667 [1,0,0,0,0,0|1,0,1]=3 20 B8R0.4 OCCCCCCCO AMY22642 [1,0,0,0,0,0|1,0,1]=3 21 B8R0.4 OCCCNCCCO AMY202100020 [1,0,0,0,0,0|2,0,1]=4 22 B10R0.1 CCOC(=O)CCCCC=O AM85368 [0,1,0,0,0,0|1,0,1]=3 23 B10R0.4 CC(C)CCCCCCC=O AM20120586 [0,1,0,0,0,0|0,0,0]=1 24 B10R0.4 CC(C)CCCCCCCO AM20120580 [0,1,0,0,0,0|0,0,2]=3 25 B10R0.4 CCCCCCCCB(O)O AMY30008 [0,1,0,0,0,0|1,0,1]=3 26 B10R0.4 CCCCCCCOC(=O)Cl AMY3945 [0,1,0,0,0,0|1,0,0]=2 27 B10R0.4 CCCCCCOCC(=O)O AMY3242 [0,1,0,0,0,0|1,0,0]=2 28 B10R0.4 NCCOCCOCC(=O)O AMY3343 [0,1,0,0,0,0|3,0,0]=4 29 B10R0.4 NCCOCCOCC(=O)O AMY3347 [0,1,0,0,0,0|3,0,0]=4 30 B10R0.4 O=C(O)CCCCCCCBr AMY31536 [0,1,0,0,0,0|1,0,0]=2 31 B10R0.4 O=C(O)CCCCCCCO AMY5109 [0,1,0,0,0,0|1,0,0]=2 32 B10R0.4 [N-]=[N+]=NCCCCCC(=O)O AMY21582 [0,1,0,0,0,0|3,0,0]=4 33 B10R0.71 BrCCCCCCCCCBr AM20100162 [0,1,0,0,0,0|1,0,1]=3 34 B10R0.71 C=C\C=C\CCCCCCO AMY32027 [0,1,0,0,0,0|1,0,2]=4 35 B10R0.71 CCCCCCCCCCN AMY21843 [0,1,0,0,0,0|1,0,1]=3 36 B10R0.71 ClCCCCCCCCCCl AM20100798 [0,1,0,0,0,0|1,0,1]=3 37 B10R0.71 OCCCCCCCCCBr AMY4021 [0,1,0,0,0,0|0,0,2]=3 38 B10R0.71 OCCCCCCCCCO AMY22342 [0,1,0,0,0,0|0,0,2]=3 39 B10R0.74 COC(=O)CCCCCC=O AM85741 [0,1,0,0,0,0|1,0,1]=3 40 B10R0.91 C#CCC[C@@H](O)CCCCC AMY22019 [0,1,0,0,0,0|1,0,1]=3 41 B10R0.91 CCCC[C@H](O)COCCO AMY33452 [0,1,0,0,0,0|1,0,2]=4 42 B10R1.4 NCCN1CCCCC1=O AM806192 [0,0,0,1,0,0|2,0,0]=3 43 B10R1.4 NCCN1CCCOC1=O AMY36543 [0,0,0,1,0,0|3,0,0]=4 44 B10R1.4 O=C1CNCCN1CCO AMY36343 [0,0,0,1,0,0|3,0,0]=4 45 B10R1.7 O=C1NCCCCC[C@@H]1Cl AMY2428 [0,0,0,1,0,0|2,0,0]=3 46 B10R1.17 BrCCCC1CCNCC1 AM100582 [0,0,0,1,0,0|2,0,1]=4 47 B10R1.17 BrCCC[C@H]1CCCCN1 AM90469 [0,0,0,1,0,0|2,0,1]=4 48 B10R1.17 BrCCC[C@H]1CCCNC1 AM100963 [0,0,0,1,0,0|2,0,1]=4 49 B10R1.17 CCCCC1CCNCC1 AM20090599 [0,0,0,1,0,0|2,0,1]=4 50 B10R1.17 CCCCC1CCNCC1 