0 B7R0.4 C#CCCCC(=O)O AM81010 [0,0,0,0,0,0|2,0,2]=4 1 B7R0.4 C=CCCCC(=O)O AMY759 [0,0,0,0,0,0|2,0,2]=4 2 B7R0.4 CC(=O)CCCCCl AM90172 [0,0,0,0,0,0|2,0,0]=2 3 B7R0.4 CC(=O)NCCCN AMY36360 [0,0,0,0,0,0|2,0,0]=2 4 B7R0.4 CC(C)NCCCO AMY41464 [0,0,0,0,0,0|3,0,1]=4 5 B7R0.4 CCCCC[C@@H](C)O AMY25723 [0,0,0,0,0,0|1,0,2]=3 6 B7R0.4 CCCCC[C@H](C)N AMY3809 [0,0,0,0,0,0|2,0,1]=3 7 B7R0.4 CCCCOC(C)=O AMY11075 [0,0,0,0,0,0|0,0,0]=0 8 B7R0.4 CCCOCC(=O)O AMY4018 [0,0,0,0,0,0|3,0,0]=3 9 B7R0.4 CCC\C=C\[N+](=O)[O-] AMY23948 [0,0,0,0,0,0|3,0,1]=4 10 B7R0.4 CCO\C=C\C(=O)Cl AMY22514 [0,0,0,0,0,0|3,0,1]=4 11 B7R0.4 CCO\C=C\C(=O)O AMY9262 [0,0,0,0,0,0|3,0,1]=4 12 B7R0.4 CN(C)CCCCN AMY31964 [0,0,0,0,0,0|4,0,0]=4 13 B7R0.4 CN(C)CCCCO AMY9644 [0,0,0,0,0,0|4,0,0]=4 14 B7R0.4 CNCCCC(=O)O AMY5046 [0,0,0,0,0,0|3,0,0]=3 15 B7R0.4 CNCCCN(C)C AMY28735 [0,0,0,0,0,0|4,0,0]=4 16 B7R0.4 CNCCOC(C)=O AMY15057 [0,0,0,0,0,0|1,0,0]=1 17 B7R0.4 COCCCN(C)C AMY1821 [0,0,0,0,0,0|4,0,0]=4 18 B7R0.4 N#CCCCC(=O)O AMY16028 [0,0,0,0,0,0|3,0,1]=4 19 B7R0.4 NC(=O)COCCCl AMY17904 [0,0,0,0,0,0|4,0,0]=4 20 B7R0.4 NCCCCC(=O)O AM82459 [0,0,0,0,0,0|3,0,0]=3 21 B7R0.4 NCCCCC(=O)O AMY39227 [0,0,0,0,0,0|3,0,0]=3 22 B7R0.4 O=C(Cl)CCCCBr AM85775 [0,0,0,0,0,0|3,0,0]=3 23 B7R0.4 O=C(Cl)CCCCCl AMY12305 [0,0,0,0,0,0|3,0,0]=3 24 B7R0.4 O=C(O)CCCCBr AM85660 [0,0,0,0,0,0|3,0,0]=3 25 B7R0.4 O=C(O)CCCCCl AMY40897 [0,0,0,0,0,0|3,0,0]=3 26 B7R0.4 O=C(O)COCCCl AMY28725 [0,0,0,0,0,0|4,0,0]=4 27 B6R0.4 C#CCOC(=O)Cl AMY3955 [1,0,0,0,0,0|1,0,2]=4 28 B6R0.4 C#CCOC(C)=O AM90264 [1,0,0,0,0,0|0,0,2]=3 29 B6R0.4 C=CCCC(=O)Cl AMY808 [1,0,0,0,0,0|1,0,2]=4 30 B6R0.4 C=CCCC(=O)O AMY12553 [1,0,0,0,0,0|1,0,2]=4 31 B6R0.4 C=CCCC(C)=O AM84335 [1,0,0,0,0,0|0,0,2]=3 32 B6R0.4 C=CCOC(=O)Cl AMY3928 [1,0,0,0,0,0|1,0,2]=4 33 B6R0.4 C=CCOC(C)=O AMY22115 [1,0,0,0,0,0|0,0,2]=3 34 B6R0.4 CC(=O)NCCN AMY40665 [1,0,0,0,0,0|2,0,0]=3 35 B6R0.4 CC(C)CCCO AMY39142 [1,0,0,0,0,0|2,0,1]=4 36 B6R0.4 CC(C)OCCBr AM80879 [1,0,0,0,0,0|2,0,1]=4 37 B6R0.4 CCCCC(=O)[O-] AMY026 [1,0,0,0,0,0|1,0,0]=2 38 B6R0.4 CCCCN(C)C AMY25818 [1,0,0,0,0,0|2,0,0]=3 39 B6R0.4 CCCOC(=O)Cl AMY3779 [1,0,0,0,0,0|1,0,0]=2 40 B6R0.4 CCOCC(=O)O AMY4062 [1,0,0,0,0,0|2,0,0]=3 41 B6R0.4 CCSCC(=O)O AM20100532 [1,0,0,0,0,0|2,0,0]=3 42 B6R0.4 CN(C)CCCCl AM84336 [1,0,0,0,0,0|3,0,0]=4 43 B6R0.4 CN(C)CCCCl AM90218 [1,0,0,0,0,0|3,0,0]=4 44 B6R0.4 CNCCC(=O)O AM84855 [1,0,0,0,0,0|2,0,0]=3 45 B6R0.4 CNCCC(C)C AMY37348 [1,0,0,0,0,0|2,0,1]=4 46 B6R0.4 CNCCC(C)C AMY37370 [1,0,0,0,0,0|2,0,1]=4 47 B6R0.4 CNCCN(C)C AMY10373 [1,0,0,0,0,0|3,0,0]=4 48 B6R0.4 COCCC(=O)O AMY2689 [1,0,0,0,0,0|2,0,0]=3 49 B6R0.4 C[C@H](Br)CCCBr AMY2526 [1,0,0,0,0,0|2,0,1]=4 50 B6R0.4 NC(=O)OCCCl AMY19018 [1,0,0,0,0,0|2,0,0]=3 51 B6R0.4 NCCCC(=O)O AM20100372 [1,0,0,0,0,0|2,0,0]=3 52 B6R0.4 NCCCC(N)=O AMY15220 [1,0,0,0,0,0|2,0,0]=3 53 B6R0.4 O=C(Cl)CCCCl AMY25684 [1,0,0,0,0,0|2,0,0]=3 54 B6R0.4 O=C(O)CCCS AM20080221 [1,0,0,0,0,0|2,0,0]=3 55 B6R0.6 C=CCCCCBr AM84859 [1,0,0,0,0,0|2,0,1]=4 56 B6R0.6 C=CCCCCO AM20100796 [1,0,0,0,0,0|2,0,1]=4 57 B6R0.6 C=COCCCN AMY3063 [1,0,0,0,0,0|1,0,1]=3 58 B6R0.6 C=COCCON AMY3312 [1,0,0,0,0,0|2,0,1]=4 59 B6R0.6 CCCCCCC AMY22304 [1,0,0,0,0,0|1,0,1]=3 60 B6R0.6 CCCCCCN AMY21942 [1,0,0,0,0,0|2,0,1]=4 61 B6R0.6 CCCCNCC AMY3985 [1,0,0,0,0,0|1,0,1]=3 62 B6R0.6 CCCCON=O AMY4016 [1,0,0,0,0,0|1,0,0]=2 63 B6R0.6 CCOCCC#N AMY40959 [1,0,0,0,0,0|1,0,2]=4 64 B6R0.6 CCOCCCN AMY21920 [1,0,0,0,0,0|1,0,1]=3 65 B6R0.6 CCOCCCO AM20080058 [1,0,0,0,0,0|1,0,1]=3 66 B6R0.6 CCOCOCC AMY25683 [1,0,0,0,0,0|1,0,1]=3 67 B6R0.6 COCCCCBr AMY9376 [1,0,0,0,0,0|3,0,0]=4 68 B6R0.6 COCCCCO AM20080057 [1,0,0,0,0,0|3,0,0]=4 69 B6R0.6 C\C=C\CCCO AMY2616 [1,0,0,0,0,0|2,0,0]=3 70 B6R0.6 O=CCCCC=O AMY3308 [1,0,0,0,0,0|2,0,1]=4 71 B6R0.6 O=CCCCCCl AMY772 [1,0,0,0,0,0|2,0,0]=3 72 B8R0.5 CCC[C@H](C)CC(C)C AMY6077 [0,1,0,0,0,0|2,0,1]=4 73 B8R0.6 CCCCC[C@@H](Br)CC AMY12158 [0,1,0,0,0,0|2,0,1]=4 74 B8R0.6 CCCCC[C@@H](O)CC AMY12157 [0,1,0,0,0,0|1,0,2]=4 75 B8R0.6 CCCCNC(=O)CCl AM20100314 [0,1,0,0,0,0|1,0,0]=2 76 B8R0.6 CCNCCC(=O)OC AMY20543 [0,1,0,0,0,0|2,0,0]=3 77 B8R0.6 COC(=O)CCCCBr AM20120637 [0,1,0,0,0,0|2,0,0]=3 78 B8R0.7 C=CCCCCC(=O)O AMY7501 [0,1,0,0,0,0|2,0,1]=4 79 B8R0.7 CC(=O)CCCCCBr AMY24068 [0,1,0,0,0,0|1,0,0]=2 80 B8R0.7 CC(=O)OCCCC=O AM10056 [0,1,0,0,0,0|0,0,1]=2 81 B8R0.7 CC(C)CCCCCBr AM806997 [0,1,0,0,0,0|2,0,1]=4 82 B8R0.7 CC(C)NCCCCO AMY10379 [0,1,0,0,0,0|2,0,1]=4 83 B8R0.7 CCCCCCC(=O)O AMY41347 [0,1,0,0,0,0|2,0,0]=3 84 B8R0.7 CCCCCC[C@H](C)N AMY21971 [0,1,0,0,0,0|2,0,1]=4 85 B8R0.7 CN(C)CCCCCN AMY37685 [0,1,0,0,0,0|3,0,0]=4 86 B8R0.7 N=C(N)NCCCCN AMY8986 [0,1,0,0,0,0|3,0,0]=4 87 B8R0.7 NCCCCCC(=O)O AM82438 [0,1,0,0,0,0|2,0,0]=3 88 B8R0.7 NCCCCCC(=O)O AMY977 [0,1,0,0,0,0|2,0,0]=3 89 B8R0.7 NCCOCCC(=O)O AMY4548 [0,1,0,0,0,0|3,0,0]=4 90 B8R0.7 O=C(Cl)CCCCCBr AMY14557 [0,1,0,0,0,0|2,0,0]=3 91 B8R0.7 O=C(O)CCCCCBr AM20100119 [0,1,0,0,0,0|2,0,0]=3 92 B8R0.7 O=C(O)CCCCCO AM10824 [0,1,0,0,0,0|2,0,0]=3 93 B8R0.7 O=C(O)CCOCCO AMY4563 [0,1,0,0,0,0|3,0,0]=4 94 B8R0.7 O=CCCCCC(=O)O AM84276 [0,1,0,0,0,0|2,0,1]=4 95 B8R0.8 CCCCC(=O)C(=O)O AMY6080 [0,1,0,0,0,0|2,0,0]=3 96 B8R0.8 CCCCC(=O)C(=O)[O-] AMY38328 [0,1,0,0,0,0|2,0,0]=3 97 B8R0.8 CCCCC(=O)[C@H](C)N AM20120673 [0,1,0,0,0,0|2,0,1]=4 98 B8R0.8 CCCC[C@H](N)C(=O)O AM82583 [0,1,0,0,0,0|2,0,0]=3 99 B8R0.8 CCCC[C@H](N)C(=O)O AM82584 [0,1,0,0,0,0|2,0,0]=3 100 B8R0.8 CCCC[C@H](N)C(=O)O AM82585 [0,1,0,0,0,0|2,0,0]=3 101 B8R0.8 CSCC[C@H](N)C(=O)O AM20100433 [0,1,0,0,0,0|3,0,0]=4 102 B8R0.8 CSCC[C@H](N)C(=O)O AM20100552 [0,1,0,0,0,0|3,0,0]=4 103 B8R0.8 CSCC[C@H](N)C(=O)O AM81977 [0,1,0,0,0,0|3,0,0]=4 104 B8R0.8 C[Se]CC[C@H](N)C(=O)O AMY18854 [0,1,0,0,0,0|3,0,0]=4 105 B8R0.8 NCCC[C@H](N)C(=O)O AM20080016 [0,1,0,0,0,0|3,0,0]=4 106 B8R0.8 NCCC[C@H](N)C(=O)O AM20090455 [0,1,0,0,0,0|3,0,0]=4 107 B8R0.8 NCCC[C@H](N)C(=O)O AM82603 [0,1,0,0,0,0|3,0,0]=4 108 B8R0.9 CC(=O)OCC(=O)CCl AMY14363 [0,1,0,0,0,0|1,0,1]=3 109 B8R0.9 CCC(=O)CCC(=O)O AMY30226 [0,1,0,0,0,0|2,0,1]=4 110 B8R0.9 CCC(=O)COC(C)=O AM20080565 [0,1,0,0,0,0|0,0,1]=2 111 B8R0.21 CCCCCS(N)(=O)=O AMY35753 [0,1,0,0,0,0|3,0,0]=4 112 B8R0.21 CCCCOS(C)(=O)=O AMY3886 [0,1,0,0,0,0|1,0,0]=2 113 B8R0.21 COCCOS(C)(=O)=O AM778 [0,1,0,0,0,0|2,0,0]=3 114 B8R0.28 C=C(C)CCCC(C)=O AMY15319 [0,1,0,0,0,0|1,0,1]=3 115 B8R0.28 CC(=O)CCCC(=O)[O-] AMY19481 [0,1,0,0,0,0|2,0,1]=4 116 B8R0.28 CC(=O)NCCC(=O)O AM83102 [0,1,0,0,0,0|2,0,1]=4 117 B8R0.28 CC(C)CCC[C@H](C)N AMY4015 [0,1,0,0,0,0|2,0,1]=4 118 B8R0.28 CC(C)COCC(=O)O AM85004 [0,1,0,0,0,0|3,0,0]=4 119 B8R0.28 CN(C)CCCC(=O)O AMY31363 [0,1,0,0,0,0|3,0,0]=4 120 B8R1.1 CC[C@H]1CNC(=O)O1 AM806527 [0,0,0,1,0,0|2,0,0]=3 121 B8R1.1 NC[C@@H]1CCC(=O)N1 AMY21674 [0,0,0,1,0,0|3,0,0]=4 122 B8R1.1 NC[C@@H]1CNC(=O)C1 AMY34438 [0,0,0,1,0,0|2,0,0]=3 123 B8R1.1 NC[C@@H]1CNC(=O)C1 AMY4351 [0,0,0,1,0,0|2,0,0]=3 124 B8R1.1 NC[C@H]1CCC(=O)N1 AMY21633 [0,0,0,1,0,0|3,0,0]=4 125 B8R1.1 NC[C@H]1CNC(=O)C1 AMY34442 [0,0,0,1,0,0|2,0,0]=3 126 B8R1.1 NC[C@H]1CNC(=O)O1 AMY33861 [0,0,0,1,0,0|3,0,0]=4 127 B8R1.1 O=C1C=C(CBr)CO1 AMY20313 [0,0,0,1,0,0|1,0,2]=4 128 B8R1.1 O=C1CC[C@@H](CBr)N1 AMY25044 [0,0,0,1,0,0|3,0,0]=4 129 B8R1.1 O=C1CC[C@H](CO)N1 AM20090035 [0,0,0,1,0,0|3,0,0]=4 130 B8R1.1 O=C1CC[C@H](CO)N1 AM20100613 [0,0,0,1,0,0|3,0,0]=4 131 B8R1.1 O=C1CC[C@H](CO)O1 AM20090484 [0,0,0,1,0,0|3,0,0]=4 132 B8R1.1 O=C1C[C@H](CO)CO1 AM806516 [0,0,0,1,0,0|1,0,0]=2 133 B8R1.1 O=C1NC[C@H](CO)O1 AMY20364 [0,0,0,1,0,0|3,0,0]=4 134 B8R1.1 O=C1N[C@@H](CI)CO1 AMY21405 [0,0,0,1,0,0|2,0,0]=3 135 B8R1.1 O=C1N[C@@H](CO)CO1 AMY21700 [0,0,0,1,0,0|2,0,0]=3 136 B8R1.1 O=C1N[C@H](CI)CO1 AMY21406 [0,0,0,1,0,0|2,0,0]=3 137 B8R1.1 O=C1N[C@H](CO)CO1 AMY21777 [0,0,0,1,0,0|2,0,0]=3 138 B8R1.4 C=C1CCO[C@@H](C)C1 AMY6013 [0,0,0,1,0,0|3,0,0]=4 139 B8R1.4 CC1=C[C@H](C)OCC1 AMY6011 [0,0,0,1,0,0|1,0,2]=4 140 B8R1.4 CC1CC(Br)CCO1 AMY6009 [0,0,0,1,0,0|2,0,1]=4 141 B8R1.4 CC1CC(Cl)CCO1 AMY6010 [0,0,0,1,0,0|2,0,1]=4 142 B8R1.4 CC1CC(N)CCO1 AMY5951 [0,0,0,1,0,0|2,0,1]=4 143 B8R1.4 CC1CC(N)CCO1 AMY5952 [0,0,0,1,0,0|2,0,1]=4 144 B8R1.4 CC1CC(O)CCO1 AMY6006 [0,0,0,1,0,0|2,0,1]=4 145 B8R1.4 CC1CCCC(N)C1 AM20070507 [0,0,0,1,0,0|2,0,1]=4 146 B8R1.4 CN1CCCC(=O)C1 AM20100357 [0,0,0,1,0,0|2,0,0]=3 147 B8R1.4 CN1CCNC(=O)C1 AMY22966 [0,0,0,1,0,0|2,0,0]=3 148 B8R1.4 C[C@H]1CC(=O)CCN1 AM20080278 [0,0,0,1,0,0|2,0,0]=3 149 B8R1.4 C[C@H]1CC(=O)CCN1 AMY13581 [0,0,0,1,0,0|2,0,0]=3 150 B8R1.4 C[C@H]1CC(=O)CCO1 AMY5961 [0,0,0,1,0,0|2,0,0]=3 151 B8R1.4 C[C@H]1CCCC(=O)N1 AMY16211 [0,0,0,1,0,0|2,0,0]=3 152 B8R1.4 C[C@H]1CNCC(=O)N1 AM804110 [0,0,0,1,0,0|3,0,0]=4 153 B8R1.4 N[C@H]1CCNC(=O)C1 AM20100356 [0,0,0,1,0,0|2,0,0]=3 154 B8R1.4 N[C@H]1CCNC(=O)C1 AMY34928 [0,0,0,1,0,0|2,0,0]=3 155 B8R1.4 O=C1CCCC(=O)C1 AM20070493 [0,0,0,1,0,0|2,0,1]=4 156 B8R1.4 O=C1CCNC(=O)C1 AM20100242 [0,0,0,1,0,0|2,0,1]=4 157 B8R1.4 O=C1C[C@@H](O)CCN1 AMY14353 [0,0,0,1,0,0|2,0,0]=3 158 B8R1.4 O=C1C[C@@H](O)CCN1 AMY9138 [0,0,0,1,0,0|2,0,0]=3 159 B8R1.4 O=C1C[C@H](O)CCN1 AMY41749 [0,0,0,1,0,0|2,0,0]=3 160 B8R1.7 CC(=O)C1=NCCC1 AMY42086 [0,0,0,1,0,0|2,0,0]=3 161 B8R1.7 CC(=O)C1=NCCS1 AMY14187 [0,0,0,1,0,0|3,0,0]=4 162 B8R1.7 CC(=O)C1CCCC1 AMY7477 [0,0,0,1,0,0|1,0,0]=2 163 B8R1.7 CC(=O)[C@H]1CCOC1 AMY6005 [0,0,0,1,0,0|2,0,0]=3 164 B8R1.7 C[C@H](N)C1CCCC1 AM86034 [0,0,0,1,0,0|2,0,1]=4 165 B8R1.7 N=C(N)C1CCCC1 AM806532 [0,0,0,1,0,0|3,0,0]=4 166 B8R1.7 NC(=O)[C@@H]1CCCN1 AM20080102 [0,0,0,1,0,0|3,0,0]=4 167 B8R1.7 NC(=O)[C@@H]1CCCN1 AM20100548 [0,0,0,1,0,0|3,0,0]=4 168 B8R1.7 NC(=O)[C@@H]1CCCN1 AM20100732 [0,0,0,1,0,0|3,0,0]=4 169 B8R1.7 NC(=O)[C@@H]1CCCN1 AM82205 [0,0,0,1,0,0|3,0,0]=4 170 B8R1.7 NC(=O)[C@@H]1CCCN1 AM82206 [0,0,0,1,0,0|3,0,0]=4 171 B8R1.7 NC(=O)[C@H]1CCNC1 AM20100187 [0,0,0,1,0,0|3,0,0]=4 172 B8R1.7 NC(=O)[C@H]1CCNC1 AM81209 [0,0,0,1,0,0|3,0,0]=4 173 B8R1.7 O=C(Cl)N1CCCC1 AMY737 [0,0,0,1,0,0|2,0,0]=3 174 B8R1.7 O=C(Cl)[C@@H]1CCCO1 AMY8077 [0,0,0,1,0,0|3,0,0]=4 