0 B12R1.2629 C=CCC1(CCCCC1)OCC 34a_200011216858_100000210202 [0,0,0,0,0,0|1,0,2]=3 1 B12R1.2629 C=CCC1(CCCCC1)OCC 7a_200011216858_100000210202 [0,0,0,0,0,0|1,0,2]=3 2 B12R1.2629 C=CCC1(CCCCC1)OCF 34a_200011216858_100015361967 [0,0,0,0,0,0|2,0,2]=4 3 B12R1.2629 C=CCC1(CCCCC1)OCF 7a_200011216858_100015361967 [0,0,0,0,0,0|2,0,2]=4 4 B12R1.2629 CC#CC1(CCCCC1)OCC 34a_200011215096_100000210202 [0,0,0,0,0,0|1,0,1]=2 5 B12R1.2629 CC#CC1(CCCCC1)OCC 7a_200011215096_100000210202 [0,0,0,0,0,0|1,0,1]=2 6 B12R1.2629 CC#CC1(CCCCC1)OCF 34a_200011215096_100015361967 [0,0,0,0,0,0|2,0,1]=3 7 B12R1.2629 CC#CC1(CCCCC1)OCF 7a_200011215096_100015361967 [0,0,0,0,0,0|2,0,1]=3 8 B12R1.2629 CCCC1(CCCCC1)OCC 34a_200011215981_100000210202 [0,0,0,0,0,0|1,0,0]=1 9 B12R1.2629 CCCC1(CCCCC1)OCC 7a_200011215981_100000210202 [0,0,0,0,0,0|1,0,0]=1 10 B12R1.2629 CCCC1(CCCCC1)OCF 34a_200011215981_100015361967 [0,0,0,0,0,0|2,0,0]=2 11 B12R1.2629 CCCC1(CCCCC1)OCF 7a_200011215981_100015361967 [0,0,0,0,0,0|2,0,0]=2 12 B12R1.2629 CCOC1(CCCCC1)CCN 34a_100102740465_100000210202 [0,0,0,0,0,0|2,0,0]=2 13 B12R1.2629 NCCC1(CCCCC1)OCF 34a_100102740465_100015361967 [0,0,0,0,0,0|3,0,0]=3 14 B11R1.1253 C#CC1(CCCCC1)NCC 2230a_100132314160_100000210202 [1,0,0,0,0,0|1,0,2]=4 15 B11R1.1253 C#CC1(CCCCC1)NCC 34a_100132314160_100000210202 [1,0,0,0,0,0|1,0,2]=4 16 B11R1.1253 C#CC1(CCCCC1)OCC 34a_100011215672_100000210202 [1,0,0,0,0,0|0,0,2]=3 17 B11R1.1253 C#CC1(CCCCC1)OCC 7a_100011215672_100000210202 [1,0,0,0,0,0|0,0,2]=3 18 B11R1.1253 C#CC1(CCCCC1)OCF 34a_100011215672_100015361967 [1,0,0,0,0,0|1,0,2]=4 19 B11R1.1253 C#CC1(CCCCC1)OCF 7a_100011215672_100015361967 [1,0,0,0,0,0|1,0,2]=4 20 B11R1.1253 C#CC1(CCCNC1)OCC 34a_100025709964_100000210202 [1,0,0,0,0,0|1,0,2]=4 21 B11R1.1253 C#CC1(CCOCC1)OCC 34a_100012169490_100000210202 [1,0,0,0,0,0|1,0,2]=4 22 B11R1.1253 C#CC1(CCOCC1)OCC 7a_100012169490_100000210202 [1,0,0,0,0,0|1,0,2]=4 23 B11R1.1253 C=CC1(CCCCC1)OCC 34a_200011934219_100000210202 [1,0,0,0,0,0|0,0,2]=3 24 B11R1.1253 C=CC1(CCCCC1)OCC 7a_200011934219_100000210202 [1,0,0,0,0,0|0,0,2]=3 25 B11R1.1253 C=CC1(CCCCC1)OCF 34a_200011934219_100015361967 [1,0,0,0,0,0|1,0,2]=4 26 B11R1.1253 C=CC1(CCCCC1)OCF 7a_200011934219_100015361967 [1,0,0,0,0,0|1,0,2]=4 27 B11R1.1253 C=CCC1(CCCCC1)OC 34a_200011216858_200000210301 [1,0,0,0,0,0|1,0,2]=4 28 B11R1.1253 C=CCC1(CCCCC1)OC 7a_200011216858_200000210301 [1,0,0,0,0,0|1,0,2]=4 29 B11R1.1253 C=CCC1(CCCCC1)O[13CH3] 34a_200011216858_200025704644 [1,0,0,0,0,0|1,0,2]=4 30 B11R1.1253 C=CCC1(CCCCC1)O[13CH3] 7a_200011216858_200025704644 [1,0,0,0,0,0|1,0,2]=4 31 B11R1.1253 CC#CC1(CCCCC1)OC 34a_200011215096_200000210301 [1,0,0,0,0,0|1,0,1]=3 32 B11R1.1253 CC#CC1(CCCCC1)OC 7a_200011215096_200000210301 [1,0,0,0,0,0|1,0,1]=3 33 B11R1.1253 CC#CC1(CCCCC1)O[13CH3] 34a_200011215096_200025704644 [1,0,0,0,0,0|1,0,1]=3 34 B11R1.1253 CC#CC1(CCCCC1)O[13CH3] 7a_200011215096_200025704644 [1,0,0,0,0,0|1,0,1]=3 35 B11R1.1253 CCC1(CCCCC1)OCF 34a_100011216009_100015361967 [1,0,0,0,0,0|1,0,0]=2 36 B11R1.1253 CCC1(CCCCC1)OCF 7a_100011216009_100015361967 [1,0,0,0,0,0|1,0,0]=2 37 B11R1.1253 CCCC1(CCCCC1)OC 34a_200011215981_200000210301 [1,0,0,0,0,0|1,0,0]=2 38 B11R1.1253 CCCC1(CCCCC1)OC 7a_200011215981_200000210301 [1,0,0,0,0,0|1,0,0]=2 39 B11R1.1253 CCCC1(CCCCC1)O[13CH3] 34a_200011215981_200025704644 [1,0,0,0,0,0|1,0,0]=2 40 B11R1.1253 CCCC1(CCCCC1)O[13CH3] 7a_200011215981_200025704644 [1,0,0,0,0,0|1,0,0]=2 41 B11R1.1253 CCNC1(CCCCC1)C#N 34a_100000184641_100000210202 [1,0,0,0,0,0|2,0,1]=4 42 B11R1.1253 CCNC1(CCCCC1)CO 2230a_100000740034_100000210202 [1,0,0,0,0,0|2,0,0]=3 43 B11R1.1253 CCNC1(CCCCC1)CO 34a_100000740034_100000210202 [1,0,0,0,0,0|2,0,0]=3 44 B11R1.1253 CCNC1(CCOCC1)CO 2230a_100000751404_100000210202 [1,0,0,0,0,0|3,0,0]=4 45 B11R1.1253 CCNC1(CCOCC1)CO 34a_100000751404_100000210202 [1,0,0,0,0,0|3,0,0]=4 46 B11R1.1253 CCOC1(CCCCC1)CC 34a_100011216009_100000210202 [1,0,0,0,0,0|0,0,0]=1 47 B11R1.1253 CCOC1(CCCCC1)CC 7a_100011216009_100000210202 [1,0,0,0,0,0|0,0,0]=1 48 B11R1.1253 CCOC1(CCCCC1)CN 34a_100000748649_100000210202 [1,0,0,0,0,0|1,0,0]=2 49 B11R1.1253 CCOC1(CCOCC1)C#N 34a_100000751910_100000210202 [1,0,0,0,0,0|2,0,1]=4 50 B11R1.1253 CCOC1(CCOCC1)C#N 7a_100000751910_100000210202 [1,0,0,0,0,0|2,0,1]=4 51 B11R1.1253 CCOC1(CCOCC1)CN 34a_100000704115_100000210202 [1,0,0,0,0,0|2,0,0]=3 52 B11R1.1253 CCOC1(CCSCC1)CN 34a_100000758141_100000210202 [1,0,0,0,0,0|2,0,0]=3 53 B11R1.1253 COC1(CCCCC1)CCN 34a_100102740465_200000210301 [1,0,0,0,0,0|2,0,0]=3 54 B11R1.1253 NCC1(CCCCC1)OCF 34a_100000748649_100015361967 [1,0,0,0,0,0|2,0,0]=3 55 B11R1.1253 NCC1(CCOCC1)OCF 34a_100000704115_100015361967 [1,0,0,0,0,0|3,0,0]=4 56 B11R1.1253 NCC1(CCSCC1)OCF 34a_100000758141_100015361967 [1,0,0,0,0,0|3,0,0]=4 57 B11R1.1253 OCC1(CCCCC1)NCF 34a_100000740034_100015361967 [1,0,0,0,0,0|3,0,0]=4 58 B11R1.1253 [13CH3]OC1(CCCCC1)CCN 34a_100102740465_200025704644 [1,0,0,0,0,0|2,0,0]=3 59 B13R1.6426 C#CCOC1(CCCCC1)C#CC 34a_200011215096_100000184674 [0,1,0,0,0,0|1,0,2]=4 60 B13R1.6426 C#CCOC1(CCCCC1)C#CC 7a_200011215096_100000038162 [0,1,0,0,0,0|1,0,2]=4 61 B13R1.6426 C#CCOC1(CCCCC1)CCC 34a_200011215981_100000184674 [0,1,0,0,0,0|1,0,1]=3 62 B13R1.6426 C#CCOC1(CCCCC1)CCC 7a_200011215981_100000038162 [0,1,0,0,0,0|1,0,1]=3 63 B13R1.6426 C#CCOC1(CCCCC1)CCN 34a_100102740465_100000184674 [0,1,0,0,0,0|2,0,1]=4 64 B13R1.6426 C=CCC1(CCCCC1)OCCC 34a_200011216858_100000210303 [0,1,0,0,0,0|1,0,2]=4 65 B13R1.6426 C=CCC1(CCCCC1)OCCC 7a_200011216858_100000210303 [0,1,0,0,0,0|1,0,2]=4 66 B13R1.6426 C=CCC1(CCCCC1)OCCF 34a_200011216858_100011217306 [0,1,0,0,0,0|1,0,2]=4 67 B13R1.6426 C=CCC1(CCCCC1)OCCF 7a_200011216858_100011217306 [0,1,0,0,0,0|1,0,2]=4 68 B13R1.6426 C=CCC1(CCCCC1)OCCO 34a_200011216858_100000211926 [0,1,0,0,0,0|1,0,2]=4 69 B13R1.6426 C=CCC1(CCCCC1)OCCO 7a_200011216858_100000211926 [0,1,0,0,0,0|1,0,2]=4 70 B13R1.6426 