AM807077 [0,0,0,1,0,0|2,0,1]=4 51 B10R1.17 CCNC[C@H]1CCCCN1 AM91126 [0,0,0,1,0,0|2,0,1]=4 52 B10R1.17 CCNC[C@H]1CCCNC1 AM91187 [0,0,0,1,0,0|3,0,0]=4 53 B10R1.17 CNCCC1CCNCC1 AM101304 [0,0,0,1,0,0|3,0,0]=4 54 B10R1.17 CNCCC1CCOCC1 AM90590 [0,0,0,1,0,0|3,0,0]=4 55 B10R1.17 CNCC[C@H]1CCCNC1 AM91410 [0,0,0,1,0,0|3,0,0]=4 56 B10R1.17 COCCC1CCNCC1 AMY15796 [0,0,0,1,0,0|3,0,0]=4 57 B10R1.17 COCC[C@H]1CCCCN1 AMY21766 [0,0,0,1,0,0|2,0,1]=4 58 B10R1.17 COCC[C@H]1CCCCN1 AMY37440 [0,0,0,1,0,0|2,0,1]=4 59 B10R1.17 ClCCCC1CCNCC1 AM101279 [0,0,0,1,0,0|2,0,1]=4 60 B10R1.17 ClCCC[C@H]1CCCCN1 AM101200 [0,0,0,1,0,0|2,0,1]=4 61 B10R1.17 ClCCC[C@H]1CCCNC1 AM100437 [0,0,0,1,0,0|2,0,1]=4 62 B10R1.17 ICCCC1CCNCC1 AM100498 [0,0,0,1,0,0|2,0,1]=4 63 B10R1.17 ICCC[C@H]1CCCCN1 AM99908 [0,0,0,1,0,0|2,0,1]=4 64 B10R1.17 ICCC[C@H]1CCCNC1 AM99360 [0,0,0,1,0,0|2,0,1]=4 65 B10R1.17 NCCCC1CCCCC1 AMY23927 [0,0,0,1,0,0|1,0,1]=3 66 B10R1.17 NCCCC1CCNCC1 AM101377 [0,0,0,1,0,0|2,0,1]=4 67 B10R1.17 NCCCN1CCCCC1 AM9934 [0,0,0,1,0,0|2,0,1]=4 68 B10R1.17 NCCC[C@H]1CCCCN1 AM101040 [0,0,0,1,0,0|2,0,1]=4 69 B10R1.17 NCCC[C@H]1CCCNC1 AM100709 [0,0,0,1,0,0|2,0,1]=4 70 B10R1.17 NCCOC1CCCCC1 AMY20121 [0,0,0,1,0,0|2,0,1]=4 71 B10R1.17 O=CCO[C@@H]1CCCCO1 AMY2069 [0,0,0,1,0,0|2,0,0]=3 72 B10R1.17 OCCCC1CCNCC1 AM100294 [0,0,0,1,0,0|1,0,2]=4 73 B10R1.17 OCCCC1CCNCC1 AMY34788 [0,0,0,1,0,0|1,0,2]=4 74 B10R1.17 OCCC[C@H]1CCCCN1 AM101541 [0,0,0,1,0,0|1,0,2]=4 75 B10R1.17 OCCC[C@H]1CCCNC1 AM100426 [0,0,0,1,0,0|1,0,2]=4 76 B10R1.17 SCCCC1CCNCC1 AM99780 [0,0,0,1,0,0|1,1,1]=4 77 B10R1.17 SCCC[C@H]1CCCCN1 AM97529 [0,0,0,1,0,0|1,1,1]=4 78 B10R1.17 SCCC[C@H]1CCCNC1 AM99471 [0,0,0,1,0,0|1,1,1]=4 79 B10R1.20 CNC1CCCCC1NC AM20070549 [0,0,0,1,0,0|3,0,0]=4 80 B10R1.20 CN[C@H]1CCCC[C@@H]1NC AM20070508 [0,0,0,1,0,0|3,0,0]=4 