175 B8R1.7 O=C(O)C1=CCCC1 AM20080408 [0,0,0,1,0,0|2,0,1]=4 176 B8R1.7 O=C(O)C1CCCC1 AM83283 [0,0,0,1,0,0|2,0,0]=3 177 B8R1.7 O=C(O)[C@@H]1CCCN1 AM20080359 [0,0,0,1,0,0|3,0,0]=4 178 B8R1.7 O=C(O)[C@@H]1CCCN1 AM20090537 [0,0,0,1,0,0|3,0,0]=4 179 B8R1.7 O=C(O)[C@@H]1CCCN1 AM20100482 [0,0,0,1,0,0|3,0,0]=4 180 B8R1.7 O=C(O)[C@@H]1CCCN1 AMY28657 [0,0,0,1,0,0|3,0,0]=4 181 B8R1.7 O=C(O)[C@@H]1CCCO1 AM20090013 [0,0,0,1,0,0|3,0,0]=4 182 B8R1.7 O=C(O)[C@@H]1CCCO1 AM20110255 [0,0,0,1,0,0|3,0,0]=4 183 B8R1.7 O=C(O)[C@@H]1CCCO1 AM20110256 [0,0,0,1,0,0|3,0,0]=4 184 B8R1.7 O=C(O)[C@@H]1CCCS1 AM803451 [0,0,0,1,0,0|3,0,0]=4 185 B8R1.7 O=C(O)[C@H]1CCNC1 AM20100448 [0,0,0,1,0,0|3,0,0]=4 186 B8R1.7 O=C(O)[C@H]1CCNC1 AM20100693 [0,0,0,1,0,0|3,0,0]=4 187 B8R1.7 O=C(O)[C@H]1CCNC1 AM20100694 [0,0,0,1,0,0|3,0,0]=4 188 B8R1.7 O=C(O)[C@H]1CCNC1 AM20120375 [0,0,0,1,0,0|3,0,0]=4 189 B8R1.7 O=C(O)[C@H]1CCOC1 AM20090011 [0,0,0,1,0,0|3,0,0]=4 190 B8R1.7 O=C(O)[C@H]1CCOC1 AM20100615 [0,0,0,1,0,0|3,0,0]=4 191 B8R1.7 O=C(O)[C@H]1CCOC1 AM20120290 [0,0,0,1,0,0|3,0,0]=4 192 B8R1.22 C[C@H]1CNCCCO1 AM806380 [0,0,0,1,0,0|2,0,1]=4 193 B8R1.22 O=C1CCCCCC1 AMY3995 [0,0,0,1,0,0|1,0,0]=2 194 B8R1.22 O=C1CCCCCN1 AM802872 [0,0,0,1,0,0|1,0,0]=2 195 B8R1.22 O=C1CCCNCC1 AM20100232 [0,0,0,1,0,0|2,0,0]=3 196 B8R1.22 O=C1CCNCCN1 AM20090172 [0,0,0,1,0,0|2,0,0]=3 197 B8R1.22 O=C1CCNCCN1 AM85736 [0,0,0,1,0,0|2,0,0]=3 198 B8R1.22 O=C1CNCCCN1 AM804637 [0,0,0,1,0,0|2,0,0]=3 199 B8R1.31 CC1CCC1C(=O)O AM807028 [0,0,0,1,0,0|2,0,0]=3 200 B8R1.31 CC1NCC1C(=O)O AMY35766 [0,0,0,1,0,0|3,0,0]=4 201 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O AMY35641 [0,0,0,1,0,0|3,0,0]=4 202 B8R1.34 CC(=O)C=C1COC1 AMY5443 [0,0,0,1,0,0|2,0,1]=4 203 B8R1.34 CC(=O)NC1CNC1 AMY34221 [0,0,0,1,0,0|2,0,0]=3 204 B8R1.34 O=C(O)C=C1CCC1 AMY33602 [0,0,0,1,0,0|2,0,1]=4 205 B8R1.34 O=C(O)CC1CCC1 AM807029 [0,0,0,1,0,0|2,0,0]=3 206 B8R1.34 O=C(O)CC1CNC1 AMY33688 [0,0,0,1,0,0|3,0,0]=4 207 B8R1.34 O=C(O)CC1CNC1 AMY38757 [0,0,0,1,0,0|3,0,0]=4 208 B8R1.34 O=C(O)CC1COC1 AMY19671 [0,0,0,1,0,0|3,0,0]=4 209 B8R1.34 O=C(O)CN1CCC1 AMY21704 [0,0,0,1,0,0|3,0,0]=4 210 B8R1.35 O=C(O)CCC1CC1 AM8844 [0,0,0,1,0,0|2,0,0]=3 211 B8R1.35 O=C(O)\C=C\C1CC1 AMY34843 [0,0,0,1,0,0|2,0,1]=4 212 B8R1.72 CC1(C)CNCCO1 AM20080363 [0,0,0,1,0,0|2,0,1]=4 213 B8R1.72 CC1(C)CNCCO1 AMY34686 [0,0,0,1,0,0|2,0,1]=4 214 B8R1.72 CC1(N)CCCCC1 AM804197 [0,0,0,1,0,0|2,0,1]=4 215 B8R1.72 CC1(O)CCCCC1 AMY25717 [0,0,0,1,0,0|1,0,2]=4 216 B8R1.72 O=S1(=O)CCCCN1 AM803804 [0,0,0,1,0,0|3,0,0]=4 217 B5R0.1 C=C(C)CCBr AMY7022 [2,0,0,0,0,0|2,0,0]=4 218 B5R0.1 C=CCC(C)=O AMY31929 [2,0,0,0,0,0|0,0,2]=4 219 B5R0.1 CC(=O)CC#N AM86800 [2,0,0,0,0,0|1,0,1]=4 220 B5R0.1 CC(=O)CC#N AMY7035 [2,0,0,0,0,0|1,0,1]=4 221 B5R0.1 CC(=O)CCO AMY31061 [2,0,0,0,0,0|1,0,0]=3 222 B5R0.1 CC(=O)OCCl AMY28690 [2,0,0,0,0,0|1,0,0]=3 223 B5R0.1 CCCC(=N)N AM802888 [2,0,0,0,0,0|2,0,0]=4 224 B5R0.1 CCCC(=N)N AMY2389 [2,0,0,0,0,0|2,0,0]=4 225 B5R0.1 CCCC(C)=O AMY25524 [2,0,0,0,0,0|0,0,0]=2 226 B5R0.1 CCC[C@H](C)N AMY12548 [2,0,0,0,0,0|1,0,1]=4 227 B5R0.1 CCOC(=S)[S-] AM20080300 [2,0,0,0,0,0|1,1,0]=4 228 B5R0.1 CCOC(C)=N AM90190 [2,0,0,0,0,0|1,0,0]=3 229 B5R0.1 CCOC(N)=O AM20100253 [2,0,0,0,0,0|1,0,0]=3 230 B5R0.1 CCO[PH](=O)[O-] AMY22458 [2,0,0,0,0,0|2,0,0]=4 231 B5R0.1 CCSC(C)=S AM90236 [2,0,0,0,0,0|0,2,0]=4 232 B5R0.1 CNCC(=O)O AM20080021 [2,0,0,0,0,0|2,0,0]=4 233 B5R0.1 CNCC(C)=O AM806508 [2,0,0,0,0,0|1,0,0]=3 234 B5R0.1 CNCC(N)=O AM82642 [2,0,0,0,0,0|2,0,0]=4 235 B5R0.1 COCC(=O)Cl AMY40728 [2,0,0,0,0,0|2,0,0]=4 236 B5R0.1 COCC(=O)O AMY4059 [2,0,0,0,0,0|2,0,0]=4 237 B5R0.1 CSCC(N)=O AMY10906 [2,0,0,0,0,0|2,0,0]=4 238 B5R0.1 C\C=C\C(C)=O AMY31928 [2,0,0,0,0,0|0,0,2]=4 239 B5R0.1 NCCC(=O)O AM20080020 [2,0,0,0,0,0|2,0,0]=4 240 B5R0.1 NCCC(=O)O AMY22128 [2,0,0,0,0,0|2,0,0]=4 241 B5R0.1 NCCC(N)=O AM20100576 [2,0,0,0,0,0|2,0,0]=4 242 B5R0.1 NCCC(N)=O AMY6958 [2,0,0,0,0,0|2,0,0]=4 243 B5R0.1 O=C(Cl)CCBr AM90184 [2,0,0,0,0,0|2,0,0]=4 244 B5R0.1 O=C(O)CCBr AM20100434 [2,0,0,0,0,0|2,0,0]=4 245 B5R0.1 O=C(O)CCF AM803932 [2,0,0,0,0,0|2,0,0]=4 246 B5R0.1 O=C(O)CCO AM85796 [2,0,0,0,0,0|2,0,0]=4 247 B5R0.1 O=C(O)CCS AMY27767 [2,0,0,0,0,0|2,0,0]=4 248 B5R0.2 C#CCCCC AMY1242 [2,0,0,0,0,0|0,0,2]=4 249 B5R0.2 C=CCCCBr AM20080066 [2,0,0,0,0,0|1,0,1]=4 250 B5R0.2 C=CCCCO AMY41353 [2,0,0,0,0,0|1,0,1]=4 251 B5R0.2 CCCCCBr AMY9378 [2,0,0,0,0,0|1,0,1]=4 252 B5R0.2 CCCCCC AMY22305 [2,0,0,0,0,0|0,0,1]=3 253 B5R0.2 CCCCCN AMY21878 [2,0,0,0,0,0|1,0,1]=4 254 B5R0.2 CCCCCS AMY19243 [2,0,0,0,0,0|0,1,1]=4 255 B5R0.2 CCCCNN AMY202003284 [2,0,0,0,0,0|2,0,0]=4 256 B5R0.2 CCCNCC AMY13343 [2,0,0,0,0,0|1,0,1]=4 257 B5R0.2 CNCCCN AM20100546 [2,0,0,0,0,0|2,0,0]=4 258 B5R0.2 CNCCNC AM86300 [2,0,0,0,0,0|2,0,0]=4 259 B5R0.2 COCCC#N AMY40960 [2,0,0,0,0,0|1,0,1]=4 260 B5R0.2 COCCCBr AM20090592 [2,0,0,0,0,0|1,0,0]=3 261 B5R0.2 COCCCCl AMY25654 [2,0,0,0,0,0|1,0,0]=3 262 B5R0.2 COCCCN AMY21871 [2,0,0,0,0,0|1,0,0]=3 263 B5R0.2 COCCCN AMY38449 [2,0,0,0,0,0|1,0,0]=3 264 B5R0.2 COCCCO AM20080231 [2,0,0,0,0,0|1,0,0]=3 265 B5R0.2 COCCNN AM803665 [2,0,0,0,0,0|2,0,0]=4 266 B5R0.2 COCCNN AMY202003278 [2,0,0,0,0,0|2,0,0]=4 267 B5R0.2 COCCOC AMY25530 [2,0,0,0,0,0|1,0,0]=3 268 B5R0.2 COCCON AMY27642 [2,0,0,0,0,0|2,0,0]=4 269 B5R0.2 CSCCCCl AMY744 [2,0,0,0,0,0|1,1,0]=4 270 B5R0.2 N#CCCC=O AMY9205 [2,0,0,0,0,0|1,0,1]=4 271 B5R0.2 O=CCCC=O AMY18777 [2,0,0,0,0,0|1,0,1]=4 272 B7R0.2 CCC(=O)CC(=O)O AM85448 [1,1,0,0,0,0|1,0,1]=4 273 B7R0.2 CCC(=O)CC(=O)[O-] AM88443 [1,1,0,0,0,0|1,0,1]=4 274 B7R0.2 CCC(=O)CC(C)=O AMY2701 [1,1,0,0,0,0|0,0,1]=3 275 B7R0.2 CCC(C)CC(C)N AMY12579 [1,1,0,0,0,0|1,0,1]=4 276 B7R0.2 CC[C@H](C)NC(N)=O AMY7838 [1,1,0,0,0,0|2,0,0]=4 277 B7R0.2 CC[C@H](O)CC(=O)O AM85451 [1,1,0,0,0,0|1,0,0]=3 278 B7R0.2 NC[C@@H](N)CC(=O)O AMY21992 [1,1,0,0,0,0|2,0,0]=4 279 B7R0.2 NC[C@H](N)CC(=O)O AMY21991 [1,1,0,0,0,0|2,0,0]=4 280 B7R0.2 N[C@H](CO)CC(=O)O AM20080465 [1,1,0,0,0,0|2,0,0]=4 281 B7R0.3 C=CC(=O)NCCC AMY39214 [1,1,0,0,0,0|1,0,1]=4 282 B7R0.3 CCCCC(=O)NN AMY3964 [1,1,0,0,0,0|1,0,0]=3 283 B7R0.3 CCCC[C@H](N)CO AMY7200 [1,1,0,0,0,0|1,0,1]=4 284 B7R0.3 CCCC[C@H](O)CO AMY11157 [1,1,0,0,0,0|0,0,2]=4 285 B7R0.3 CCCOC(=O)CC AMY21939 [1,1,0,0,0,0|0,0,0]=2 286 B7R0.3 CNCCC(=O)OC AMY4326 [1,1,0,0,0,0|1,0,0]=3 287 B7R0.3 COC(=O)CCC=O AM20080287 [1,1,0,0,0,0|1,0,1]=4 288 B7R0.3 COC(=O)CCCN AM803145 [1,1,0,0,0,0|1,0,0]=3 289 B7R0.3 COC(=O)CCCS AMY40461 [1,1,0,0,0,0|1,0,0]=3 290 B7R0.3 [C-]#[N+]CCC(=O)OC AMY21714 [1,1,0,0,0,0|1,0,1]=4 291 B7R0.5 CCCC(=O)C(=O)O AMY6081 [1,1,0,0,0,0|1,0,1]=4 292 B7R0.5 CCC[C@H](N)C(=O)O AM20090147 [1,1,0,0,0,0|1,0,0]=3 293 B7R0.5 CCC[C@H](N)C(=O)O AM20100599 [1,1,0,0,0,0|1,0,0]=3 294 B7R0.5 CCC[C@H](N)C(=O)O AM20100742 [1,1,0,0,0,0|1,0,0]=3 295 B7R0.5 CCOC(=O)C(C)=O AMY40824 [1,1,0,0,0,0|1,0,1]=4 296 B7R0.5 CNC[C@H](N)C(=O)O AM86002 [1,1,0,0,0,0|2,0,0]=4 297 B7R0.5 CNC[C@H](N)C(=O)O AMY22064 [1,1,0,0,0,0|2,0,0]=4 298 B7R0.5 COC[C@@H](N)C(=O)O AMY25034 [1,1,0,0,0,0|2,0,0]=4 299 B7R0.5 COC[C@H](Cl)C(=O)O AMY11466 [1,1,0,0,0,0|2,0,0]=4 300 B7R0.5 COC[C@H](N)C(=O)O AM808146 [1,1,0,0,0,0|2,0,0]=4 301 B7R0.5 COC[C@H](N)C(=O)O AM808152 [1,1,0,0,0,0|2,0,0]=4 302 B7R0.5 COC[C@H](N)C(=O)O AM808173 [1,1,0,0,0,0|2,0,0]=4 303 B7R0.5 CSC[C@H](N)C(=O)O AM82581 [1,1,0,0,0,0|2,0,0]=4 304 B7R0.5 NCC[C@H](N)C(=O)O AM20090101 [1,1,0,0,0,0|2,0,0]=4 305 B7R0.5 NCC[C@H](N)C(=O)O AM20100596 [1,1,0,0,0,0|2,0,0]=4 306 B7R0.5 NCC[C@H](N)C(=O)O AM803354 [1,1,0,0,0,0|2,0,0]=4 307 B7R0.5 NCC[C@H](N)C(=O)O AM82466 [1,1,0,0,0,0|2,0,0]=4 308 B7R0.5 NCC[C@H](O)C(=O)O AM20100077 [1,1,0,0,0,0|2,0,0]=4 309 B7R0.5 N[C@@H](CCBr)C(=O)O AMY18828 [1,1,0,0,0,0|2,0,0]=4 310 B7R0.5 N[C@@H](CCBr)C(=O)O AMY4429 [1,1,0,0,0,0|2,0,0]=4 311 B7R0.5 N[C@@H](CCO)C(=O)O AM20100471 [1,1,0,0,0,0|2,0,0]=4 312 B7R0.5 N[C@@H](CCO)C(=O)O AM20100617 [1,1,0,0,0,0|2,0,0]=4 313 B7R0.5 N[C@@H](CCO)C(=O)O AM82563 [1,1,0,0,0,0|2,0,0]=4 314 B7R0.5 N[C@@H](CCS)C(=O)O AMY25680 [1,1,0,0,0,0|2,0,0]=4 315 B7R0.5 O=C(Cl)[C@@H](Br)CCBr AM20080598 [1,1,0,0,0,0|2,0,0]=4 316 B7R0.6 CC(=O)CCC(=O)O AM20080171 [1,1,0,0,0,0|1,0,1]=4 317 B7R0.6 CC(=O)CCC(C)=O AMY25528 [1,1,0,0,0,0|0,0,1]=3 318 B7R0.6 CC(=O)CNC(C)=O AMY32031 [1,1,0,0,0,0|1,0,1]=4 319 B7R0.6 CC(=O)OCC(=O)Cl AMY39424 [1,1,0,0,0,0|1,0,1]=4 320 B7R0.6 CC(=O)OCC(=O)O AMY3826 [1,1,0,0,0,0|1,0,1]=4 321 B7R0.6 CC(C)CCC(=O)Cl AMY33518 [1,1,0,0,0,0|1,0,0]=3 322 B7R0.6 CC(C)CC[C@H](C)N AMY3922 [1,1,0,0,0,0|1,0,1]=4 323 B7R0.6 CC(C)NCC(=O)Cl AM87903 [1,1,0,0,0,0|2,0,0]=4 324 B7R0.6 CC(C)OCC(=O)O AMY4704 [1,1,0,0,0,0|2,0,0]=4 325 B7R0.6 CN(C)CCC(=O)O AM86616 [1,1,0,0,0,0|2,0,0]=4 326 B7R0.8 CCCCC(C)(O)O AMY1200 [1,1,0,0,0,0|0,0,2]=4 327 B7R0.8 CCCOS(C)(=O)=O AMY3885 [1,1,0,0,0,0|1,0,0]=3 328 B7R0.8 CS(=O)(=O)CCCO AMY42220 [1,1,0,0,0,0|2,0,0]=4 329 B7R0.1 C=CCCCCC=O AMY2455 [1,1,0,0,0,0|1,0,1]=4 330 B7R0.1 C=CCCCCCCl AM85971 [1,1,0,0,0,0|1,0,1]=4 331 B7R0.1 C=CCCCCCO AMY7500 [1,1,0,0,0,0|1,0,1]=4 332 B7R0.1 C=CCCCCNC AMY41147 [1,1,0,0,0,0|1,0,1]=4 333 B7R0.1 CCCCCON=O AMY3989 [1,1,0,0,0,0|1,0,0]=3 334 B7R0.1 CNCCCCNC AMY13612 [1,1,0,0,0,0|2,0,0]=4 335 B7R0.1 OCCCOCCCl AM806608 [1,1,0,0,0,0|1,0,1]=4 336 B7R0.7 CCCC(N)CCC AMY3864 [1,1,0,0,0,0|1,0,1]=4 337 B7R0.7 CCCC(O)CCC AMY23531 [1,1,0,0,0,0|1,0,1]=4 338 B9R0.53 CC(C)C[C@H](N)CC(=O)O AM20090584 [0,2,0,0,0,0|2,0,0]=4 339 B9R0.53 CC(C)C[C@H](N)CC(=O)O AMY14352 [0,2,0,0,0,0|2,0,0]=4 340 B9R0.58 CCC[C@](C)(O)CC(=O)O AMY27843 [0,2,0,0,0,0|2,0,0]=4 341 B9R0.1 CC(C)=CCC[C@H](C)C=O AMY25518 [0,2,0,0,0,0|2,0,0]=4 342 B9R0.5 CCOC(=O)CCCCBr AM20080354 [0,2,0,0,0,0|2,0,0]=4 343 B9R0.5 COCCNC(=O)CC#N AM803247 [0,2,0,0,0,0|2,0,0]=4 344 B9R0.8 CCCC[C@H](Br)C(=O)OC AMY21797 [0,2,0,0,0,0|1,0,0]=3 345 B9R0.8 CCCC[C@H](N)C(=O)OC AM82593 [0,2,0,0,0,0|1,0,0]=3 346 B9R0.8 COC(=O)[C@@H](Br)CCCBr AMY17784 [0,2,0,0,0,0|2,0,0]=4 347 B9R0.8 COC(=O)[C@@H](N)CCCN AM20100070 [0,2,0,0,0,0|2,0,0]=4 348 B9R0.24 C=CC(=O)OC[C@H](Br)CBr AMY25604 [0,2,0,0,0,0|1,0,1]=4 349 B9R0.24 CCC(=O)CCC(=O)CC AMY42063 [0,2,0,0,0,0|1,0,1]=4 350 B9R0.24 CCC(=O)CCC(=O)OC AMY30255 [0,2,0,0,0,0|1,0,1]=4 351 B9R0.46 CCCCCCC(=O)NO AM806754 [0,2,0,0,0,0|2,0,0]=4 352 B9R0.46 COC(=O)CCCCC=O AM85868 [0,2,0,0,0,0|1,0,1]=4 353 B9R0.46 COC(=O)CCCCCBr AMY17985 [0,2,0,0,0,0|1,0,0]=3 354 B9R0.46 COC(=O)CCCCCN AM20090125 [0,2,0,0,0,0|1,0,0]=3 355 B9R0.47 C=C(C)C(=O)NCCCN AM807272 [0,2,0,0,0,0|2,0,0]=4 356 B9R0.47 C=C(C)C(=O)OCCCC AMY4150 [0,2,0,0,0,0|0,0,0]=2 357 B9R0.47 C=C(C)C(=O)OCCCO AMY18806 [0,2,0,0,0,0|1,0,0]=3 358 B9R0.47 CCCCC[C@H](C)C(=O)O AMY25539 [0,2,0,0,0,0|1,0,1]=4 359 B9R0.47 NCCCC[C@H](N)C(=O)O AM20100333 [0,2,0,0,0,0|2,0,0]=4 360 B9R0.47 NCCCC[C@H](N)C(=O)O AM20100376 [0,2,0,0,0,0|2,0,0]=4 361 B9R0.47 NCCCC[C@H](N)C(=O)O AM20100661 [0,2,0,0,0,0|2,0,0]=4 362 B9R0.47 NCCCC[C@H](N)C(=O)O AM20100662 [0,2,0,0,0,0|2,0,0]=4 363 B9R0.47 NCCCC[C@H](N)C(=O)O AM20100696 [0,2,0,0,0,0|2,0,0]=4 364 B9R0.47 NCCCC[C@H](N)C(=O)O AM81900 [0,2,0,0,0,0|2,0,0]=4 365 B9R0.47 NCCCC[C@H](N)C(=O)O AM81901 [0,2,0,0,0,0|2,0,0]=4 366 B9R0.47 NCCCC[C@H](N)C(=O)O AM81902 [0,2,0,0,0,0|2,0,0]=4 367 B9R0.47 NCCCC[C@H](N)C(=O)O AMY25343 [0,2,0,0,0,0|2,0,0]=4 368 B9R0.2 CC(=O)OCCOCCO AMY28818 [0,2,0,0,0,0|0,0,0]=2 369 B9R0.2 CCCCCCCC(=O)[O-] AMY19799 [0,2,0,0,0,0|2,0,0]=4 370 B9R0.2 CCCCCCOC(=O)Cl AMY4168 [0,2,0,0,0,0|1,0,0]=3 371 B9R0.2 CC\C=C\CCOC(C)=O AM806731 [0,2,0,0,0,0|0,0,0]=2 372 B9R0.2 NCCCCCCC(=O)O AM20120334 [0,2,0,0,0,0|2,0,0]=4 373 B9R0.2 O=C(O)CCCCCCBr AMY10966 [0,2,0,0,0,0|2,0,0]=4 374 B9R0.2 O=C(O)CCCCCCO AM20090595 [0,2,0,0,0,0|2,0,0]=4 375 B9R0.2 O=C(O)CNCCCCO AM806410 [0,2,0,0,0,0|2,0,0]=4 376 B9R0.48 CCOC(=O)CNC(C)=O AM20090112 [0,2,0,0,0,0|1,0,1]=4 377 B9R0.55 CC(C)CCOCC(=O)O AMY15507 [0,2,0,0,0,0|1,0,0]=3 378 B9R0.55 CN(C)CCCCC(=O)O AMY20362 [0,2,0,0,0,0|2,0,0]=4 379 B9R0.55 CN(C)CCCCC(=O)O AMY20363 [0,2,0,0,0,0|2,0,0]=4 380 B9R0.13 CCCC[C@H](CC)C(=O)O AM9656 [0,2,0,0,0,0|2,0,0]=4 381 B9R0.13 CCCC[C@H](CC)C(=O)O AM9657 [0,2,0,0,0,0|2,0,0]=4 382 B9R0.13 CCCC[C@H](NC)C(=O)O AM9198 [0,2,0,0,0,0|2,0,0]=4 383 B9R0.43 CCN(CC)CCC(C)=O AMY19297 [0,2,0,0,0,0|2,0,0]=4 384 B9R0.56 CC(=O)OCC[B-](F)(F)F AMY1141 [0,2,0,0,0,0|2,0,0]=4 385 B9R0.56 CC(=O)OCC[N+](C)(C)C AM20080864 [0,2,0,0,0,0|1,0,0]=3 386 B9R0.56 CC(=O)SCC[N+](C)(C)C AMY27039 [0,2,0,0,0,0|1,1,0]=4 387 B9R0.56 CC(=O)SCC[N+](C)(C)C AMY27054 [0,2,0,0,0,0|1,1,0]=4 388 B7R1.2 CN1CCC(=O)C1 AM20100632 [1,0,0,1,0,0|1,0,0]=3 389 B7R1.2 CN1CCC(=O)C1 AMY25051 [1,0,0,1,0,0|1,0,0]=3 390 B7R1.2 C[C@@H]1CCC(=O)N1 AMY37338 [1,0,0,1,0,0|1,0,0]=3 391 B7R1.2 C[C@@H]1CC[C@@H](C)N1 AMY202003238 [1,0,0,1,0,0|1,0,1]=4 392 B7R1.2 C[C@@H]1CNC(=O)C1 AMY34987 [1,0,0,1,0,0|1,0,0]=3 393 B7R1.2 C[C@H]1CCC(=O)C1 AMY3874 [1,0,0,1,0,0|0,0,0]=2 394 B7R1.2 C[C@H]1CCC(=O)N1 AMY23794 [1,0,0,1,0,0|1,0,0]=3 395 B7R1.2 C[C@H]1CC[C@H](C)N1 AMY202003211 [1,0,0,1,0,0|1,0,1]=4 396 B7R1.2 C[C@H]1CNC(=O)C1 AMY35747 [1,0,0,1,0,0|1,0,0]=3 397 B7R1.2 C[C@H]1CNC(=O)O1 AMY3772 [1,0,0,1,0,0|2,0,0]=4 398 B7R1.2 N[C@@H]1CNC(=O)C1 AMY34929 [1,0,0,1,0,0|2,0,0]=4 399 B7R1.2 N[C@@H]1COC(=O)C1 AMY22231 [1,0,0,1,0,0|1,0,0]=3 400 B7R1.2 N[C@H]1COC(=O)C1 AMY18836 [1,0,0,1,0,0|1,0,0]=3 401 B7R1.2 O=C1CCC(=O)C1 AM20100026 [1,0,0,1,0,0|1,0,1]=4 402 B7R1.2 O=C1CC[C@H](O)C1 AMY33737 [1,0,0,1,0,0|1,0,0]=3 403 B7R1.2 O=C1C[C@H](O)CN1 AM20090229 [1,0,0,1,0,0|2,0,0]=4 404 B7R1.2 O=C1C[C@H](O)CN1 AM20100631 [1,0,0,1,0,0|2,0,0]=4 405 B7R1.2 O=C1C[C@H](O)CN1 AMY22949 [1,0,0,1,0,0|2,0,0]=4 406 B7R1.2 O=C1C[C@H](O)CO1 AMY4221 [1,0,0,1,0,0|1,0,0]=3 407 B7R1.2 O=C1OC[C@H](Cl)O1 AMY19473 [1,0,0,1,0,0|2,0,0]=4 408 B7R1.3 BrC1=CCCCC1 AMY38285 [1,0,0,1,0,0|1,0,1]=4 409 B7R1.3 C=C1CCCCC1 AMY736 [1,0,0,1,0,0|1,0,0]=3 410 B7R1.3 C=C1CCCOC1 AMY6008 [1,0,0,1,0,0|2,0,0]=4 411 B7R1.3 C=C1CCNCC1 AMY5962 [1,0,0,1,0,0|2,0,0]=4 412 B7R1.3 C=C1CCNCC1 AMY6101 [1,0,0,1,0,0|2,0,0]=4 413 B7R1.3 C=C1CCNCC1 AMY6167 [1,0,0,1,0,0|2,0,0]=4 414 B7R1.3 C=C1CCOCC1 AMY34984 [1,0,0,1,0,0|2,0,0]=4 415 B7R1.3 CC1=CCNCC1 AMY33784 [1,0,0,1,0,0|2,0,0]=4 416 B7R1.3 CC1=CCOCC1 AMY5953 [1,0,0,1,0,0|2,0,0]=4 417 B7R1.3 CC1=COCCC1 AMY6007 [1,0,0,1,0,0|2,0,0]=4 418 B7R1.3 CN1CCCCC1 AM20100531 [1,0,0,1,0,0|2,0,0]=4 419 B7R1.3 C[C@H]1CCCCN1 AM20080042 [1,0,0,1,0,0|1,0,1]=4 420 B7R1.3 C[C@H]1CCCCN1 AM81342 [1,0,0,1,0,0|1,0,1]=4 421 B7R1.3 ClC1=CCCCC1 AM85974 [1,0,0,1,0,0|1,0,1]=4 422 B7R1.3 ClC1CCCCC1 AM90219 [1,0,0,1,0,0|1,0,1]=4 423 B7R1.3 NC1CCCCC1 AM802905 [1,0,0,1,0,0|1,0,1]=4 424 B7R1.3 NN1CCCCC1 AM85332 [1,0,0,1,0,0|2,0,0]=4 425 B7R1.3 NN1CCCCC1 AM85348 [1,0,0,1,0,0|2,0,0]=4 426 B7R1.3 O=C1CCCCN1 AM20100626 [1,0,0,1,0,0|1,0,0]=3 427 B7R1.3 O=C1CCCNC1 AM20100504 [1,0,0,1,0,0|1,0,0]=3 428 B7R1.3 O=C1CCCNC1 AM81341 [1,0,0,1,0,0|1,0,0]=3 429 B7R1.3 O=C1CCCOC1 AM20090251 [1,0,0,1,0,0|1,0,0]=3 430 B7R1.3 O=C1CCCSC1 AM20090115 [1,0,0,1,0,0|1,0,0]=3 431 B7R1.3 O=C1CCNCC1 