C=CCC1(CCCCC1)OCSC 34a_200011216858_100011218213 [0,1,0,0,0,0|1,0,2]=4 71 B13R1.6426 C=CCOC1(CCCCC1)C#CC 34a_200011215096_100015514636 [0,1,0,0,0,0|1,0,2]=4 72 B13R1.6426 C=CCOC1(CCCCC1)C#CC 7a_200011215096_100015514636 [0,1,0,0,0,0|1,0,2]=4 73 B13R1.6426 C=CCOC1(CCCCC1)CCC 34a_200011215981_100015514636 [0,1,0,0,0,0|1,0,1]=3 74 B13R1.6426 C=CCOC1(CCCCC1)CCC 7a_200011215981_100015514636 [0,1,0,0,0,0|1,0,1]=3 75 B13R1.6426 C=CCOC1(CCCCC1)CCN 34a_100102740465_100015514636 [0,1,0,0,0,0|2,0,1]=4 76 B13R1.6426 CC#CC1(CCCCC1)OCC#N 7a_200011215096_100011215382 [0,1,0,0,0,0|1,0,2]=4 77 B13R1.6426 CC#CC1(CCCCC1)OCC=O 34a_200011215096_200009817547 [0,1,0,0,0,0|1,0,2]=4 78 B13R1.6426 CC#CC1(CCCCC1)OCC=O 7a_200011215096_200015260668 [0,1,0,0,0,0|1,0,2]=4 79 B13R1.6426 CC#CC1(CCCCC1)OCCC 34a_200011215096_100000210303 [0,1,0,0,0,0|1,0,1]=3 80 B13R1.6426 CC#CC1(CCCCC1)OCCC 7a_200011215096_100000210303 [0,1,0,0,0,0|1,0,1]=3 81 B13R1.6426 CC#CC1(CCCCC1)OCCF 34a_200011215096_100011217306 [0,1,0,0,0,0|1,0,1]=3 82 B13R1.6426 CC#CC1(CCCCC1)OCCF 7a_200011215096_100011217306 [0,1,0,0,0,0|1,0,1]=3 83 B13R1.6426 CC#CC1(CCCCC1)OCCO 34a_200011215096_100000211926 [0,1,0,0,0,0|1,0,1]=3 84 B13R1.6426 CC#CC1(CCCCC1)OCCO 7a_200011215096_100000211926 [0,1,0,0,0,0|1,0,1]=3 85 B13R1.6426 CC#CC1(CCCCC1)OCSC 34a_200011215096_100011218213 [0,1,0,0,0,0|1,0,1]=3 86 B13R1.6426 CCCC1(CCCCC1)OCC#N 7a_200011215981_100011215382 [0,1,0,0,0,0|1,0,1]=3 87 B13R1.6426 CCCC1(CCCCC1)OCC=O 34a_200011215981_200009817547 [0,1,0,0,0,0|1,0,1]=3 88 B13R1.6426 CCCC1(CCCCC1)OCC=O 7a_200011215981_200015260668 [0,1,0,0,0,0|1,0,1]=3 89 B13R1.6426 CCCC1(CCCCC1)OCCF 34a_200011215981_100011217306 [0,1,0,0,0,0|1,0,0]=2 90 B13R1.6426 CCCC1(CCCCC1)OCCF 7a_200011215981_100011217306 [0,1,0,0,0,0|1,0,0]=2 91 B13R1.6426 CCCC1(CCCCC1)OCCO 34a_200011215981_100000211926 [0,1,0,0,0,0|1,0,0]=2 92 B13R1.6426 CCCC1(CCCCC1)OCCO 7a_200011215981_100000211926 [0,1,0,0,0,0|1,0,0]=2 93 B13R1.6426 CCCC1(CCCCC1)OCSC 34a_200011215981_100011218213 [0,1,0,0,0,0|1,0,0]=2 94 B13R1.6426 CCCCC1(CCCCC1)OCC 34a_200011218111_100000210202 [0,1,0,0,0,0|1,0,0]=2 95 B13R1.6426 CCCCC1(CCCCC1)OCC 7a_200011218111_100000210202 [0,1,0,0,0,0|1,0,0]=2 96 B13R1.6426 CCCCC1(CCCCC1)OCF 34a_200011218111_100015361967 [0,1,0,0,0,0|2,0,0]=3 97 B13R1.6426 CCCCC1(CCCCC1)OCF 7a_200011218111_100015361967 [0,1,0,0,0,0|2,0,0]=3 98 B13R1.6426 CCCOC1(CCCCC1)CCC 34a_200011215981_100000210303 [0,1,0,0,0,0|1,0,0]=2 99 B13R1.6426 CCCOC1(CCCCC1)CCC 7a_200011215981_100000210303 [0,1,0,0,0,0|1,0,0]=2 100 B13R1.6426 CCCOC1(CCCCC1)CCN 34a_100102740465_100000210303 [0,1,0,0,0,0|2,0,0]=3 101 B13R1.6426 CSCOC1(CCCCC1)CCN 34a_100102740465_100011218213 [0,1,0,0,0,0|2,0,0]=3 102 B13R1.6426 NCCC1(CCCCC1)OCC=O 34a_100102740465_200009817547 [0,1,0,0,0,0|2,0,1]=4 103 B13R1.6426 NCCC1(CCCCC1)OCCF 34a_100102740465_100011217306 [0,1,0,0,0,0|2,0,0]=3 104 B13R1.6426 NCCC1(CCCCC1)OCCO 34a_100102740465_100000211926 [0,1,0,0,0,0|2,0,0]=3 105 B13R1.7332 CCNC1(CCCCC1)C(=O)NC 2230a_100000741645_100000210202 [0,1,0,0,0,0|3,0,0]=4 106 B13R1.7332 CCNC1(CCCCC1)C(=O)NC 34a_100000741645_100000210202 [0,1,0,0,0,0|3,0,0]=4 107 B13R1.7332 CCOC1(CCCCC1)C(=O)OC 34a_100011242881_100000210202 [0,1,0,0,0,0|2,0,0]=3 108 B13R1.7332 CCOC1(CCCCC1)C(=O)OC 34a_100121572206_100000700894 [0,1,0,0,0,0|2,0,0]=3 109 B13R1.7332 CCOC1(CCCCC1)C(=O)OC 7a_100011242881_100000210202 [0,1,0,0,0,0|2,0,0]=3 110 B13R1.7332 CCOC1(CCNCC1)C(=O)OC 34a_100000696052_100000210202 [0,1,0,0,0,0|3,0,0]=4 111 B13R1.7332 CCOC1(CCOCC1)C(=O)OC 34a_100000688401_100000210202 [0,1,0,0,0,0|3,0,0]=4 112 B13R1.7332 CCOC1(CCOCC1)C(=O)OC 7a_100000688401_100000210202 [0,1,0,0,0,0|3,0,0]=4 113 B13R1.7332 CCSC1(CCCCC1)C(=O)OC 62a_100000210202_100000700894 [0,1,0,0,0,0|2,1,0]=4 114 B13R1.7332 CCSC1(CCCCC1)C(=O)OC 62a_100000700894_100000210202 [0,1,0,0,0,0|2,1,0]=4 115 B13R1.7332 COC(=O)C1(CCCCC1)OCF 34a_100011242881_100015361967 [0,1,0,0,0,0|3,0,0]=4 116 B13R1.7332 COC(=O)C1(CCCCC1)OCF 7a_100011242881_100015361967 [0,1,0,0,0,0|3,0,0]=4 117 B13R1.7334 C=CCC1(CCCCC1)OC(C)C 34a_200011216858_100000210206 [0,1,0,0,0,0|1,0,2]=4 118 B13R1.7334 C=CCC1(CCCCC1)OC(C)C 7a_200011216858_100000210206 [0,1,0,0,0,0|1,0,2]=4 119 B13R1.7334 CC#CC1(CCCCC1)OC(C)C 34a_200011215096_100000210206 [0,1,0,0,0,0|1,0,1]=3 120 B13R1.7334 CC#CC1(CCCCC1)OC(C)C 7a_200011215096_100000210206 [0,1,0,0,0,0|1,0,1]=3 121 B13R1.7334 CC(C)CC1(CCCCC1)CO[13CH3] 34a_100012399753_200025704644 [0,1,0,0,0,0|3,0,0]=4 122 B13R1.7334 CC(C)CC1(CCCCC1)CO[13CH3] 7a_100012399753_200025704644 [0,1,0,0,0,0|3,0,0]=4 123 B13R1.7334 CC(C)OC1(CCCCC1)CCN 34a_100102740465_100000210206 [0,1,0,0,0,0|2,0,0]=3 124 B13R1.7334 CCCC1(CCCCC1)OC(C)C 34a_200011215981_100000210206 [0,1,0,0,0,0|1,0,0]=2 125 B13R1.7334 CCCC1(CCCCC1)OC(C)C 7a_200011215981_100000210206 [0,1,0,0,0,0|1,0,0]=2 126 B13R1.7334 COCC1(CCCCC1)CC(C)C 34a_100012399753_200000210301 [0,1,0,0,0,0|3,0,0]=4 127 B13R1.7334 COCC1(CCCCC1)CC(C)C 7a_100012399753_200000210301 [0,1,0,0,0,0|3,0,0]=4 128 B11R0.80 C#CCNCC(OCC)OCC 34a_100000211098_100000184674 [0,0,1,0,0,0|1,0,2]=4 129 B11R0.80 C#CCNCC(OCC)OCC 34a_100000212058_100000210512 [0,0,1,0,0,0|1,0,2]=4 130 B11R0.80 C#CCOCC(OCC)OCC 34a_100000210247_100000210512 [0,0,1,0,0,0|1,0,2]=4 131 B11R0.80 C#CCOCC(OCC)OCC 34a_100011216334_100000184674 [0,0,1,0,0,0|1,0,2]=4 132 B11R0.80 C#CCOCC(OCC)OCC 7a_100011216334_100000038162 [0,0,1,0,0,0|1,0,2]=4 133 B11R0.80 C#CCSCC(OCC)OCC 62a_100000038162_100000210512 [0,0,1,0,0,0|1,0,2]=4 134 B11R0.80 C=CCC(CCCCC)OCC 34a_200011216309_100000210202 [0,0,1,0,0,0|1,0,2]=4 135 B11R0.80 C=CCC(CCCCC)OCC 7a_200011216309_100000210202 [0,0,1,0,0,0|1,0,2]=4 136 B11R0.80 C=CCNCC(OCC)OCC 2230a_100020586998_100000210512 [0,0,1,0,0,0|1,0,2]=4 137 B11R0.80 C=CCNCC(OCC)OCC 34a_100000211098_100015514636 [0,0,1,0,0,0|1,0,2]=4 138 B11R0.80 C=CCOCC(OCC)OCC 34a_100011216334_100015514636 [0,0,1,0,0,0|1,0,2]=4 139 