81 B10R1.20 CN[C@H]1CCCC[C@@H]1NC AM20070518 [0,0,0,1,0,0|3,0,0]=4 82 B10R1.20 OC[C@@H]1CCCC[C@H]1CO AMY5218 [0,0,0,1,0,0|1,0,2]=4 83 B10R1.21 CCCCCN1CCCC1 AMY25657 [0,0,0,1,0,0|2,0,1]=4 84 B10R1.21 CCNCC[C@H]1CCNC1 AM100167 [0,0,0,1,0,0|3,0,0]=4 85 B10R1.21 CCNCC[C@H]1CCNC1 AM100192 [0,0,0,1,0,0|3,0,0]=4 86 B10R1.21 CCNCC[C@H]1CCNC1 AM99776 [0,0,0,1,0,0|3,0,0]=4 87 B10R1.21 N#CCCNC1CCCC1 AMY5553 [0,0,0,1,0,0|2,0,1]=4 88 B10R1.21 NCCCCN1CCCC1 AMY10948 [0,0,0,1,0,0|2,0,1]=4 89 B10R1.29 CCNC[C@H]1CCCN1C AM101140 [0,0,0,1,0,0|3,0,0]=4 90 B10R1.29 CCNC[C@H]1CCCN1C AM96804 [0,0,0,1,0,0|3,0,0]=4 91 B10R1.29 O=C1CCCN1CCCBr AM85059 [0,0,0,1,0,0|2,0,0]=3 92 B10R1.78 Cl[C@H]1CCCCCCCN1 AMY32707 [0,0,0,1,0,0|2,0,1]=4 93 B10R1.78 O=C1CCCCCCCC1 AM20090511 [0,0,0,1,0,0|0,0,0]=1 94 B10R1.161 CNC1CCCCCCC1 AMY10583 [0,0,0,1,0,0|2,0,0]=3 95 B7R0.1 BrCCCCCCBr AMY11215 [2,0,0,0,0,0|2,0,0]=4 96 B7R0.1 C#CCCCCCC AMY25742 [2,0,0,0,0,0|0,0,2]=4 97 B7R0.1 C=CCCCCC=O AMY2455 [2,0,0,0,0,0|0,0,2]=4 98 B7R0.1 C=CCCCCCCl AM85971 [2,0,0,0,0,0|1,0,1]=4 99 B7R0.1 C=CCCCCCO AMY7500 [2,0,0,0,0,0|1,0,1]=4 100 B7R0.1 C=CCCCCNC AMY41147 [2,0,0,0,0,0|1,0,1]=4 101 B7R0.1 CCCCCON=O AMY3989 [2,0,0,0,0,0|2,0,0]=4 102 B7R0.1 CNCCCCNC AMY13612 [2,0,0,0,0,0|2,0,0]=4 103 B7R0.1 ClCCCCCCCl AM84762 [2,0,0,0,0,0|2,0,0]=4 104 B7R0.1 NCCCCCCO AMY18359 [2,0,0,0,0,0|1,0,1]=4 105 B7R0.1 NCCCCCCS AMY32225 [2,0,0,0,0,0|1,1,0]=4 106 B7R0.1 OCCCCCCBr AMY2822 [2,0,0,0,0,0|1,0,1]=4 107 B7R0.1 OCCCCCCCl AMY25606 [2,0,0,0,0,0|1,0,1]=4 108 B9R0.2 CC(C)CCCCCC=O AM20120578 [1,1,0,0,0,0|0,0,0]=2 109 B9R0.2 CCCCCCCC(=O)[O-] AMY19799 [1,1,0,0,0,0|0,0,0]=2 110 B9R0.2 CCCCCCOC(=O)Cl AMY4168 [1,1,0,0,0,0|1,0,0]=3 111 B9R0.2 NCCCCCCC(=O)O AM20120334 [1,1,0,0,0,0|1,0,0]=3 112 B9R0.2 O=C(O)CCCCCCBr AMY10966 [1,1,0,0,0,0|1,0,0]=3 