AM100807 [1,0,0,1,0,0|1,0,0]=3 432 B7R1.3 O=C1CCNCC1 AM20100060 [1,0,0,1,0,0|1,0,0]=3 433 B7R1.3 O=C1CCNCC1 AM803879 [1,0,0,1,0,0|1,0,0]=3 434 B7R1.3 O=C1CCOCC1 AM20090400 [1,0,0,1,0,0|1,0,0]=3 435 B7R1.3 O=C1CCSCC1 AM20080026 [1,0,0,1,0,0|1,0,0]=3 436 B7R1.3 O=C1CNCCN1 AM20100386 [1,0,0,1,0,0|2,0,0]=4 437 B7R1.3 O=C1CNCCO1 AM62713 [1,0,0,1,0,0|1,0,0]=3 438 B7R1.3 O=C1COCCN1 AM20080044 [1,0,0,1,0,0|2,0,0]=4 439 B7R1.3 O=C1CSCCN1 AMY10805 [1,0,0,1,0,0|2,0,0]=4 440 B7R1.3 O=C1NCCCN1 AM90187 [1,0,0,1,0,0|2,0,0]=4 441 B7R1.3 O=C1NCCCO1 AMY19041 [1,0,0,1,0,0|1,0,0]=3 442 B7R1.3 O=S1CCOCC1 AMY42358 [1,0,0,1,0,0|2,0,0]=4 443 B7R1.3 SC1CCCCC1 AMY11243 [1,0,0,1,0,0|0,1,1]=4 444 B7R1.10 C=C1CC(CBr)C1 AM84291 [1,0,0,1,0,0|2,0,0]=4 445 B7R1.10 C=C1CC(CN)C1 AM84290 [1,0,0,1,0,0|2,0,0]=4 446 B7R1.10 C=C1CC(CO)C1 AM84289 [1,0,0,1,0,0|2,0,0]=4 447 B7R1.10 N#CC1CC(=O)C1 AM20070603 [1,0,0,1,0,0|1,0,1]=4 448 B7R1.10 O=C1CC(CBr)C1 AM85778 [1,0,0,1,0,0|1,0,0]=3 449 B7R1.10 O=C1CC(CF)C1 AM84266 [1,0,0,1,0,0|1,0,0]=3 450 B7R1.10 O=C1CC(CO)C1 AM20070600 [1,0,0,1,0,0|1,0,0]=3 451 B7R1.12 CC1CC1C(=O)O AM803649 [1,0,0,1,0,0|1,0,0]=3 452 B7R1.12 CC1CC1C(N)=O AMY5644 [1,0,0,1,0,0|1,0,0]=3 453 B7R1.12 C[C@@H]1C[C@H]1C(=O)O AMY35644 [1,0,0,1,0,0|1,0,0]=3 454 B7R1.12 O=C(O)C1CC1F AMY5778 [1,0,0,1,0,0|2,0,0]=4 455 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F AMY5475 [1,0,0,1,0,0|2,0,0]=4 456 B7R1.12 O=C(O)[C@H]1C[C@@H]1F AM85620 [1,0,0,1,0,0|2,0,0]=4 457 B7R1.12 O=C(O)[C@H]1C[C@@H]1F AM85621 [1,0,0,1,0,0|2,0,0]=4 458 B7R1.12 O=C(O)[C@H]1C[C@H]1F AM85536 [1,0,0,1,0,0|2,0,0]=4 459 B7R1.12 O=C(O)[C@H]1C[C@H]1I AMY5812 [1,0,0,1,0,0|2,0,0]=4 460 B7R1.14 CC1(N)CCCC1 AM808157 [1,0,0,1,0,0|1,0,1]=4 461 B7R1.14 CC1(O)CCCC1 AMY25573 [1,0,0,1,0,0|0,0,2]=4 462 B7R1.14 C[Si]1(C)CCCC1 AMY42241 [1,0,0,1,0,0|1,1,0]=4 463 B7R1.14 O=S1(=O)CCCC1 AMY33385 [1,0,0,1,0,0|2,0,0]=4 464 B7R1.18 C[C@@H](N)C1CCC1 AM807006 [1,0,0,1,0,0|1,0,1]=4 465 B7R1.18 C[C@H](N)C1CCC1 AM807007 [1,0,0,1,0,0|1,0,1]=4 466 B7R1.18 C[C@H](N)C1CCC1 AM807008 [1,0,0,1,0,0|1,0,1]=4 467 B7R1.18 C[C@H](O)C1CCC1 AMY16099 [1,0,0,1,0,0|0,0,2]=4 468 B7R1.18 NC(=O)C1CCC1 AMY32785 [1,0,0,1,0,0|1,0,0]=3 469 B7R1.18 NC(=O)C1CNC1 AM20100716 [1,0,0,1,0,0|2,0,0]=4 470 B7R1.18 NC(=O)C1CNC1 AMY34027 [1,0,0,1,0,0|2,0,0]=4 471 B7R1.18 NC(=O)[C@@H]1CCN1 AMY38555 [1,0,0,1,0,0|2,0,0]=4 472 B7R1.18 O=C(O)C1CCC1 AM62800 [1,0,0,1,0,0|1,0,0]=3 473 B7R1.18 O=C(O)C1CNC1 AM20090582 [1,0,0,1,0,0|2,0,0]=4 474 B7R1.18 O=C(O)C1CNC1 AMY4825 [1,0,0,1,0,0|2,0,0]=4 475 B7R1.18 O=C(O)C1COC1 AM84264 [1,0,0,1,0,0|2,0,0]=4 476 B7R1.18 O=C(O)C1CSC1 AM20100754 [1,0,0,1,0,0|2,0,0]=4 477 B7R1.18 O=C(O)[C@@H]1CCN1 AM20090145 [1,0,0,1,0,0|2,0,0]=4 478 B7R1.18 O=C(O)[C@@H]1CCN1 AM20090185 [1,0,0,1,0,0|2,0,0]=4 479 B7R1.18 O=C(O)[C@@H]1CCN1 AM20100766 [1,0,0,1,0,0|2,0,0]=4 480 B7R1.18 O=C(O)[C@@H]1CCO1 AM20020050 [1,0,0,1,0,0|2,0,0]=4 481 B7R1.18 O=[N+]([O-])C1CCC1 AMY18168 [1,0,0,1,0,0|2,0,0]=4 482 B7R1.20 CC(=O)CC1CC1 AM20100099 [1,0,0,1,0,0|0,0,0]=2 483 B7R1.20 O=C(O)CC1CC1 AM20100289 [1,0,0,1,0,0|1,0,0]=3 484 B7R1.1 BrC[C@H]1CCOC1 AM20080466 [1,0,0,1,0,0|1,0,1]=4 485 B7R1.1 C=CN1CCCC1 AM85776 [1,0,0,1,0,0|1,0,1]=4 486 B7R1.1 CC[C@@H]1CCNC1 AMY34410 [1,0,0,1,0,0|1,0,1]=4 487 B7R1.1 CC[C@H]1CCNC1 AMY34423 [1,0,0,1,0,0|1,0,1]=4 488 B7R1.1 CNC1CCCC1 AMY10584 [1,0,0,1,0,0|2,0,0]=4 489 B7R1.1 CN[C@@H]1CCOC1 AMY37512 [1,0,0,1,0,0|1,0,1]=4 490 B7R1.1 CN[C@H]1CCOC1 AM20120293 [1,0,0,1,0,0|1,0,1]=4 491 B7R1.1 CN[C@H]1CCOC1 AMY34214 [1,0,0,1,0,0|1,0,1]=4 492 B7R1.1 CN[C@H]1CCOC1 AMY37563 [1,0,0,1,0,0|1,0,1]=4 493 B7R1.1 IC[C@H]1CCOC1 AMY33647 [1,0,0,1,0,0|1,0,1]=4 494 B7R1.1 NC[C@H]1CCOC1 AM20070698 [1,0,0,1,0,0|1,0,1]=4 495 B7R1.1 NC[C@H]1CCOC1 AM20070699 [1,0,0,1,0,0|1,0,1]=4 496 B7R1.1 NC[C@H]1CCOC1 AM20080467 [1,0,0,1,0,0|1,0,1]=4 497 B7R1.1 NC[C@H]1CCOC1 AM20090079 [1,0,0,1,0,0|1,0,1]=4 498 B7R1.1 O=CC1=CCCC1 AMY30885 [1,0,0,1,0,0|1,0,1]=4 499 B7R1.1 O=CC1CCCC1 AM83284 [1,0,0,1,0,0|1,0,0]=3 500 B7R1.1 O=CN1CCCC1 AMY24174 [1,0,0,1,0,0|1,0,0]=3 501 B7R1.1 O=C[C@@H]1CCCN1 AM101023 [1,0,0,1,0,0|2,0,0]=4 502 B7R1.1 O=C[C@@H]1CCCN1 AM95058 [1,0,0,1,0,0|2,0,0]=4 503 B7R1.1 O=C[C@@H]1CCCN1 AM95490 [1,0,0,1,0,0|2,0,0]=4 504 B7R1.1 O=C[C@@H]1CCCO1 AM85907 [1,0,0,1,0,0|2,0,0]=4 505 B7R1.1 O=C[C@H]1CCNC1 AM101346 [1,0,0,1,0,0|2,0,0]=4 506 B7R1.1 O=C[C@H]1CCNC1 AM94342 [1,0,0,1,0,0|2,0,0]=4 507 B7R1.1 O=C[C@H]1CCOC1 AMY5966 [1,0,0,1,0,0|2,0,0]=4 508 B7R1.1 OCC1CC=CC1 AM20090293 [1,0,0,1,0,0|2,0,0]=4 509 B7R1.1 OC[C@H]1CCOC1 AM20080182 [1,0,0,1,0,0|1,0,1]=4 510 B7R1.1 OC[C@H]1CCOC1 AM20080421 [1,0,0,1,0,0|1,0,1]=4 511 B7R1.1 OC[C@H]1CCOC1 AMY23730 [1,0,0,1,0,0|1,0,1]=4 512 B7R1.4 C=C1CCOC1=O AMY7315 [1,0,0,1,0,0|0,0,2]=4 513 B7R1.4 CN1CCCC1=O AM20110252 [1,0,0,1,0,0|2,0,0]=4 514 B7R1.4 C[C@@H]1SCCC1=O AMY23233 [1,0,0,1,0,0|2,0,0]=4 515 B7R1.4 C[C@H]1CCCC1=O AM84338 [1,0,0,1,0,0|1,0,0]=3 516 B7R1.4 C[C@H]1CCOC1=O AM20090007 [1,0,0,1,0,0|0,0,0]=2 517 B7R1.4 N[C@@H]1CCOC1=O AMY22572 [1,0,0,1,0,0|1,0,0]=3 518 B7R1.4 N[C@H]1CCNC1=O AM20130022 [1,0,0,1,0,0|2,0,0]=4 519 B7R1.4 N[C@H]1CCNC1=O AMY15667 [1,0,0,1,0,0|2,0,0]=4 520 B7R1.4 N[C@H]1CCOC1=O AM20090203 [1,0,0,1,0,0|1,0,0]=3 521 B7R1.4 N[C@H]1CCOC1=O AMY21622 [1,0,0,1,0,0|1,0,0]=3 522 B7R1.4 N[C@H]1CCSC1=O AMY25724 [1,0,0,1,0,0|1,1,0]=4 523 B7R1.4 O=C1CCC[C@@H]1Br AM20090204 [1,0,0,1,0,0|2,0,0]=4 524 B7R1.4 O=C1NCC[C@@H]1O AM20080386 [1,0,0,1,0,0|2,0,0]=4 525 B7R1.4 O=C1NCC[C@@H]1O AM20090532 [1,0,0,1,0,0|2,0,0]=4 526 B7R1.4 O=C1NCC[C@H]1O AMY14450 [1,0,0,1,0,0|2,0,0]=4 527 B7R1.4 O=C1OCC[C@@H]1Br AM20100243 [1,0,0,1,0,0|1,0,0]=3 528 B7R1.6 CCOC1CNC1 AM804015 [1,0,0,1,0,0|1,0,1]=4 529 B7R1.24 C1CNCCOC1 AM20090058 [1,0,0,1,0,0|1,0,1]=4 530 B9R1.7 CCC[C@H]1COC(=O)C1 AMY16477 [0,1,0,1,0,0|0,0,0]=2 531 B9R1.13 O=C(O)CC1CCCC1 AMY18728 [0,1,0,1,0,0|2,0,0]=4 532 B9R1.13 O=C(O)CN1CCCC1 AM803802 [0,1,0,1,0,0|2,0,0]=4 533 B9R1.13 O=C(O)C[C@@H]1CCCN1 AMY28614 [0,1,0,1,0,0|2,0,0]=4 534 B9R1.13 O=C(O)C[C@@H]1CCNC1 AMY25039 [0,1,0,1,0,0|2,0,0]=4 535 B9R1.13 O=C(O)C[C@H]1CCCO1 AMY37705 [0,1,0,1,0,0|2,0,0]=4 536 B9R1.13 O=C(O)C[C@H]1CCNC1 AM20120287 [0,1,0,1,0,0|2,0,0]=4 537 B9R1.13 O=C(O)C[C@H]1CCOC1 AM20080284 [0,1,0,1,0,0|2,0,0]=4 538 B9R1.34 CC1CC(=O)CC(=O)C1 AMY3042 [0,1,0,1,0,0|1,0,1]=4 539 B9R1.34 CC1CC(=O)OC(=O)C1 AMY3983 [0,1,0,1,0,0|0,0,1]=3 540 B9R1.34 C[C@H]1CC(=O)C[C@@H](C)O1 AMY35788 [0,1,0,1,0,0|2,0,0]=4 541 B9R1.41 CN1CCC[C@H]1C(=O)O AM100855 [0,1,0,1,0,0|2,0,0]=4 542 B9R1.41 CN1CCC[C@H]1C(=O)O AM101133 [0,1,0,1,0,0|2,0,0]=4 543 B9R1.41 CN1CCC[C@H]1C(=O)O AM20090144 [0,1,0,1,0,0|2,0,0]=4 544 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O AMY21145 [0,1,0,1,0,0|2,0,0]=4 545 B9R1.48 O=C1CCCCC(=O)C1 AM85496 [0,1,0,1,0,0|1,0,1]=4 546 B9R1.48 O=C1CCCCC(=O)O1 AMY41401 [0,1,0,1,0,0|0,0,1]=3 547 B9R1.53 CC(=O)O[C@H]1CC(=O)N1 AM20090365 [0,1,0,1,0,0|1,0,1]=4 548 B9R1.53 NC1CC(CC(=O)O)C1 AM85571 [0,1,0,1,0,0|2,0,0]=4 549 B9R1.53 N[C@H]1C[C@@H](CC(=O)O)C1 AMY34050 [0,1,0,1,0,0|2,0,0]=4 550 B9R1.66 CC1(C)CC(=O)CCO1 AM20080139 [0,1,0,1,0,0|2,0,0]=4 551 B9R1.66 CC1(C)CCCC(=O)C1 AM84905 [0,1,0,1,0,0|1,0,0]=3 552 B9R1.66 CC1(C)CCNC(=O)C1 AM90109 [0,1,0,1,0,0|1,0,0]=3 553 B9R1.66 CC1(C)C[C@@H](O)CCO1 AMY9124 [0,1,0,1,0,0|1,0,1]=4 554 B9R1.66 C[C@]1(O)CCOC(=O)C1 AMY10735 [0,1,0,1,0,0|0,0,0]=2 555 B9R1.137 CC(=O)CC(=O)C1CC1 AM20090193 [0,1,0,1,0,0|1,0,1]=4 556 B9R1.137 N[C@@H](CC(=O)O)C1CC1 AMY38208 [0,1,0,1,0,0|2,0,0]=4 557 B9R1.1 CCN1CCC(=O)CC1 AMY5271 [0,1,0,1,0,0|2,0,0]=4 558 B9R1.1 CNC1CCC(=O)CC1 AMY202100013 [0,1,0,1,0,0|2,0,0]=4 559 B9R1.1 COC1CCC(=O)CC1 AMY3589 [0,1,0,1,0,0|2,0,0]=4 560 B9R1.1 NC[C@H]1CCC(=O)NC1 AMY33863 [0,1,0,1,0,0|2,0,0]=4 561 B9R1.1 O=C1CCC(CO)CC1 AMY9066 [0,1,0,1,0,0|2,0,0]=4 562 B9R1.1 O=C1CO[C@@H](CO)CN1 AMY21703 [0,1,0,1,0,0|2,0,0]=4 563 B9R1.2 CNC1CCOC(C)C1 AMY6015 [0,1,0,1,0,0|1,0,1]=4 564 B9R1.2 NC[C@H]1CCNC(=O)C1 AM803060 [0,1,0,1,0,0|1,0,0]=3 565 B9R1.2 O=C1CCC[C@@H](CO)N1 AMY16344 [0,1,0,1,0,0|2,0,0]=4 566 B9R1.2 O=C1CCC[C@H](CO)C1 AMY18909 [0,1,0,1,0,0|1,0,0]=3 567 B9R1.2 O=C1CCC[C@H](CO)N1 AMY16343 [0,1,0,1,0,0|2,0,0]=4 568 B9R1.2 O=C1CCC[C@H](CO)N1 AMY16345 [0,1,0,1,0,0|2,0,0]=4 569 B9R1.2 O=C1COC[C@H](CO)N1 AMY21702 [0,1,0,1,0,0|2,0,0]=4 570 B9R1.3 CC1OCCC(=O)C1C AMY6076 [0,1,0,1,0,0|2,0,0]=4 571 B9R1.5 CN1CCCNCC1=O AM20100475 [0,1,0,1,0,0|2,0,0]=4 572 B9R1.5 CN1CCCNCC1=O AMY15722 [0,1,0,1,0,0|2,0,0]=4 573 B9R1.5 N[C@@H]1CCCCNC1=O AMY3925 [0,1,0,1,0,0|1,0,0]=3 574 B9R1.5 N[C@H]1CCCCNC1=O AM20090060 [0,1,0,1,0,0|1,0,0]=3 575 B9R1.5 N[C@H]1CCCCNC1=O AM803517 [0,1,0,1,0,0|1,0,0]=3 576 B9R1.11 COC(=O)C1=CCCC1 AM20090313 [0,1,0,1,0,0|1,0,1]=4 577 B9R1.11 COC(=O)C1CCCC1 AM803935 [0,1,0,1,0,0|1,0,0]=3 578 B9R1.11 COC(=O)[C@@H]1CCCN1 AM20090186 [0,1,0,1,0,0|2,0,0]=4 579 B9R1.11 COC(=O)[C@@H]1CCCN1 AM803993 [0,1,0,1,0,0|2,0,0]=4 580 B9R1.11 COC(=O)[C@@H]1CCCN1 AM82197 [0,1,0,1,0,0|2,0,0]=4 581 B9R1.11 COC(=O)[C@@H]1CCNC1 AMY23600 [0,1,0,1,0,0|2,0,0]=4 582 B9R1.11 COC(=O)[C@H]1CCNC1 AM20120399 [0,1,0,1,0,0|2,0,0]=4 583 B9R1.11 COC(=O)[C@H]1CCNC1 AM20120502 [0,1,0,1,0,0|2,0,0]=4 584 B9R1.11 COC(=O)[C@H]1CCNC1 AMY14571 [0,1,0,1,0,0|2,0,0]=4 585 B9R1.11 COC(=O)[C@H]1CCOC1 AMY202100097 [0,1,0,1,0,0|2,0,0]=4 586 B9R1.11 NCC(=O)N1CCCC1 AMY21509 [0,1,0,1,0,0|1,0,0]=3 587 B9R1.11 O=C(CCl)C1CCCC1 AMY7275 [0,1,0,1,0,0|1,0,0]=3 588 B9R1.11 O=C(CCl)N1CCCC1 AM803472 [0,1,0,1,0,0|1,0,0]=3 589 B9R1.49 CN1CCCC(=O)CC1 AM20090140 [0,1,0,1,0,0|2,0,0]=4 590 B9R1.49 CN1CCNC(=O)CC1 AM20120571 [0,1,0,1,0,0|2,0,0]=4 591 B9R1.50 O=C1CCCCCCC1 AMY3996 [0,1,0,1,0,0|1,0,0]=3 592 B9R1.50 O=C1CCCCCCN1 AM20100621 [0,1,0,1,0,0|1,0,0]=3 593 B9R1.79 COC(=O)CC1CNC1 AMY34161 [0,1,0,1,0,0|2,0,0]=4 594 B9R1.81 COC(=O)C1CNC1C AMY35763 [0,1,0,1,0,0|2,0,0]=4 595 B9R1.89 O=CC1CCCCCC1 AMY21681 [0,1,0,1,0,0|1,0,1]=4 596 B9R1.118 CC1(C=O)CCCCC1 AM20070501 [0,1,0,1,0,0|1,0,1]=4 597 