B11R0.80 C=CCOCC(OCC)OCC 34a_200000210373_100000210512 [0,0,1,0,0,0|1,0,2]=4 140 B11R0.80 C=CCOCC(OCC)OCC 7a_100011216334_100015514636 [0,0,1,0,0,0|1,0,2]=4 141 B11R0.80 C=CCSCC(OCC)OCC 62a_100000210512_100000210623 [0,0,1,0,0,0|1,0,2]=4 142 B11R0.80 C=CCSCC(OCC)OCC 62a_100000210623_100000210512 [0,0,1,0,0,0|1,0,2]=4 143 B11R0.80 CCCCCC(CCC)COC 34a_100011290854_200000210301 [0,0,1,0,0,0|3,0,0]=4 144 B11R0.80 CCCCCC(CCC)COC 7a_100011290854_200000210301 [0,0,1,0,0,0|3,0,0]=4 145 B11R0.80 CCCCCC(CCC)CO[13CH3] 34a_100011290854_200025704644 [0,0,1,0,0,0|3,0,0]=4 146 B11R0.80 CCCCCC(CCC)CO[13CH3] 7a_100011290854_200025704644 [0,0,1,0,0,0|3,0,0]=4 147 B11R0.80 CCCCCC(CCC)NCC 270004a_100015525214_200011216343 [0,0,1,0,0,0|2,0,0]=3 148 B11R0.80 CCCCCC(CCC)OCC 34a_200011215058_100000210202 [0,0,1,0,0,0|1,0,0]=2 149 B11R0.80 CCCCCC(CCC)OCC 7a_200011215058_100000210202 [0,0,1,0,0,0|1,0,0]=2 150 B11R0.80 CCCCCC(CCC)OCF 34a_200011215058_100015361967 [0,0,1,0,0,0|2,0,0]=3 151 B11R0.80 CCCCCC(CCC)OCF 7a_200011215058_100015361967 [0,0,1,0,0,0|2,0,0]=3 152 B11R0.80 CCCCCN(CCC)CCC 2230a_100000210455_100000210326 [0,0,1,0,0,0|3,0,0]=4 153 B11R0.80 CCCCCN(CCC)CCC 2230a_200000226819_100000210303 [0,0,1,0,0,0|3,0,0]=4 154 B11R0.80 CCCCCN(CCC)CCC 269982a_100000210455_100000210215 [0,0,1,0,0,0|3,0,0]=4 155 B11R0.80 CCCCCN(CCC)CCC 269982a_200000226819_100000210303 [0,0,1,0,0,0|3,0,0]=4 156 B11R0.80 CCCCNC(CCC)CCC 2230a_100011207992_100000210211 [0,0,1,0,0,0|3,0,0]=4 157 B11R0.80 CCCCNC(CCC)CCC 270004a_100000102301_100000210088 [0,0,1,0,0,0|3,0,0]=4 158 B11R0.80 CCCCNC(CCC)CCC 34a_100011207992_100000210210 [0,0,1,0,0,0|3,0,0]=4 159 B11R0.80 CCCCNC(CCC)CCC 7a_106832991798_200011218217 [0,0,1,0,0,0|3,0,0]=4 160 B11R0.80 CCCCOC(CCC)CCC 34a_100000210227_200011218217 [0,0,1,0,0,0|3,0,0]=4 161 B11R0.80 CCCCOC(CCC)CCC 34a_200011218534_100000210210 [0,0,1,0,0,0|3,0,0]=4 162 B11R0.80 CCCCOC(CCC)CCC 7a_100000210227_200011218217 [0,0,1,0,0,0|3,0,0]=4 163 B11R0.80 CCCCOC(CCC)CCC 7a_200011218534_100000210211 [0,0,1,0,0,0|3,0,0]=4 164 B11R0.80 CCCCSC(CCC)CCC 62a_100000210211_200011218217 [0,0,1,0,0,0|3,0,0]=4 165 B11R0.80 CCCCSC(CCC)CCC 62a_200011218217_100000210210 [0,0,1,0,0,0|3,0,0]=4 166 B11R0.80 CCCNCC(OCC)OCC 34a_100000211098_100000210303 [0,0,1,0,0,0|1,0,0]=2 167 B11R0.80 CCCOCC(CCC)CCC 34a_200011215456_100000210303 [0,0,1,0,0,0|3,0,0]=4 168 B11R0.80 CCCOCC(CCC)CCC 7a_200011215456_100000210303 [0,0,1,0,0,0|3,0,0]=4 169 B11R0.80 CCCOCC(OCC)OCC 34a_100000210258_100000210512 [0,0,1,0,0,0|1,0,0]=2 170 B11R0.80 CCCOCC(OCC)OCC 34a_100011216334_100000210303 [0,0,1,0,0,0|1,0,0]=2 171 B11R0.80 CCCOCC(OCC)OCC 7a_100011216334_100000210303 [0,0,1,0,0,0|1,0,0]=2 172 B11R0.80 CCCSCC(OCC)OCC 62a_100000210303_100000210512 [0,0,1,0,0,0|1,0,0]=2 173 B11R0.80 CCCSCC(OCC)OCC 62a_100000210512_100000210303 [0,0,1,0,0,0|1,0,0]=2 174 B11R0.80 CCNCCC(OCC)OCC 2230a_100015525214_100000033671 [0,0,1,0,0,0|1,0,0]=2 175 B11R0.80 CCNCCC(OCC)OCC 34a_100000748396_100000210202 [0,0,1,0,0,0|1,0,0]=2 176 B11R0.80 CCOC(CCCNC)OCC 2230a_106832991635_100000034166 [0,0,1,0,0,0|1,0,0]=2 177 B11R0.80 CCOC(CCCNC)OCC 34a_100000211155_200000210301 [0,0,1,0,0,0|1,0,0]=2 178 B11R0.80 CCOC(CCCNC)OCC 34a_100102657272_100000034166 [0,0,1,0,0,0|1,0,0]=2 179 B11R0.80 CCOC(CCCNC)OCC 7a_106832991635_100000034166 [0,0,1,0,0,0|1,0,0]=2 180 B11R0.80 CCOC(CCCN[13CH3])OCC 34a_100000211155_200025704644 [0,0,1,0,0,0|1,0,0]=2 181 B11R0.80 CCOC(CCCOC)OCC 34a_100138415774_100000034166 [0,0,1,0,0,0|1,0,0]=2 182 B11R0.80 CCOC(CCCSC)OCC 62a_100000034166_200000210301 [0,0,1,0,0,0|1,0,0]=2 183 B11R0.80 CCOC(CCCSC)OCC 62a_200000210301_100000034166 [0,0,1,0,0,0|1,0,0]=2 184 B11R0.80 CCOC(CCCS[13CH3])OCC 62a_100000034166_200025704644 [0,0,1,0,0,0|1,0,0]=2 185 B11R0.80 CCOC(CCCS[13CH3])OCC 62a_200025704644_100000034166 [0,0,1,0,0,0|1,0,0]=2 186 B11R0.80 CCOC(CCNCF)OCC 34a_100000748396_100015361967 [0,0,1,0,0,0|2,0,0]=3 187 B11R0.80 CCOC(CCOCF)OCC 34a_100011218310_100015361967 [0,0,1,0,0,0|2,0,0]=3 188 B11R0.80 CCOC(CCOCF)OCC 7a_100011218310_100015361967 [0,0,1,0,0,0|2,0,0]=3 189 B11R0.80 CCOC(CCSCC)OCC 62a_100000033671_100000210202 [0,0,1,0,0,0|1,0,0]=2 190 B11R0.80 CCOC(CCSCC)OCC 62a_100000210202_100000033671 [0,0,1,0,0,0|1,0,0]=2 191 B11R0.80 CCOC(CCSCF)OCC 62a_100000033671_100015361967 [0,0,1,0,0,0|2,0,0]=3 192 B11R0.80 CCOC(CCSCF)OCC 62a_100015361967_100000033671 [0,0,1,0,0,0|2,0,0]=3 193 B11R0.80 CCOC(CNCC=O)OCC 34a_100000211098_200009817547 [0,0,1,0,0,0|2,0,1]=4 194 B11R0.80 CCOC(CNCCF)OCC 34a_100000211098_100011217306 [0,0,1,0,0,0|2,0,0]=3 195 B11R0.80 CCOC(CNCCF)OCC 34a_100000724931_100000210512 [0,0,1,0,0,0|2,0,0]=3 196 B11R0.80 CCOC(CNCCO)OCC 2230a_100016997473_100000210512 [0,0,1,0,0,0|2,0,0]=3 197 B11R0.80 CCOC(CNCCO)OCC 34a_100000211098_100000211926 [0,0,1,0,0,0|2,0,0]=3 198 B11R0.80 CCOC(CNCCO)OCC 34a_100016990907_100000210512 [0,0,1,0,0,0|2,0,0]=3 199 B11R0.80 CCOC(CNCSC)OCC 34a_100000211098_100011218213 [0,0,1,0,0,0|2,0,0]=3 200 B11R0.80 CCOC(COCC#N)OCC 7a_100011216334_100011215382 [0,0,1,0,0,0|2,0,1]=4 201 B11R0.80 CCOC(COCC=O)OCC 34a_100011216334_200009817547 [0,0,1,0,0,0|2,0,1]=4 202 B11R0.80 CCOC(COCC=O)OCC 7a_100011216334_200015260668 [0,0,1,0,0,0|2,0,1]=4 203 B11R0.80 CCOC(COCCBr)OCC 34a_100000211926_100000210512 [0,0,1,0,0,0|2,0,0]=3 204 B11R0.80 CCOC(COCCF)OCC 34a_100011216334_100011217306 [0,0,1,0,0,0|2,0,0]=3 205 B11R0.80 CCOC(COCCF)OCC 7a_100011216334_100011217306 [0,0,1,0,0,0|2,0,0]=3 206 B11R0.80 CCOC(COCCN)OCC 34a_100000210304_100000210512 [0,0,1,0,0,0|2,0,0]=3 207 B11R0.80 CCOC(COCCO)OCC 34a_100011216334_100000211926 [0,0,1,0,0,0|2,0,0]=3 208 B11R0.80 CCOC(COCCO)OCC 7a_100011216334_100000211926 [0,0,1,0,0,0|2,0,0]=3 209 B11R0.80 CCOC(COCSC)OCC 34a_100011216334_100011218213 [0,0,1,0,0,0|2,0,0]=3 210 B11R0.80 CCOC(CSCC#N)OCC 62a_100000210512_100011215382 [0,0,1,0,0,0|2,0,1]=4 211 B11R0.80 CCOC(CSCC#N)OCC 62a_100011215382_100000210512 [0,0,1,0,0,0|2,0,1]=4 212 B11R0.80 CCOC(CSCC=O)OCC 62a_100000210512_200015260668 [0,0,1,0,0,0|2,0,1]=4 213 B11R0.80 CCOC(CSCC=O)OCC 62a_200015260668_100000210512 [0,0,1,0,0,0|2,0,1]=4 214 B11R0.80 CCOC(CSCCF)OCC 62a_100000210512_100011217306 [0,0,1,0,0,0|2,0,0]=3 215 B11R0.80 CCOC(CSCCF)OCC 62a_100011217306_100000210512 [0,0,1,0,0,0|2,0,0]=3 216 B11R0.80 CCOC(CSCCO)OCC 62a_100000210512_100000211926 [0,0,1,0,0,0|2,0,0]=3 217 B11R0.80 CCOC(CSCCO)OCC 62a_100000211926_100000210512 [0,0,1,0,0,0|2,0,0]=3 218 B11R0.80 CCOC(CSCOC)OCC 62a_100000210512_100000766300 [0,0,1,0,0,0|2,0,0]=3 219 B11R0.80 CCOC(CSCOC)OCC 62a_100000766300_100000210512 [0,0,1,0,0,0|2,0,0]=3 220 B11R0.80 CCOC(CSCSC)OCC 62a_100000210512_100011218213 [0,0,1,0,0,0|2,0,0]=3 221 B11R0.80 CCOC(CSCSC)OCC 62a_100011218213_100000210512 [0,0,1,0,0,0|2,0,0]=3 222 B11R0.80 CCOCCC(OCC)OCC 34a_100011218310_100000210202 [0,0,1,0,0,0|1,0,0]=2 223 B11R0.80 CCOCCC(OCC)OCC 34a_100121572206_100000033671 [0,0,1,0,0,0|1,0,0]=2 224 B11R0.80 CCOCCC(OCC)OCC 7a_100011218310_100000210202 [0,0,1,0,0,0|1,0,0]=2 225 B11R0.221 C#CCC(C)(CCCC)OCC 7a_100000079463_100000210202 [0,0,1,0,0,0|1,0,2]=4 226 B11R0.221 CCCOC(C)(CCC)CCC 7a_200011219694_100000210303 [0,0,1,0,0,0|3,0,0]=4 227 B11R0.221 CCNCP(=O)(OCC)OCC 2230a_100015525214_100010393119 [0,0,1,0,0,0|3,0,0]=4 228 B11R0.221 CCOCP(=O)(OCC)OCC 34a_100000033165_100000210202 [0,0,1,0,0,0|3,0,0]=4 229 B11R0.221 CCOCP(=O)(OCC)OCC 34a_100121572206_100010393119 [0,0,1,0,0,0|3,0,0]=4 230 B11R0.221 CCOC[Si](C)(OCC)OCC 34a_100121572206_100000061259 [0,0,1,0,0,0|1,1,0]=3 231 B11R0.221 CCOP(=O)(CCNC)OCC 2230a_106832991635_100000766911 [0,0,1,0,0,0|3,0,0]=4 232 B11R0.221 CCOP(=O)(CCNC)OCC 34a_100102657272_100000766911 [0,0,1,0,0,0|3,0,0]=4 233 B11R0.221 CCOP(=O)(CCOC)OCC 34a_100138415774_100000766911 [0,0,1,0,0,0|3,0,0]=4 234 B11R0.221 CCOP(=O)(CCSC)OCC 62a_100000766911_200000210301 [0,0,1,0,0,0|3,0,0]=4 235 B11R0.221 CCOP(=O)(CCSC)OCC 62a_200000210301_100000766911 [0,0,1,0,0,0|3,0,0]=4 236 B11R0.221 CCOP(=O)(CCS[13CH3])OCC 62a_100000766911_200025704644 [0,0,1,0,0,0|3,0,0]=4 237 B11R0.221 CCOP(=O)(CCS[13CH3])OCC 62a_200025704644_100000766911 [0,0,1,0,0,0|3,0,0]=4 238 B11R0.221 CCOP(=O)(CSCC)OCC 62a_100000210202_100010393119 [0,0,1,0,0,0|3,0,0]=4 239 B11R0.221 CCOP(=O)(CSCC)OCC 62a_100010393119_100000210202 [0,0,1,0,0,0|3,0,0]=4 240 B11R0.221 CCO[Si](C)(CSCC)OCC 62a_100000061259_100000210202 [0,0,1,0,0,0|1,1,0]=3 241 B11R0.221 CCO[Si](C)(CSCC)OCC 62a_100000210202_100000061259 [0,0,1,0,0,0|1,1,0]=3 242 B11R0.221 CCO[Si](C)(CSCF)OCC 62a_100000061259_100015361967 [0,0,1,0,0,0|2,1,0]=4 243 B11R0.221 CCO[Si](C)(CSCF)OCC 62a_100015361967_100000061259 [0,0,1,0,0,0|2,1,0]=4 244 B13R2.6 CCN1CCOC12CCCCC2 269982a_200015422347_100000204670 [0,0,0,1,0,0|1,0,0]=2 245 B13R2.6 CCN1CCOC12CCCCC2 34a_200015422347_100000210202 [0,0,0,1,0,0|1,0,0]=2 246 B13R2.6 FCN1CCOC12CCCCC2 269982a_200015422347_100015361967 [0,0,0,1,0,0|2,0,0]=3 247 B13R2.6 FCN1CCOC12CCCCC2 34a_200015422347_100015361967 [0,0,0,1,0,0|2,0,0]=3 248 B11R1.1242 CCCC1(CCCC1)OCC 34a_200011216196_100000210202 [0,0,0,0,1,0|1,0,0]=2 249 B11R1.1242 CCCC1(CCCC1)OCC 7a_200011216196_100000210202 [0,0,0,0,1,0|1,0,0]=2 250 B11R1.1242 CCCC1(CCCC1)OCF 34a_200011216196_100015361967 [0,0,0,0,1,0|2,0,0]=3 251 B11R1.1242 CCCC1(CCCC1)OCF 7a_200011216196_100015361967 [0,0,0,0,1,0|2,0,0]=3 252 B11R1.1242 CCNC1(CCCC1)COC 2230a_100000757996_100000210202 [0,0,0,0,1,0|3,0,0]=4 253 B11R1.1242 CCOC1(CCCC1)CCN 34a_100000719956_100000210202 [0,0,0,0,1,0|2,0,0]=3 254 B11R1.1242 NCCC1(CCCC1)OCF 34a_100000719956_100015361967 [0,0,0,0,1,0|3,0,0]=4 255 B10R0.24 C#CC(CCCCC)OCC 34a_100011216489_100000210202 [1,0,1,0,0,0|0,0,2]=4 256 B10R0.24 C#CC(CCCCC)OCC 7a_100011216489_100000210202 [1,0,1,0,0,0|0,0,2]=4 257 B10R0.24 C=CC(CCCCC)OCC 34a_100011216863_100000210202 [1,0,1,0,0,0|0,0,2]=4 258 B10R0.24 C=CC(CCCCC)OCC 7a_100011216863_100000210202 [1,0,1,0,0,0|0,0,2]=4 259 B10R0.24 CCCCCC(CC)NCC 270004a_100015525214_100011215316 [1,0,1,0,0,0|1,0,0]=3 260 B10R0.24 CCCCCC(CC)OCC 34a_100011215405_100000210202 [1,0,1,0,0,0|0,0,0]=2 261 B10R0.24 CCCCCC(CC)OCC 7a_100011215405_100000210202 [1,0,1,0,0,0|0,0,0]=2 262 B10R0.24 CCCCCC(CC)OCF 34a_100011215405_100015361967 [1,0,1,0,0,0|1,0,0]=3 263 B10R0.24 CCCCCC(CC)OCF 7a_100011215405_100015361967 [1,0,1,0,0,0|1,0,0]=3 264 B10R0.24 CCCCCC(CCC)NC 270004a_106832991635_200011216343 [1,0,1,0,0,0|2,0,0]=4 265 B10R0.24 CCCCCC(CCC)OC 34a_200011215058_200000210301 [1,0,1,0,0,0|1,0,0]=3 266 B10R0.24 CCCCCC(CCC)OC 7a_200011215058_200000210301 [1,0,1,0,0,0|1,0,0]=3 267 B10R0.24 CCCCCC(CCC)O[13CH3] 34a_200011215058_200025704644 [1,0,1,0,0,0|1,0,0]=3 268 B10R0.24 CCCCCC(CCC)O[13CH3] 7a_200011215058_200025704644 [1,0,1,0,0,0|1,0,0]=3 269 B10R0.24 CCCCCN(CC)CCC 2230a_100000226822_100000210326 [1,0,1,0,0,0|2,0,0]=4 270 B10R0.24 CCCCCN(CC)CCC 2230a_200000226819_100000210202 [1,0,1,0,0,0|2,0,0]=4 271 B10R0.24 CCCCCN(CC)CCC 269982a_100000226822_100000210215 [1,0,1,0,0,0|2,0,0]=4 272 B10R0.24 CCCCCN(CC)CCC 269982a_200000226819_100000204670 [1,0,1,0,0,0|2,0,0]=4 273 B10R0.24 CCCCNC(CC)CCC 2230a_100000747048_100000210211 [1,0,1,0,0,0|2,0,0]=4 274 B10R0.24 CCCCNC(CC)CCC 270004a_100000102301_100000687865 [1,0,1,0,0,0|2,0,0]=4 275 B10R0.24 CCCCNC(CC)CCC 7a_106832991798_100011219200 [1,0,1,0,0,0|2,0,0]=4 276 B10R0.24 CCCCOC(CC)CCC 34a_100000687864_100000210210 [1,0,1,0,0,0|2,0,0]=4 277 B10R0.24 CCCCOC(CC)CCC 7a_100000210227_100011219200 [1,0,1,0,0,0|2,0,0]=4 278 B10R0.24 CCCCOC(CC)CCC 7a_100000687864_100000210211 [1,0,1,0,0,0|2,0,0]=4 279 B10R0.24 CCCCSC(CC)CCC 62a_100000210211_100011219200 [1,0,1,0,0,0|2,0,0]=4 280 B10R0.24 CCCCSC(CC)CCC 62a_100011219200_100000210210 [1,0,1,0,0,0|2,0,0]=4 281 B10R0.24 CCCNCC(CC)OCC 2230a_100015183923_100000210303 [1,0,1,0,0,0|1,0,0]=3 282 B10R0.24 CCCNCC(CC)OCC 34a_100015183923_100000210303 [1,0,1,0,0,0|1,0,0]=3 283 