113 B9R0.2 O=C(O)CCCCCCO AM20090595 [1,1,0,0,0,0|1,0,0]=3 114 B9R0.2 O=C(O)CNCCCCO AM806410 [1,1,0,0,0,0|2,0,0]=4 115 B9R0.5 CCOC(=O)CCCC=O AM85359 [1,1,0,0,0,0|1,0,1]=4 116 B9R0.18 CCCCC(O)CCCC AMY19319 [1,1,0,0,0,0|0,0,1]=3 117 B9R0.46 COC(=O)CCCCC=O AM85868 [1,1,0,0,0,0|1,0,1]=4 118 B11R0.4 C=CCCCCCC(=O)OCC AM20210001 [0,2,0,0,0,0|1,0,1]=4 119 B11R0.4 CCOC(=O)CCCCCC=O AM20112003 [0,2,0,0,0,0|0,0,1]=3 120 B11R0.176 CCOC(=O)CCCCC(=O)O AMY4061 [0,2,0,0,0,0|1,0,1]=4 121 B11R0.30 CC(C)CCCCCCC(=O)O AMY41999 [0,2,0,0,0,0|0,0,0]=2 122 B11R0.30 O=C(O)CCCCCCC(=O)O AM20100233 [0,2,0,0,0,0|1,0,1]=4 123 B11R0.40 CCCCCCCCC(=O)NO AM806756 [0,2,0,0,0,0|0,0,0]=2 124 B11R0.42 C=CCCCCC[C@@H](N)C(=O)O AMY7198 [0,2,0,0,0,0|0,0,2]=4 125 B11R0.42 C=CCCCCC[C@H](N)C(=O)O AMY6921 [0,2,0,0,0,0|0,0,2]=4 126 B11R0.42 CCCCCCC[C@H](N)C(=O)O AMY7202 [0,2,0,0,0,0|0,0,0]=2 127 B11R0.111 CC[C@H](C)CCCCCC(=O)O AM20120579 [0,2,0,0,0,0|0,0,0]=2 128 B11R0.148 CC(C)CCCCCCCC=O AM20120576 [0,2,0,0,0,0|0,0,0]=2 129 B11R0.148 CC(C)CCCCCCCCO AM20120577 [0,2,0,0,0,0|0,0,2]=4 130 B11R0.148 CCCCCCCCOC(=O)Cl AMY4096 [0,2,0,0,0,0|0,0,0]=2 131 B11R0.148 CCC\C=C\CCCCC(=O)O AMY22527 [0,2,0,0,0,0|0,0,1]=3 132 B11R0.148 O=C(O)CCCCCCCCBr AM803870 [0,2,0,0,0,0|0,0,0]=2 133 B11R0.148 O=C(O)CCCCCCCCO AM20100011 [0,2,0,0,0,0|0,0,0]=2 134 B11R0.3 BrCCCCCCCCCCBr AMY11211 [0,2,0,0,0,0|1,0,1]=4 135 B11R0.3 C#CCCCCCCCCCO AMY25626 [0,2,0,0,0,0|0,0,2]=4 136 B11R0.3 C=CCCCCCCCCC=O AMY6063 [0,2,0,0,0,0|0,0,0]=2 137 B11R0.3 C=CCCCCCCCCCBr AMY6138 [0,2,0,0,0,0|1,0,0]=3 138 B11R0.3 C=CCCCCCCCCCCl AMY6064 [0,2,0,0,0,0|1,0,0]=3 139 B11R0.3 C=CCCCCCCCCCN AMY6111 [0,2,0,0,0,0|1,0,0]=3 140 B11R0.3 C=CCCCCCCCCCO AMY5942 [0,2,0,0,0,0|1,0,0]=3 141 B11R0.3 CCCCCCCCCCCO AMY5947 [0,2,0,0,0,0|0,0,2]=4 142 B11R0.3 CCCCCCCCNCCN