B9R1.6 CC(=O)C1CCCCC1 AM20070516 [0,1,0,1,0,0|1,0,0]=3 598 B9R1.6 CC(=O)C1CCNCC1 AM20090433 [0,1,0,1,0,0|1,0,0]=3 599 B9R1.6 CC(=O)C1CCNCC1 AMY40616 [0,1,0,1,0,0|1,0,0]=3 600 B9R1.6 CC(=O)C1CCOCC1 AM803183 [0,1,0,1,0,0|1,0,0]=3 601 B9R1.6 CC(=O)N1CCNCC1 AM20080291 [0,1,0,1,0,0|1,0,0]=3 602 B9R1.6 CC(=O)N1CCOCC1 AMY10034 [0,1,0,1,0,0|1,0,0]=3 603 B9R1.6 CC(=O)[C@@H]1CCCCN1 AM20120390 [0,1,0,1,0,0|1,0,0]=3 604 B9R1.6 CC(=O)[C@H]1CCCNC1 AM20100792 [0,1,0,1,0,0|1,0,0]=3 605 B9R1.6 CC(C)=C1CCOCC1 AMY6092 [0,1,0,1,0,0|2,0,0]=4 606 B9R1.6 NC(=O)C1CCNCC1 AM20100043 [0,1,0,1,0,0|2,0,0]=4 607 B9R1.6 NC(=O)C1CCOCC1 AM20090538 [0,1,0,1,0,0|2,0,0]=4 608 B9R1.6 NC(=O)[C@@H]1CCCCN1 AMY5796 [0,1,0,1,0,0|2,0,0]=4 609 B9R1.6 NC(=O)[C@H]1CCCNC1 AM20100097 [0,1,0,1,0,0|2,0,0]=4 610 B9R1.6 O=C(Cl)C1CCOCC1 AM20100067 [0,1,0,1,0,0|2,0,0]=4 611 B9R1.6 O=C(Cl)N1CCOCC1 AMY9689 [0,1,0,1,0,0|2,0,0]=4 612 B9R1.6 O=C(O)C1=CCCCC1 AMY12562 [0,1,0,1,0,0|2,0,0]=4 613 B9R1.6 O=C(O)C1=CCCCO1 AMY25035 [0,1,0,1,0,0|1,0,1]=4 614 B9R1.6 O=C(O)C1CCCCC1 AM20070525 [0,1,0,1,0,0|2,0,0]=4 615 B9R1.6 O=C(O)C1CCNCC1 AM20100215 [0,1,0,1,0,0|2,0,0]=4 616 B9R1.6 O=C(O)C1CCOCC1 AM1056 [0,1,0,1,0,0|2,0,0]=4 617 B9R1.6 O=C(O)C1CCSCC1 AM804512 [0,1,0,1,0,0|2,0,0]=4 618 B9R1.6 O=C(O)[C@@H]1CCCCN1 AM20090026 [0,1,0,1,0,0|2,0,0]=4 619 B9R1.6 O=C(O)[C@@H]1CCCCN1 AM20100254 [0,1,0,1,0,0|2,0,0]=4 620 B9R1.6 O=C(O)[C@@H]1CCCCN1 AM803674 [0,1,0,1,0,0|2,0,0]=4 621 B9R1.6 O=C(O)[C@@H]1CCCCN1 AM90343 [0,1,0,1,0,0|2,0,0]=4 622 B9R1.6 O=C(O)[C@@H]1CCCCO1 AM20100266 [0,1,0,1,0,0|1,0,0]=3 623 B9R1.6 O=C(O)[C@@H]1CCCCO1 AMY34469 [0,1,0,1,0,0|1,0,0]=3 624 B9R1.6 O=C(O)[C@@H]1CNCCO1 AM20090406 [0,1,0,1,0,0|2,0,0]=4 625 B9R1.6 O=C(O)[C@H]1CCCCO1 AMY34375 [0,1,0,1,0,0|1,0,0]=3 626 B9R1.6 O=C(O)[C@H]1CCCNC1 AM20090295 [0,1,0,1,0,0|2,0,0]=4 627 B9R1.6 O=C(O)[C@H]1CCCNC1 AM20100216 [0,1,0,1,0,0|2,0,0]=4 628 B9R1.6 O=C(O)[C@H]1CCCNC1 AM83087 [0,1,0,1,0,0|2,0,0]=4 629 B9R1.6 O=C(O)[C@H]1CCCNC1 AMY4228 [0,1,0,1,0,0|2,0,0]=4 630 B9R1.6 O=C(O)[C@H]1CCCOC1 AM20110254 [0,1,0,1,0,0|2,0,0]=4 631 B9R1.6 O=C(O)[C@H]1CCCSC1 AMY34285 [0,1,0,1,0,0|2,0,0]=4 632 B9R1.6 O=C(O)[C@H]1CNCCO1 AMY21768 [0,1,0,1,0,0|2,0,0]=4 633 B9R1.23 CN1C[C@@H](CN)CC1=O AMY33766 [0,1,0,1,0,0|2,0,0]=4 634 B9R1.23 CN1C[C@@H](CO)CC1=O AMY34896 [0,1,0,1,0,0|2,0,0]=4 635 B9R1.35 CC(=O)N1CCC(=O)C1 AM100682 [0,1,0,1,0,0|1,0,1]=4 636 B9R1.35 CC(=O)N1CC[C@H](Br)C1 AM95037 [0,1,0,1,0,0|1,0,0]=3 637 B9R1.35 CC(=O)N1CC[C@H](Br)C1 AM96640 [0,1,0,1,0,0|1,0,0]=3 638 B9R1.35 CC(=O)N1CC[C@H](Br)C1 AM96910 [0,1,0,1,0,0|1,0,0]=3 639 B9R1.35 CC(=O)N1CC[C@H](Cl)C1 AM91958 [0,1,0,1,0,0|1,0,0]=3 640 B9R1.35 CC(=O)N1CC[C@H](Cl)C1 AM95359 [0,1,0,1,0,0|1,0,0]=3 641 B9R1.35 CC(=O)N1CC[C@H](Cl)C1 AM96637 [0,1,0,1,0,0|1,0,0]=3 642 B9R1.35 CC(=O)N1CC[C@H](I)C1 AM93701 [0,1,0,1,0,0|1,0,0]=3 643 B9R1.35 CC(=O)N1CC[C@H](I)C1 AM96019 [0,1,0,1,0,0|1,0,0]=3 644 B9R1.35 CC(=O)N1CC[C@H](I)C1 AM96646 [0,1,0,1,0,0|1,0,0]=3 645 B9R1.35 CC(=O)N1CC[C@H](N)C1 AM101330 [0,1,0,1,0,0|1,0,0]=3 646 B9R1.35 CC(=O)N1CC[C@H](N)C1 AM90401 [0,1,0,1,0,0|1,0,0]=3 647 B9R1.35 CC(=O)N1CC[C@H](N)C1 AM90424 [0,1,0,1,0,0|1,0,0]=3 648 B9R1.35 CC(=O)N1CC[C@H](O)C1 AM101587 [0,1,0,1,0,0|1,0,0]=3 649 B9R1.35 CC(=O)N1CC[C@H](O)C1 AMY20010 [0,1,0,1,0,0|1,0,0]=3 650 B9R1.35 CC(C)[C@@H]1COC(=O)N1 AM81454 [0,1,0,1,0,0|1,0,0]=3 651 B9R1.35 CC(C)[C@@H]1COC(=O)N1 AM81455 [0,1,0,1,0,0|1,0,0]=3 652 B9R1.35 NC1CCC(C(=O)O)C1 AMY20253 [0,1,0,1,0,0|2,0,0]=4 653 B9R1.35 NC1CCC(C(=O)O)C1 AMY34078 [0,1,0,1,0,0|2,0,0]=4 654 B9R1.35 N[C@@H]1CC[C@@H](C(=O)O)C1 AMY21334 [0,1,0,1,0,0|2,0,0]=4 655 B9R1.35 N[C@@H]1CC[C@@H](C(=O)O)C1 AMY35677 [0,1,0,1,0,0|2,0,0]=4 656 B9R1.35 N[C@@H]1CC[C@H](C(=O)O)C1 AMY21402 [0,1,0,1,0,0|2,0,0]=4 657 B9R1.35 N[C@@H]1CC[C@H](C(=O)O)C1 AMY21662 [0,1,0,1,0,0|2,0,0]=4 658 B9R1.35 N[C@H]1CC[C@@H](C(=O)O)C1 AMY21371 [0,1,0,1,0,0|2,0,0]=4 659 B9R1.35 N[C@H]1CC[C@@H](C(=O)O)C1 AMY21403 [0,1,0,1,0,0|2,0,0]=4 660 B9R1.35 N[C@H]1CC[C@H](C(=O)O)C1 AMY21335 [0,1,0,1,0,0|2,0,0]=4 661 B9R1.35 O=C1N[C@H](C(F)F)CO1 AMY16832 [0,1,0,1,0,0|2,0,0]=4 662 B9R1.69 CC1CC(=O)CCC1O AM806654 [0,1,0,1,0,0|1,0,0]=3 663 B9R1.110 CC(=O)N(C)C1CNC1 AMY34223 [0,1,0,1,0,0|2,0,0]=4 664 B9R1.163 NC(=O)C1(N)CCCC1 AM20090025 [0,1,0,1,0,0|2,0,0]=4 665 B9R1.163 NC1(C(=O)O)CCCC1 AM20100281 [0,1,0,1,0,0|2,0,0]=4 666 B9R1.163 O=C(O)C1(O)CCCC1 AMY40976 [0,1,0,1,0,0|2,0,0]=4 667 B9R1.114 CS(=O)(=O)OC1CNC1 AMY4431 [0,1,0,1,0,0|2,0,0]=4 668 B9R1.114 CS(=O)(=O)OC1COC1 AM90055 [0,1,0,1,0,0|2,0,0]=4 669 B9R2.39 O=C1CC2CCC1C2 AMY10402 [0,0,0,2,0,0|1,0,0]=3 670 B9R2.39 O=C1CN2CCC1C2 AM20080170 [0,0,0,2,0,0|2,0,0]=4 671 B9R2.39 O=C1CN2CCC1C2 AM20090192 [0,0,0,2,0,0|2,0,0]=4 672 B9R2.138 O=C1CC2(CCC2)C1 AMY34246 [0,0,0,2,0,0|1,0,0]=3 673 B9R2.138 O=C1CC2(CCC2)N1 AM100896 [0,0,0,2,0,0|1,0,0]=3 674 B9R2.138 O=C1CC2(COC2)C1 AMY9232 [0,0,0,2,0,0|2,0,0]=4 675 B9R2.138 O=C1CC2(CSC2)C1 AMY33628 [0,0,0,2,0,0|2,0,0]=4