B10R0.24 CCOC(CC)CNCCF 2230a_100015183923_100011217306 [1,0,1,0,0,0|2,0,0]=4 284 B10R0.24 CCOC(CC)CNCCF 34a_100015183923_100011217306 [1,0,1,0,0,0|2,0,0]=4 285 B10R0.24 CCOC(CC)CNCCO 2230a_100015183923_100000211926 [1,0,1,0,0,0|2,0,0]=4 286 B10R0.24 CCOC(CC)CNCCO 34a_100015183923_100000211926 [1,0,1,0,0,0|2,0,0]=4 287 B10R0.24 CCOC(CC)CNCOC 2230a_100015183923_100000766300 [1,0,1,0,0,0|2,0,0]=4 288 B10R0.24 CCOC(CC)CNCSC 2230a_100015183923_100011218213 [1,0,1,0,0,0|2,0,0]=4 289 B10R0.24 CCOC(CC)CNCSC 34a_100015183923_100011218213 [1,0,1,0,0,0|2,0,0]=4 290 B10R0.90 CCCCC(CCC)OCC 34a_100011215800_100000210202 [1,0,1,0,0,0|1,0,0]=3 291 B10R0.90 CCCCC(CCC)OCC 34a_100121572206_100000211913 [1,0,1,0,0,0|1,0,0]=3 292 B10R0.90 CCCCC(CCC)OCC 7a_100011215800_100000210202 [1,0,1,0,0,0|1,0,0]=3 293 B10R0.90 CCCCC(CCC)OCF 34a_100011215800_100015361967 [1,0,1,0,0,0|2,0,0]=4 294 B10R0.90 CCCCC(CCC)OCF 7a_100011215800_100015361967 [1,0,1,0,0,0|2,0,0]=4 295 B10R0.90 CCCCC(CCC)SCC 62a_100000210202_100000211913 [1,0,1,0,0,0|1,1,0]=4 296 B10R0.90 CCCCC(CCC)SCC 62a_100000211913_100000210202 [1,0,1,0,0,0|1,1,0]=4 297 B10R0.90 CCNCC(OCC)OCC 2230a_100015525214_100000210512 [1,0,1,0,0,0|1,0,0]=3 298 B10R0.90 CCNCC(OCC)OCC 34a_100000211098_100000210202 [1,0,1,0,0,0|1,0,0]=3 299 B10R0.90 CCOC(CCNC)OCC 2230a_106832991635_100000033671 [1,0,1,0,0,0|1,0,0]=3 300 B10R0.90 CCOC(CCNC)OCC 34a_100000748396_200000210301 [1,0,1,0,0,0|1,0,0]=3 301 B10R0.90 CCOC(CCNC)OCC 34a_100102657272_100000033671 [1,0,1,0,0,0|1,0,0]=3 302 B10R0.90 CCOC(CCNC)OCC 7a_106832991635_100000033671 [1,0,1,0,0,0|1,0,0]=3 303 B10R0.90 CCOC(CCN[13CH3])OCC 34a_100000748396_200025704644 [1,0,1,0,0,0|1,0,0]=3 304 B10R0.90 CCOC(CCOC)OCC 34a_100011218310_200000210301 [1,0,1,0,0,0|1,0,0]=3 305 B10R0.90 CCOC(CCOC)OCC 34a_100138415774_100000033671 [1,0,1,0,0,0|1,0,0]=3 306 B10R0.90 CCOC(CCOC)OCC 7a_100011218310_200000210301 [1,0,1,0,0,0|1,0,0]=3 307 B10R0.90 CCOC(CCO[13CH3])OCC 34a_100011218310_200025704644 [1,0,1,0,0,0|1,0,0]=3 308 B10R0.90 CCOC(CCO[13CH3])OCC 7a_100011218310_200025704644 [1,0,1,0,0,0|1,0,0]=3 309 B10R0.90 CCOC(CCSC)OCC 62a_100000033671_200000210301 [1,0,1,0,0,0|1,0,0]=3 310 B10R0.90 CCOC(CCSC)OCC 62a_200000210301_100000033671 [1,0,1,0,0,0|1,0,0]=3 311 B10R0.90 CCOC(CCS[13CH3])OCC 62a_100000033671_200025704644 [1,0,1,0,0,0|1,0,0]=3 312 B10R0.90 CCOC(CCS[13CH3])OCC 62a_200025704644_100000033671 [1,0,1,0,0,0|1,0,0]=3 313 B10R0.90 CCOC(CNCF)OCC 34a_100000211098_100015361967 [1,0,1,0,0,0|2,0,0]=4 314 B10R0.90 CCOC(COCF)OCC 34a_100011216334_100015361967 [1,0,1,0,0,0|2,0,0]=4 315 B10R0.90 CCOC(COCF)OCC 7a_100011216334_100015361967 [1,0,1,0,0,0|2,0,0]=4 316 B10R0.90 CCOC(CSCC)OCC 62a_100000210202_100000210512 [1,0,1,0,0,0|1,0,0]=3 317 B10R0.90 CCOC(CSCC)OCC 62a_100000210512_100000210202 [1,0,1,0,0,0|1,0,0]=3 318 B10R0.90 CCOC(CSCF)OCC 62a_100000210512_100015361967 [1,0,1,0,0,0|2,0,0]=4 319 B10R0.90 CCOC(CSCF)OCC 62a_100015361967_100000210512 [1,0,1,0,0,0|2,0,0]=4 320 B10R0.90 CCOCC(OCC)OCC 34a_100011216334_100000210202 [1,0,1,0,0,0|1,0,0]=3 321 B10R0.90 CCOCC(OCC)OCC 34a_100121572206_100000210512 [1,0,1,0,0,0|1,0,0]=3 322 B10R0.90 CCOCC(OCC)OCC 7a_100011216334_100000210202 [1,0,1,0,0,0|1,0,0]=3 323 B10R0.107 CCCC(C)(CCC)OCC 7a_200011219694_100000210202 [1,0,1,0,0,0|1,0,0]=3 324 B10R0.107 CCCC(C)(CCC)OCF 7a_200011219694_100015361967 [1,0,1,0,0,0|2,0,0]=4 325 B10R0.107 CCO[Si](C)(CNC)OCC 34a_100102657272_100000061259 [1,0,1,0,0,0|1,1,0]=4 326 B10R0.107 CCO[Si](C)(COC)OCC 34a_100138415774_100000061259 [1,0,1,0,0,0|1,1,0]=4 327 B10R0.107 CCO[Si](C)(CSC)OCC 62a_100000061259_200000210301 [1,0,1,0,0,0|1,1,0]=4 328 B10R0.107 CCO[Si](C)(CSC)OCC 62a_200000210301_100000061259 [1,0,1,0,0,0|1,1,0]=4 329 B10R0.107 CCO[Si](C)(CS[13CH3])OCC 62a_100000061259_200025704644 [1,0,1,0,0,0|1,1,0]=4 330 B10R0.107 CCO[Si](C)(CS[13CH3])OCC 62a_200025704644_100000061259 [1,0,1,0,0,0|1,1,0]=4 331 B10R0.111 C=CCC(CC)(CC)OCC 7a_200011218178_100000210202 [1,0,1,0,0,0|0,0,2]=4 332 B10R0.111 CCCC(CC)(CC)OCC 7a_200011217480_100000210202 [1,0,1,0,0,0|0,0,0]=2 333 B10R0.111 CCCC(CC)(CC)OCF 7a_200011217480_100015361967 [1,0,1,0,0,0|1,0,0]=3 334 B10R0.123 CCCCC(C)(CC)OCC 7a_200011218725_100000210202 [1,0,1,0,0,0|0,0,0]=2 335 B10R0.123 CCCCC(C)(CC)OCF 7a_200011218725_100015361967 [1,0,1,0,0,0|1,0,0]=3 336 B10R0.123 CCCOC(C)(CC)CCC 7a_200011215934_100000210303 [1,0,1,0,0,0|2,0,0]=4 337 B10R0.123 CCCSC(C)(CC)CCC 62a_100000210303_200000040151 [1,0,1,0,0,0|2,0,0]=4 338 B10R0.123 CCCSC(C)(CC)CCC 62a_200000040151_100000210303 [1,0,1,0,0,0|2,0,0]=4 339 B10R1.377 CC1(CCCCC1)CN[13CH3] 2230a_100000706052_200025704644 [2,0,0,0,0,0|2,0,0]=4 340 B10R1.377 CC1(CCCCC1)CN[13CH3] 34a_100000706052_200025704644 [2,0,0,0,0,0|2,0,0]=4 341 B10R1.377 CC1(CCCCC1)CO[13CH3] 34a_100000688186_200025704644 [2,0,0,0,0,0|2,0,0]=4 342 B10R1.377 CC1(CCCCC1)CO[13CH3] 7a_100000688186_200025704644 [2,0,0,0,0,0|2,0,0]=4 343 B10R1.377 CC1(CCCCC1)NCF 34a_100000741114_100015361967 [2,0,0,0,0,0|2,0,0]=4 344 B10R1.377 CC1(CCCCC1)OCF 34a_100011215885_100015361967 [2,0,0,0,0,0|1,0,0]=3 345 B10R1.377 CC1(CCCCC1)OCF 7a_100011215885_100015361967 [2,0,0,0,0,0|1,0,0]=3 346 B10R1.377 CC1(CCOCC1)OCF 34a_100011827762_100015361967 [2,0,0,0,0,0|2,0,0]=4 347 B10R1.377 CC1(CCOCC1)OCF 7a_100011827762_100015361967 [2,0,0,0,0,0|2,0,0]=4 348 B10R1.377 CC1(CCSCC1)OCF 34a_200011004327_100015361967 [2,0,0,0,0,0|2,0,0]=4 349 B10R1.377 CC1(CCSCC1)OCF 7a_200011004327_100015361967 [2,0,0,0,0,0|2,0,0]=4 350 B10R1.377 CCNC1(CCCCC1)C 2230a_100000741114_100000210202 [2,0,0,0,0,0|1,0,0]=3 351 B10R1.377 CCNC1(CCCCC1)C 34a_100000741114_100000210202 [2,0,0,0,0,0|1,0,0]=3 352 B10R1.377 CCNC1(CCOCC1)C 2230a_100000692449_100000210202 [2,0,0,0,0,0|2,0,0]=4 353 B10R1.377 CCNC1(CCOCC1)C 34a_100000692449_100000210202 [2,0,0,0,0,0|2,0,0]=4 354 B10R1.377 CCOC1(CCCCC1)C 34a_100011215885_100000210202 [2,0,0,0,0,0|0,0,0]=2 355 B10R1.377 