AM20130031 [0,2,0,0,0,0|1,0,1]=4 143 B11R0.3 ClCCCCCCCCCCCl AMY9370 [0,2,0,0,0,0|1,0,1]=4 144 B11R0.3 NCCCCCCCCCCN AMY25748 [0,2,0,0,0,0|1,0,1]=4 145 B9R1.5 CN1CCCNCC1=O AM20100475 [1,0,0,1,0,0|2,0,0]=4 146 B9R1.5 CN1CCCNCC1=O AMY15722 [1,0,0,1,0,0|2,0,0]=4 147 B9R1.5 N[C@@H]1CCCCNC1=O AMY3925 [1,0,0,1,0,0|2,0,0]=4 148 B9R1.5 N[C@H]1CCCCNC1=O AM20090060 [1,0,0,1,0,0|2,0,0]=4 149 B9R1.5 N[C@H]1CCCCNC1=O AM803517 [1,0,0,1,0,0|2,0,0]=4 150 B9R1.8 BrCCC1CCNCC1 AM90686 [1,0,0,1,0,0|2,0,0]=4 151 B9R1.8 BrCCC1CCOCC1 AM100848 [1,0,0,1,0,0|2,0,0]=4 152 B9R1.8 BrCC[C@H]1CCCNC1 AM100581 [1,0,0,1,0,0|2,0,0]=4 153 B9R1.8 CCNC1CCCCC1 AM20070548 [1,0,0,1,0,0|1,0,1]=4 154 B9R1.8 CNCC1CCCCC1 AM803595 [1,0,0,1,0,0|1,0,1]=4 155 B9R1.8 CNC[C@H]1CCCCN1 AM100614 [1,0,0,1,0,0|2,0,0]=4 156 B9R1.8 COC[C@@H]1CCCCN1 AM807049 [1,0,0,1,0,0|2,0,0]=4 157 B9R1.8 COC[C@H]1CCCCN1 AM806273 [1,0,0,1,0,0|2,0,0]=4 158 B9R1.8 COC[C@H]1CCCCN1 AM90528 [1,0,0,1,0,0|2,0,0]=4 159 B9R1.8 ClCCC1CCNCC1 AM90696 [1,0,0,1,0,0|2,0,0]=4 160 B9R1.8 ClCCC1CCOCC1 AM100847 [1,0,0,1,0,0|2,0,0]=4 161 B9R1.8 ClCCN1CCCCC1 AM20090146 [1,0,0,1,0,0|2,0,0]=4 162 B9R1.8 ClCC[C@H]1CCCNC1 AM99496 [1,0,0,1,0,0|2,0,0]=4 163 B9R1.8 ICCC1CCNCC1 AM100793 [1,0,0,1,0,0|2,0,0]=4 164 B9R1.8 ICCC1CCOCC1 AM100845 [1,0,0,1,0,0|2,0,0]=4 165 B9R1.8 ICC[C@H]1CCCNC1 AM97540 [1,0,0,1,0,0|2,0,0]=4 166 B9R1.8 NCCC1=CCCCC1 AMY14247 [1,0,0,1,0,0|1,0,1]=4 167 B9R1.8 NCCC1CCCCC1 AMY38665 [1,0,0,1,0,0|1,0,0]=3 168 B9R1.8 NCCC1CCNCC1 AM101244 [1,0,0,1,0,0|2,0,0]=4 169 B9R1.8 NCCC1CCNCC1 AMY15188 [1,0,0,1,0,0|2,0,0]=4 170 B9R1.8 NCCC1CCOCC1 AM20100593 [1,0,0,1,0,0|2,0,0]=4 171 B9R1.8 NCCC1CCOCC1 AM803825 [1,0,0,1,0,0|2,0,0]=4 172 B9R1.8 NCCN1CCCCC1 AMY5277 [1,0,0,1,0,0|2,0,0]=4 173 B9R1.8 NCC[C@H]1CCCCN1 AMY21355 [1,0,0,1,0,0|2,0,0]=4 174 B9R1.8 NCC[C@H]1CCCNC1 AM101532 [1,0,0,1,0,0|2,0,0]=4 175 B9R1.8 NNCC1CCCCC1 AMY202003293 [1,0,0,1,0,0|2,0,0]=4 176 B9R1.8 O=C=NC1CCCCC1 AMY37189 [1,0,0,1,0,0|1,0,1]=4 177 B9R1.8 O=CCC1CCCCC1 AMY24044 [1,0,0,1,0,0|0,0,0]=2 178 B9R1.8 O=CCC1CCOCC1 AM101094 [1,0,0,1,0,0|1,0,0]=3 179 B9R1.8 O=CCN1CCOCC1 AMY38330 [1,0,0,1,0,0|2,0,0]=4 180 B9R1.8 OCCC1CCOCC1 AM100846 [1,0,0,1,0,0|1,0,1]=4 181 B9R1.8 OCCN1CCCCC1 AMY9422 [1,0,0,1,0,0|1,0,1]=4 182 B9R1.8 OCC[C@@H]1C=CCCC1 AM86042 [1,0,0,1,0,0|1,0,1]=4 183 B9R1.8 OCC[C@@H]1CCCCN1 AMY21751 [1,0,0,1,0,0|1,0,1]=4 184 B9R1.8 OCC[C@H]1CCCCN1 AM20080368 [1,0,0,1,0,0|1,0,1]=4 185 B9R1.8 OCC[C@H]1CCCCN1 AM20100783 [1,0,0,1,0,0|1,0,1]=4 186 B9R1.8 OCC[C@H]1CCCCN1 AMY21750 [1,0,0,1,0,0|1,0,1]=4 187 B9R1.8 OCC[C@H]1CCCNC1 AM101208 [1,0,0,1,0,0|1,0,1]=4 188 B9R1.8 OCC[C@H]1CCCNC1 AM81154 [1,0,0,1,0,0|1,0,1]=4 189 B9R1.8 OCC[C@H]1CCCOC1 AMY38303 [1,0,0,1,0,0|1,0,1]=4 190 B9R1.8 SCCC1CCNCC1 AM101536 [1,0,0,1,0,0|1,1,0]=4 191 B9R1.8 SCCC1CCOCC1 AM98456 [1,0,0,1,0,0|1,1,0]=4 192 B9R1.8 SCC[C@H]1CCCNC1 AM98083 [1,0,0,1,0,0|1,1,0]=4 193 B9R1.12 CCNC[C@H]1CCCN1 AM91659 [1,0,0,1,0,0|2,0,0]=4 194 B9R1.12 ClCCCN1CCCC1 AM804073 [1,0,0,1,0,0|2,0,0]=4 195 B9R1.12 NCCCN1CCCC1 AM20090247 [1,0,0,1,0,0|2,0,0]=4 196 B9R1.12 NCCOC1CCCC1 AMY20123 [1,0,0,1,0,0|2,0,0]=4 197 B9R1.12 NCCOC1CCCC1 AMY20124 [1,0,0,1,0,0|2,0,0]=4 198 B9R1.12 OCCCN1CCCC1 AMY38662 [1,0,0,1,0,0|1,0,1]=4 199 B9R1.15 CCC1CCCCC1O AM20070485 [1,0,0,1,0,0|0,0,1]=3 200 B9R1.15 CN1CCCC[C@@H]1CN AMY21400 [1,0,0,1,0,0|2,0,0]=4 201 B9R1.15 CN1CCCC[C@@H]1CO AM20090174 [1,0,0,1,0,0|1,0,1]=4 202 B9R1.15 CN1CCCC[C@H]1C=O AM100803 [1,0,0,1,0,0|1,0,0]=3 203 B9R1.15 CN[C@H]1CCCC[C@@H]1O AMY928 [1,0,0,1,0,0|1,0,1]=4 204 B9R1.15 CN[C@H]1CCCC[C@@H]1O AMY929 [1,0,0,1,0,0|1,0,1]=4 205 B9R1.15 