CCOC1(CCCCC1)C 7a_100011215885_100000210202 [2,0,0,0,0,0|0,0,0]=2 356 B10R1.377 CCOC1(CCOCC1)C 34a_100011827762_100000210202 [2,0,0,0,0,0|1,0,0]=3 357 B10R1.377 CCOC1(CCOCC1)C 7a_100011827762_100000210202 [2,0,0,0,0,0|1,0,0]=3 358 B10R1.377 CCOC1(CCSCC1)C 34a_200011004327_100000210202 [2,0,0,0,0,0|1,0,0]=3 359 B10R1.377 CCOC1(CCSCC1)C 7a_200011004327_100000210202 [2,0,0,0,0,0|1,0,0]=3 360 B10R1.377 CNCC1(CCCCC1)C 2230a_100000706052_200000210301 [2,0,0,0,0,0|2,0,0]=4 361 B10R1.377 CNCC1(CCCCC1)C 269862a_106832991636_100011935227 [2,0,0,0,0,0|2,0,0]=4 362 B10R1.377 CNCC1(CCCCC1)C 34a_100000706052_200000210301 [2,0,0,0,0,0|2,0,0]=4 363 B10R1.377 CNCC1(CCCCC1)O 2230a_100000748649_200000210301 [2,0,0,0,0,0|2,0,0]=4 364 B10R1.377 CNCC1(CCCCC1)O 34a_100000748649_200000210301 [2,0,0,0,0,0|2,0,0]=4 365 B10R1.377 COCC1(CCCCC1)C 34a_100000688186_200000210301 [2,0,0,0,0,0|2,0,0]=4 366 B10R1.377 COCC1(CCCCC1)C 7a_100000688186_200000210301 [2,0,0,0,0,0|2,0,0]=4 367 B10R1.377 [13CH3]NCC1(CCCCC1)O 2230a_100000748649_200025704644 [2,0,0,0,0,0|2,0,0]=4 368 B10R1.377 [13CH3]NCC1(CCCCC1)O 34a_100000748649_200025704644 [2,0,0,0,0,0|2,0,0]=4 369 B10R1.487 C#CC1(CCCCC1)OC 34a_100011215672_200000210301 [2,0,0,0,0,0|0,0,2]=4 370 B10R1.487 C#CC1(CCCCC1)OC 7a_100011215672_200000210301 [2,0,0,0,0,0|0,0,2]=4 371 B10R1.487 C#CC1(CCCCC1)O[13CH3] 34a_100011215672_200025704644 [2,0,0,0,0,0|0,0,2]=4 372 B10R1.487 C#CC1(CCCCC1)O[13CH3] 7a_100011215672_200025704644 [2,0,0,0,0,0|0,0,2]=4 373 B10R1.487 C=CC1(CCCCC1)OC 34a_200011934219_200000210301 [2,0,0,0,0,0|0,0,2]=4 374 B10R1.487 C=CC1(CCCCC1)OC 7a_200011934219_200000210301 [2,0,0,0,0,0|0,0,2]=4 375 B10R1.487 C=CC1(CCCCC1)O[13CH3] 34a_200011934219_200025704644 [2,0,0,0,0,0|0,0,2]=4 376 B10R1.487 C=CC1(CCCCC1)O[13CH3] 7a_200011934219_200025704644 [2,0,0,0,0,0|0,0,2]=4 377 B10R1.487 CCC1(CCCCC1)OC 34a_100011216009_200000210301 [2,0,0,0,0,0|0,0,0]=2 378 B10R1.487 CCC1(CCCCC1)OC 7a_100011216009_200000210301 [2,0,0,0,0,0|0,0,0]=2 379 B10R1.487 CCC1(CCCCC1)O[13CH3] 34a_100011216009_200025704644 [2,0,0,0,0,0|0,0,0]=2 380 B10R1.487 CCC1(CCCCC1)O[13CH3] 7a_100011216009_200025704644 [2,0,0,0,0,0|0,0,0]=2 381 B10R1.487 CNC1(CCCCC1)CO 2230a_100000740034_200000210301 [2,0,0,0,0,0|2,0,0]=4 382 B10R1.487 CNC1(CCCCC1)CO 34a_100000740034_200000210301 [2,0,0,0,0,0|2,0,0]=4 383 B10R1.487 COC1(CCCCC1)CN 34a_100000748649_200000210301 [2,0,0,0,0,0|1,0,0]=3 384 B10R1.487 COC1(CCOCC1)CN 34a_100000704115_200000210301 [2,0,0,0,0,0|2,0,0]=4 385 B10R1.487 COC1(CCSCC1)CN 34a_100000758141_200000210301 [2,0,0,0,0,0|2,0,0]=4 386 B10R1.487 [13CH3]NC1(CCCCC1)CO 2230a_100000740034_200025704644 [2,0,0,0,0,0|2,0,0]=4 387 B10R1.487 [13CH3]NC1(CCCCC1)CO 34a_100000740034_200025704644 [2,0,0,0,0,0|2,0,0]=4 388 B10R1.487 [13CH3]OC1(CCCCC1)CN 34a_100000748649_200025704644 [2,0,0,0,0,0|1,0,0]=3 389 B10R1.487 [13CH3]OC1(CCOCC1)CN 34a_100000704115_200025704644 [2,0,0,0,0,0|2,0,0]=4 390 B10R1.487 [13CH3]OC1(CCSCC1)CN 34a_100000758141_200025704644 [2,0,0,0,0,0|2,0,0]=4 391 B12R0.22 CCCC(=O)CC(OCC)OCC 1458a_100000082722_100000210303 [0,1,1,0,0,0|0,0,1]=3 392 B12R0.22 CCCC(=O)CC(OCC)OCC 1458a_100000211992_100000210512 [0,1,1,0,0,0|0,0,1]=3 393 B12R0.22 CCCN(C)CC(OCC)OCC 2230a_100000747261_100000210512 [0,1,1,0,0,0|1,0,0]=3 394 B12R0.22 CCCN(C)CC(OCC)OCC 269982a_100000747261_100000733474 [0,1,1,0,0,0|1,0,0]=3 395 B12R0.22 CCCN(C)CC(OCC)OCC 269982a_200000227172_100000210303 [0,1,1,0,0,0|1,0,0]=3 396 B12R0.22 CCCN(C)CC(OCC)OCC 34a_200000227172_100000210303 [0,1,1,0,0,0|1,0,0]=3 397 B12R0.22 CCNC(=O)CC(OCC)OCC 11a_100015525214_100000082722 [0,1,1,0,0,0|1,0,1]=4 398 B12R0.22 CCNC(=O)CC(OCC)OCC 240690a_100015525214_100000082722 [0,1,1,0,0,0|1,0,1]=4 399 B12R0.22 CCNC(=O)CC(OCC)OCC 527a_100015525214_100000082722 [0,1,1,0,0,0|1,0,1]=4 400 B12R0.22 CCOC(CC(=O)CCF)OCC 1458a_100000082722_100011217306 [0,1,1,0,0,0|1,0,1]=4 401 B12R0.22 CCOC(CC(=O)CCO)OCC 1458a_100000082722_100000211926 [0,1,1,0,0,0|1,0,1]=4 402 B12R0.22 CCOC(CC(=O)CCO)OCC 1458a_100011216618_100000210512 [0,1,1,0,0,0|1,0,1]=4 403 B12R0.22 CCOC(CC(=O)COC)OCC 1458a_100000210968_100000210512 [0,1,1,0,0,0|1,0,1]=4 404 B12R0.22 CCOC(CC(=O)CSC)OCC 1458a_100000184570_100000210512 [0,1,1,0,0,0|1,0,1]=4 405 B12R0.22 CCOC(CN(C)CCF)OCC 269982a_200000227172_100011217306 [0,1,1,0,0,0|2,0,0]=4 406 B12R0.22 CCOC(CN(C)CCF)OCC 34a_200000227172_100011217306 [0,1,1,0,0,0|2,0,0]=4 407 B12R0.22 CCOC(CN(C)CCO)OCC 2230a_100000210263_100000210512 [0,1,1,0,0,0|2,0,0]=4 408 B12R0.22 CCOC(CN(C)CCO)OCC 269982a_100000210263_100000733474 [0,1,1,0,0,0|2,0,0]=4 409 B12R0.22 CCOC(CN(C)CCO)OCC 269982a_200000227172_100000211926 [0,1,1,0,0,0|2,0,0]=4 410 B12R0.22 CCOC(CN(C)CCO)OCC 34a_200000227172_100000211926 [0,1,1,0,0,0|2,0,0]=4 411 B12R0.22 CCOC(CN(C)COC)OCC 269982a_200000227172_100000766300 [0,1,1,0,0,0|2,0,0]=4 412 B12R0.22 CCOC(CN(C)CSC)OCC 269982a_200000227172_100011218213 [0,1,1,0,0,0|2,0,0]=4 413 B12R0.22 CCOC(CN(C)CSC)OCC 34a_200000227172_100011218213 [0,1,1,0,0,0|2,0,0]=4 414 B12R0.100 CCCCC(=O)C(OCC)OCC 1458a_100000082760_100000210211 [0,1,1,0,0,0|0,0,1]=3 415 B12R0.100 CCCNC(=O)C(OCC)OCC 11a_100020643023_100000082760 [0,1,1,0,0,0|1,0,1]=4 416 B12R0.100 CCCNC(=O)C(OCC)OCC 1626a_100020643023_100000082760 [0,1,1,0,0,0|1,0,1]=4 417 B12R0.100 CCCNC(=O)C(OCC)OCC 240690a_100020643023_100000082760 [0,1,1,0,0,0|1,0,1]=4 418 B12R0.100 CCCNC(=O)C(OCC)OCC 527a_100020643023_100000082760 [0,1,1,0,0,0|1,0,1]=4 419 B12R0.100 CCCOC(C)C(OCC)OCC 34a_100000210258_100009815656 [0,1,1,0,0,0|1,0,0]=3 420 B12R0.100 CCCSC(C)C(OCC)OCC 62a_100000210303_100009815656 [0,1,1,0,0,0|1,0,0]=3 421 B12R0.100 CCCSC(C)C(OCC)OCC 62a_100009815656_100000210303 [0,1,1,0,0,0|1,0,0]=3 422 B12R0.100 CCOC(OCC)C(=O)CCCF 1458a_100000082760_100011934791 [0,1,1,0,0,0|1,0,1]=4 423 B12R0.100 CCOC(OCC)C(=O)CCCO 1458a_100000082760_100011215043 [0,1,1,0,0,0|1,0,1]=4 424 B12R0.100 CCOC(OCC)C(=O)CCOC 