CO[C@H]1CCCNC1=O AM20090301 [1,0,0,1,0,0|2,0,0]=4 206 B9R1.15 CO[C@H]1COCCC1=O AMY33743 [1,0,0,1,0,0|2,0,0]=4 207 B9R1.15 O=C[C@@H]1CCCCC1=O AM9963 [1,0,0,1,0,0|1,0,1]=4 208 B9R1.17 OCCCCC1COC1 AMY32111 [1,0,0,1,0,0|1,0,1]=4 209 B9R1.33 CN1CCC[C@@H]1CCN AMY822 [1,0,0,1,0,0|2,0,0]=4 210 B9R1.33 CN1CCC[C@H]1CCN AMY19244 [1,0,0,1,0,0|2,0,0]=4 211 B9R1.33 NCCN1CCCC1=O AMY19233 [1,0,0,1,0,0|2,0,0]=4 212 B9R1.33 O=C1CCCN1CCBr AM20210013 [1,0,0,1,0,0|2,0,0]=4 213 B9R1.50 NC1CCCCCCC1 AMY14314 [1,0,0,1,0,0|1,0,0]=3 214 B9R1.50 O=C1CCCCCCC1 AMY3996 [1,0,0,1,0,0|0,0,0]=2 215 B9R1.50 O=C1CCCCCCN1 AM20100621 [1,0,0,1,0,0|1,0,0]=3 216 B9R1.50 OC1CCCCCCC1 AMY39481 [1,0,0,1,0,0|0,0,1]=3 217 B9R1.89 NNC1CCCCCC1 AM9802 [1,0,0,1,0,0|2,0,0]=4 218 B9R1.89 O=CC1CCCCCC1 AMY21681 [1,0,0,1,0,0|0,0,0]=2 219 B9R1.89 OC[C@H]1CCCCNC1 AMY11832 [1,0,0,1,0,0|1,0,1]=4 220 B11R1.199 CCOC(=O)[C@@H]1CCCC1=O AM20100487 [0,1,0,1,0,0|1,0,1]=4 221 B11R1.53 CC(=O)N1CCCC[C@@H]1CN AM91396 [0,1,0,1,0,0|2,0,0]=4 222 B11R1.53 CC(=O)N1CCCC[C@@H]1CO AM100444 [0,1,0,1,0,0|2,0,0]=4 223 B11R1.53 CC(=O)N1CCCC[C@H]1C=O AM90652 [0,1,0,1,0,0|1,0,1]=4 224 B11R1.53 CCN1CCNC[C@H]1C(=O)[O-] AMY33380 [0,1,0,1,0,0|2,0,0]=4 225 B11R1.57 O=C(O)CN1CCC[C@@H]1CBr AM92240 [0,1,0,1,0,0|2,0,0]=4 226 B11R1.57 O=C(O)CN1CCC[C@@H]1CCl AM92314 [0,1,0,1,0,0|2,0,0]=4 227 B11R1.57 O=C(O)CN1CCC[C@@H]1CI AM94367 [0,1,0,1,0,0|2,0,0]=4 228 B11R1.57 O=C(O)CN1CCC[C@@H]1CO AM100296 [0,1,0,1,0,0|2,0,0]=4 229 B11R1.57 O=C(O)CN1CCC[C@@H]1CO AM100586 [0,1,0,1,0,0|2,0,0]=4 230 B11R1.86 CC(=O)NC1CCCCC1N AM91541 [0,1,0,1,0,0|2,0,0]=4 231 B11R1.86 CC(=O)OC1CCCCC1C AMY307 [0,1,0,1,0,0|1,0,0]=3 232 B11R1.86 CN(C)C[C@H]1CCCCC1=O AMY23638 [0,1,0,1,0,0|1,0,0]=3 233 B11R1.86 CN(C)C[C@H]1CCCCC1=O AMY38302 [0,1,0,1,0,0|1,0,0]=3 234 B11R1.91 CC(=O)NC[C@H]1CCCCN1 AM101776 [0,1,0,1,0,0|2,0,0]=4 235 B11R1.91 CC(=O)NC[C@H]1CCCNC1 AM101543 [0,1,0,1,0,0|2,0,0]=4 236 B11R1.91 O=C(O)CCC1CCCCC1 AMY3571 [0,1,0,1,0,0|0,0,0]=2 237 B11R1.91 O=C(O)CCC1CCNCC1 AM100415 [0,1,0,1,0,0|1,0,0]=3 238 B11R1.91 O=C(O)CCN1CCCCC1 AMY21698 [0,1,0,1,0,0|1,0,0]=3 239 B11R1.91 O=C(O)CCN1CCOCC1 AMY21696 [0,1,0,1,0,0|2,0,0]=4 240 B11R1.91 O=C(O)CC[C@H]1CCCCN1 AM100796 [0,1,0,1,0,0|1,0,0]=3 241 B11R1.91 O=C(O)CC[C@H]1CCCNC1 AM100414 [0,1,0,1,0,0|1,0,0]=3 242 B11R1.91 O=C(O)CNC1CCCCC1 AM83646 [0,1,0,1,0,0|1,0,0]=3 243 B11R1.193 CNC[C@H]1CCCN1C(C)=O AM93722 [0,1,0,1,0,0|2,0,0]=4 244 B11R1.193 CNC[C@H]1CCCN1C(C)=O AM96687 [0,1,0,1,0,0|2,0,0]=4 245 B11R1.568 O=C1NCCCCCC1(Cl)Cl AMY2427 [0,1,0,1,0,0|2,0,0]=4 246 B11R1.742 O=C(O)CN1CCCCCC1 AMY21705 [0,1,0,1,0,0|1,0,0]=3 247 B11R1.17 CCNC[C@H]1CCCCN1C AM101109 [0,1,0,1,0,0|2,0,0]=4 248 B11R1.17 N#CCC[C@H]1CCCCC1=O AMY24688 [0,1,0,1,0,0|0,0,1]=3 249 B11R1.28 CCNCC[C@H]1CCCNC1 AM101301 [0,1,0,1,0,0|2,0,0]=4 250 B11R1.28 CNCCCC1CCNCC1 AM91270 [0,1,0,1,0,0|2,0,0]=4 251 B11R1.28 CNCCCN1CCCCC1 AMY15392 [0,1,0,1,0,0|2,0,0]=4 252 B11R1.28 CNCCC[C@H]1CCCCN1 AM91314 [0,1,0,1,0,0|1,0,1]=4 253 B11R1.28 CNCCC[C@H]1CCCNC1 AM91374 [0,1,0,1,0,0|2,0,0]=4 254 B11R2.20 C1CCC2CNCCC2C1 AM20070504 [0,0,0,2,0,0|1,0,1]=4 255 B11R2.565 BrB1C2CCCC1CCC2 AMY14846 [0,0,0,2,0,0|2,0,0]=4 256 B11R2.565 [Li]B1C2CCCC1CCC2 AMY14904 [0,0,0,2,0,0|2,0,0]=4 257 B11R2.1 O=C1CC[C@@H]2CNCCN12 AMY34456 [0,0,0,2,0,0|2,0,0]=4 258 B11R2.1261 C1CCC2(C1)CCCNC2 AM806443 [0,0,0,2,0,0|2,0,0]=4 259 B11R2.1261 C1CCC2(CCCC2)NC1 AMY18748 [0,0,0,2,0,0|1,0,1]=4 260 B11R2.63 CN1C2CCC(=O)C1CC2 AMY35144 [0,0,0,2,0,0|1,0,0]=3 261 B11R2.3 O=C1NCC[C@]12CCNC2 AM20080148 [0,0,0,2,0,0|2,0,0]=4 262 B11R2.60 O=C1CCC2C(=O)CCC12 AMY205 [0,0,0,2,0,0|1,0,1]=4