1458a_100000082760_100000233755 [0,1,1,0,0,0|1,0,1]=4 425 B12R0.100 CCOC(OCC)C(=O)CCSC 1458a_100000082760_100000751147 [0,1,1,0,0,0|1,0,1]=4 426 B12R0.100 CCOC(OCC)C(C)NCCF 34a_100000724931_100009815656 [0,1,1,0,0,0|2,0,0]=4 427 B12R0.100 CCOC(OCC)C(C)NCCO 34a_100016990907_100009815656 [0,1,1,0,0,0|2,0,0]=4 428 B12R0.100 CCOC(OCC)C(C)OCCBr 34a_100000211926_100009815656 [0,1,1,0,0,0|2,0,0]=4 429 B12R0.100 CCOC(OCC)C(C)OCCN 34a_100000210304_100009815656 [0,1,1,0,0,0|2,0,0]=4 430 B12R0.100 CCOC(OCC)C(C)SCCF 62a_100009815656_100011217306 [0,1,1,0,0,0|2,0,0]=4 431 B12R0.100 CCOC(OCC)C(C)SCCF 62a_100011217306_100009815656 [0,1,1,0,0,0|2,0,0]=4 432 B12R0.100 CCOC(OCC)C(C)SCCO 62a_100000211926_100009815656 [0,1,1,0,0,0|2,0,0]=4 433 B12R0.100 CCOC(OCC)C(C)SCCO 62a_100009815656_100000211926 [0,1,1,0,0,0|2,0,0]=4 434 B12R0.100 CCOC(OCC)C(C)SCOC 62a_100000766300_100009815656 [0,1,1,0,0,0|2,0,0]=4 435 B12R0.100 CCOC(OCC)C(C)SCOC 62a_100009815656_100000766300 [0,1,1,0,0,0|2,0,0]=4 436 B12R0.100 CCOC(OCC)C(C)SCSC 62a_100009815656_100011218213 [0,1,1,0,0,0|2,0,0]=4 437 B12R0.100 CCOC(OCC)C(C)SCSC 62a_100011218213_100009815656 [0,1,1,0,0,0|2,0,0]=4 438 B12R0.118 C#CCOC(CCC)CCCCC 34a_200011215058_100000184674 [0,1,1,0,0,0|1,0,1]=4 439 B12R0.118 C#CCOC(CCC)CCCCC 7a_200011215058_100000038162 [0,1,1,0,0,0|1,0,1]=4 440 B12R0.118 C=CCOC(CCC)CCCCC 34a_200011215058_100015514636 [0,1,1,0,0,0|1,0,1]=4 441 B12R0.118 C=CCOC(CCC)CCCCC 7a_200011215058_100015514636 [0,1,1,0,0,0|1,0,1]=4 442 B12R0.118 CCCCCC(CCC)COCC 34a_100011290854_100000210202 [0,1,1,0,0,0|1,0,0]=3 443 B12R0.118 CCCCCC(CCC)COCC 7a_100011290854_100000210202 [0,1,1,0,0,0|1,0,0]=3 444 B12R0.118 CCCCCC(CCC)COCF 34a_100011290854_100015361967 [0,1,1,0,0,0|2,0,0]=4 445 B12R0.118 CCCCCC(CCC)COCF 7a_100011290854_100015361967 [0,1,1,0,0,0|2,0,0]=4 446 B12R0.118 CCCCCC(CCC)NCCC 270004a_100020643023_200011216343 [0,1,1,0,0,0|2,0,0]=4 447 B12R0.118 CCCCCC(CCC)NCCO 270004a_100000210304_200011216343 [0,1,1,0,0,0|2,0,0]=4 448 B12R0.118 CCCCCC(CCC)OCC#N 7a_200011215058_100011215382 [0,1,1,0,0,0|1,0,1]=4 449 B12R0.118 CCCCCC(CCC)OCC=O 34a_200011215058_200009817547 [0,1,1,0,0,0|1,0,1]=4 450 B12R0.118 CCCCCC(CCC)OCC=O 7a_200011215058_200015260668 [0,1,1,0,0,0|1,0,1]=4 451 B12R0.118 CCCCCC(CCC)OCCC 34a_200011215058_100000210303 [0,1,1,0,0,0|1,0,0]=3 452 B12R0.118 CCCCCC(CCC)OCCC 7a_200011215058_100000210303 [0,1,1,0,0,0|1,0,0]=3 453 B12R0.118 CCCCCC(CCC)OCCF 34a_200011215058_100011217306 [0,1,1,0,0,0|1,0,0]=3 454 B12R0.118 CCCCCC(CCC)OCCF 7a_200011215058_100011217306 [0,1,1,0,0,0|1,0,0]=3 455 B12R0.118 CCCCCC(CCC)OCCO 34a_200011215058_100000211926 [0,1,1,0,0,0|1,0,0]=3 456 B12R0.118 CCCCCC(CCC)OCCO 7a_200011215058_100000211926 [0,1,1,0,0,0|1,0,0]=3 457 B12R0.118 CCCCCC(CCC)OCSC 34a_200011215058_100011218213 [0,1,1,0,0,0|1,0,0]=3 458 B12R0.118 CCCCCC(CCCC)NCC 270004a_100015525214_200011218572 [0,1,1,0,0,0|2,0,0]=4 459 B12R0.118 CCCCCN(CCC)COCC 269982a_200000226819_100000739092 [0,1,1,0,0,0|2,0,0]=4 460 B12R0.160 CCOC(CCC(=O)CC)OCC 1458a_100000210414_100000033671 [0,1,1,0,0,0|0,0,1]=3 461 B12R0.160 CCOC(CCC(=O)CO)OCC 1458a_100000210174_100000033671 [0,1,1,0,0,0|1,0,1]=4 462 B12R0.160 CCOC(CCN(C)CC)OCC 2230a_100000225621_100000033671 [0,1,1,0,0,0|1,0,0]=3 463 B12R0.160 CCOC(CCN(C)CC)OCC 269982a_100000225621_100000033671 [0,1,1,0,0,0|1,0,0]=3 464 B12R0.160 CCOC(CNC(=O)CC)OCC 11a_100000211098_100000210414 [0,1,1,0,0,0|1,0,1]=4 465 B12R0.160 CCOC(CNC(=O)CC)OCC 1626a_100000211098_100000210414 [0,1,1,0,0,0|1,0,1]=4 466 B12R0.160 CCOC(CNC(=O)CC)OCC 240690a_100000211098_100000210414 [0,1,1,0,0,0|1,0,1]=4 467 B12R0.160 CCOC(CNC(=O)CC)OCC 527a_100000211098_100000210414 [0,1,1,0,0,0|1,0,1]=4 468 B12R0.160 CCOC(CNC(C)CC)OCC 2230a_100000209981_100000210512 [0,1,1,0,0,0|1,0,0]=3 469 B12R0.160 CCOC(CNC(C)CC)OCC 34a_100000211098_100011215416 [0,1,1,0,0,0|1,0,0]=3 470 B12R0.160 CCOC(CNC(C)CO)OCC 34a_100000211098_100012180447 [0,1,1,0,0,0|2,0,0]=4 471 B12R0.160 CCOC(CN[C@H](C)CO)OCC 2230a_100000737577_100000210512 [0,1,1,0,0,0|2,0,0]=4 472 B12R0.160 CCOC(COC(C)CC)OCC 34a_100011216334_100011215416 [0,1,1,0,0,0|1,0,0]=3 473 B12R0.160 CCOC(COC(C)CC)OCC 7a_100000210228_100000210512 [0,1,1,0,0,0|1,0,0]=3 474 B12R0.160 CCOC(COC(C)CC)OCC 7a_100011216334_100000758301 [0,1,1,0,0,0|1,0,0]=3 475 B12R0.160 CCOC(COC(C)CF)OCC 34a_100016041109_100000210512 [0,1,1,0,0,0|2,0,0]=4 476 B12R0.160 CCOC(COC(C)CF)OCC 7a_100016041109_100000210512 [0,1,1,0,0,0|2,0,0]=4 477 B12R0.160 CCOC(COC(C)CN)OCC 34a_100000210904_100000210512 [0,1,1,0,0,0|2,0,0]=4 478 B12R0.160 CCOC(COC(C)CO)OCC 34a_100011216334_100012180447 [0,1,1,0,0,0|2,0,0]=4 479 B12R0.160 CCOC(COC(C)CO)OCC 7a_100011216334_100012180447 [0,1,1,0,0,0|2,0,0]=4 480 B12R0.160 CCOC(CSC(C)CC)OCC 62a_100000210512_100000758301 [0,1,1,0,0,0|1,0,0]=3 481 B12R0.160 CCOC(CSC(C)CC)OCC 62a_100000758301_100000210512 [0,1,1,0,0,0|1,0,0]=3 482 B12R0.160 CCOC(CSC(C)CO)OCC 62a_100012180447_100000210512 [0,1,1,0,0,0|2,0,0]=4 483 B12R0.160 CCOC(CSC(C)OC)OCC 62a_100000210512_100009879195 [0,1,1,0,0,0|2,0,0]=4 484 B12R0.160 CCOC(CSC(C)OC)OCC 62a_100009879195_100000210512 [0,1,1,0,0,0|2,0,0]=4 485 B12R0.160 CCOC(CS[C@H](C)CO)OCC 62a_100000210512_100016084084 [0,1,1,0,0,0|2,0,0]=4 486 B12R0.160 CCOC(CS[C@H](C)CO)OCC 62a_100016084084_100000210512 [0,1,1,0,0,0|2,0,0]=4 487 B12R0.164 C=C(C)CNCC(OCC)OCC 34a_100000211098_100000748629 [0,1,1,0,0,0|1,0,1]=4 488 B12R0.164 C=C(C)COCC(OCC)OCC 34a_100000210245_100000210512 [0,1,1,0,0,0|1,0,1]=4 489 B12R0.164 C=C(C)COCC(OCC)OCC 34a_100011216334_100000748629 [0,1,1,0,0,0|1,0,1]=4 490 B12R0.164 C=C(C)COCC(OCC)OCC 7a_100011216334_100000748629 [0,1,1,0,0,0|1,0,1]=4 491 B12R0.164 C=C(C)CSCC(OCC)OCC 62a_100000210512_100000211660 [0,1,1,0,0,0|1,0,1]=4 492 B12R0.164 C=C(C)CSCC(OCC)OCC 62a_100000748629_100000210512 [0,1,1,0,0,0|1,0,1]=4 493 B12R0.164 CCOC(CCCC(=O)C)OCC 1458a_100000070787_100000034166 [0,1,1,0,0,0|0,0,1]=3 494 B12R0.164 CCOC(CCCN(C)C)OCC 2230a_100102631434_100000034166 [0,1,1,0,0,0|1,0,0]=3 495 B12R0.164 CCOC(CCCN(C)C)OCC 269982a_100102631434_100000034166 [0,1,1,0,0,0|1,0,0]=3 496 B12R0.164 CCOC(CCNC(=O)C)OCC 11a_100000748396_100015343762 [0,1,1,0,0,0|1,0,1]=4 497 B12R0.164 CCOC(CCNC(=O)C)OCC 1626a_100000748396_100015343762 [0,1,1,0,0,0|1,0,1]=4 498 B12R0.164 CCOC(CCNC(=O)C)OCC 240690a_100000748396_100015343762 [0,1,1,0,0,0|1,0,1]=4 499 B12R0.164 CCOC(CCNC(=O)C)OCC 527a_100000748396_100103153847 [0,1,1,0,0,0|1,0,1]=4 500 B12R0.164 CCOC(CCNC(C)C)OCC 2230a_100138425928_100000033671 [0,1,1,0,0,0|1,0,0]=3 501 B12R0.164 CCOC(CCNC(C)C)OCC 34a_100000748396_100000210206 [0,1,1,0,0,0|1,0,0]=3 502 B12R0.164 CCOC(CCNC(C)C)OCC 34a_100138425928_100000033671 [0,1,1,0,0,0|1,0,0]=3 503 B12R0.164 CCOC(CCOC(C)C)OCC 34a_100000212225_100000033671 [0,1,1,0,0,0|1,0,0]=3 504 B12R0.164 CCOC(CCOC(C)C)OCC 34a_100011218310_100000210206 [0,1,1,0,0,0|1,0,0]=3 505 B12R0.164 CCOC(CCOC(C)C)OCC 7a_100011218310_100000210206 [0,1,1,0,0,0|1,0,0]=3 506 B12R0.164 CCOC(CCSC(C)C)OCC 62a_100000033671_100000210206 [0,1,1,0,0,0|1,0,0]=3 507 B12R0.164 CCOC(CCSC(C)C)OCC 62a_100000210206_100000033671 [0,1,1,0,0,0|1,0,0]=3 508 B12R0.164 CCOC(CNCC(C)C)OCC 2230a_100000210953_100000210512 [0,1,1,0,0,0|1,0,0]=3 509 B12R0.164 CCOC(CNCC(C)C)OCC 270004a_100000211098_100000210432 [0,1,1,0,0,0|1,0,0]=3 510 B12R0.164 CCOC(CNCC(C)C)OCC 34a_100000210953_100000210512 [0,1,1,0,0,0|1,0,0]=3 511 B12R0.164 CCOC(CNCC(C)C)OCC 34a_100000211098_100000210624 [0,1,1,0,0,0|1,0,0]=3 512 B12R0.164 CCOC(CNCC(C)O)OCC 2230a_100000210904_100000210512 [0,1,1,0,0,0|1,0,0]=3 513 B12R0.164 CCOC(CNCC(C)O)OCC 34a_100000210904_100000210512 [0,1,1,0,0,0|1,0,0]=3 514 B12R0.164 CCOC(CNCC(C)O)OCC 34a_100000211098_100011218427 [0,1,1,0,0,0|1,0,0]=3 515 B12R0.164 CCOC(CNCC(F)F)OCC 34a_100000211098_100011934356 [0,1,1,0,0,0|2,0,0]=4 516 B12R0.164 CCOC(CNCC(F)F)OCC 34a_100000765723_100000210512 [0,1,1,0,0,0|2,0,0]=4 517 B12R0.164 CCOC(CNC[C@@H](C)O)OCC 34a_100000211098_100009817552 [0,1,1,0,0,0|1,0,0]=3 518 B12R0.164 CCOC(COCC(=O)C)OCC 34a_100000211253_100000210512 [0,1,1,0,0,0|1,0,1]=4 519 B12R0.164 CCOC(COCC(C)Br)OCC 34a_100012180447_100000210512 [0,1,1,0,0,0|1,0,0]=3 520 B12R0.164 CCOC(COCC(C)C)OCC 34a_100000210257_100000210512 [0,1,1,0,0,0|1,0,0]=3 521 B12R0.164 CCOC(COCC(C)C)OCC 34a_100011216334_100000210624 [0,1,1,0,0,0|1,0,0]=3 522 B12R0.164 CCOC(COCC(C)C)OCC 7a_100011216334_100000210760 [0,1,1,0,0,0|1,0,0]=3 523 B12R0.164 CCOC(COCC(C)F)OCC 34a_100015925927_100000210512 [0,1,1,0,0,0|1,0,0]=3 524 B12R0.164 CCOC(COCC(C)O)OCC 34a_100011216334_100011218427 [0,1,1,0,0,0|1,0,0]=3 525 B12R0.164 CCOC(COCC(C)O)OCC 7a_100011216334_100011218427 [0,1,1,0,0,0|1,0,0]=3 526 B12R0.164 CCOC(COCC(F)F)OCC 34a_100000743014_100000210512 [0,1,1,0,0,0|2,0,0]=4 527 B12R0.164 CCOC(COCC(F)F)OCC 34a_100011216334_100011934356 [0,1,1,0,0,0|2,0,0]=4 528 B12R0.164 CCOC(COCC(F)F)OCC 7a_100011216334_100011934356 [0,1,1,0,0,0|2,0,0]=4 529 B12R0.164 CCOC(COC[C@@H](C)Cl)OCC 34a_100016084084_100000210512 [0,1,1,0,0,0|1,0,0]=3 530 B12R0.164 CCOC(COC[C@@H](C)N)OCC 34a_100000737577_100000210512 [0,1,1,0,0,0|1,0,0]=3 531 B12R0.164 CCOC(COC[C@@H](C)O)OCC 34a_100011216334_100009817552 [0,1,1,0,0,0|1,0,0]=3 532 B12R0.164 CCOC(COC[C@@H](C)O)OCC 7a_100011216334_100009817552 [0,1,1,0,0,0|1,0,0]=3 533 B12R0.164 CCOC(CSCC(C)C)OCC 62a_100000210512_100000210760 [0,1,1,0,0,0|1,0,0]=3 534 B12R0.164 CCOC(CSCC(C)C)OCC 62a_100000210624_100000210512 [0,1,1,0,0,0|1,0,0]=3 535 B12R0.164 CCOC(CSCC(C)O)OCC 62a_100000210512_100011218427 [0,1,1,0,0,0|1,0,0]=3 536 B12R0.164 CCOC(CSCC(C)O)OCC 62a_100011218427_100000210512 [0,1,1,0,0,0|1,0,0]=3 537 B12R0.164 CCOC(CSCC(F)F)OCC 62a_100000210512_100011934356 [0,1,1,0,0,0|2,0,0]=4 538 B12R0.164 CCOC(CSCC(F)F)OCC 62a_100011934356_100000210512 [0,1,1,0,0,0|2,0,0]=4 539 B12R0.164 CCOC(CSC[C@@H](C)O)OCC 62a_100000210512_100009817552 [0,1,1,0,0,0|1,0,0]=3 540 B12R0.164 CCOC(CSC[C@@H](C)O)OCC 62a_100009817552_100000210512 [0,1,1,0,0,0|1,0,0]=3 541 B12R0.205 C#CCCNCC(OCC)OCC 34a_100000211098_100000688953 [0,1,1,0,0,0|0,0,2]=4 542 B12R0.205 C#CCCNCC(OCC)OCC 34a_100000755551_100000210512 [0,1,1,0,0,0|0,0,2]=4 543 B12R0.205 C#CCCOCC(OCC)OCC 34a_100011215631_100000210512 [0,1,1,0,0,0|0,0,2]=4 544 B12R0.205 C#CCCOCC(OCC)OCC 34a_100011216334_100000688953 [0,1,1,0,0,0|0,0,2]=4 545 B12R0.205 C#CCCOCC(OCC)OCC 7a_100011216334_100000688953 [0,1,1,0,0,0|0,0,2]=4 546 B12R0.205 C#CCCSCC(OCC)OCC 62a_100000210512_100000688953 [0,1,1,0,0,0|0,0,2]=4 547 B12R0.205 C#CCCSCC(OCC)OCC 62a_100000688953_100000210512 [0,1,1,0,0,0|0,0,2]=4 548 B12R0.205 C#CCNCCC(OCC)OCC 34a_100000212058_100000033671 [0,1,1,0,0,0|0,0,2]=4 549 B12R0.205 C#CCNCCC(OCC)OCC 34a_100000748396_100000184674 [0,1,1,0,0,0|0,0,2]=4 550 B12R0.205 C#CCOCCC(OCC)OCC 34a_100000210247_100000033671 [0,1,1,0,0,0|0,0,2]=4 551 B12R0.205 C#CCOCCC(OCC)OCC 34a_100011218310_100000184674 [0,1,1,0,0,0|0,0,2]=4 552 B12R0.205 C#CCOCCC(OCC)OCC 7a_100011218310_100000038162 [0,1,1,0,0,0|0,0,2]=4 553 B12R0.205 C#CCSCCC(OCC)OCC 62a_100000038162_100000033671 [0,1,1,0,0,0|0,0,2]=4 554 B12R0.205 C/C=C/CNCC(OCC)OCC 34a_100000211098_100102629194 [0,1,1,0,0,0|0,0,2]=4 555 B12R0.205 C/C=C/COCC(OCC)OCC 34a_100011216334_100102629194 [0,1,1,0,0,0|0,0,2]=4 556 B12R0.205 C/C=C/COCC(OCC)OCC 34a_100016270725_100000210512 [0,1,1,0,0,0|0,0,2]=4 557 B12R0.205 C/C=C/COCC(OCC)OCC 7a_100011216334_100102629194 [0,1,1,0,0,0|0,0,2]=4 558 B12R0.205 C/C=C/CSCC(OCC)OCC 62a_100000210512_100102629194 [0,1,1,0,0,0|0,0,2]=4 559 B12R0.205 C/C=C/CSCC(OCC)OCC 62a_100102629194_100000210512 [0,1,1,0,0,0|0,0,2]=4 560 B12R0.205 C=CCCNCC(OCC)OCC 2230a_100015191253_100000210512 [0,1,1,0,0,0|0,0,2]=4 561 B12R0.205 C=CCCNCC(OCC)OCC 34a_100000211098_100000754431 [0,1,1,0,0,0|0,0,2]=4 562 B12R0.205 C=CCCOCC(OCC)OCC 34a_100011205117_100000210512 [0,1,1,0,0,0|0,0,2]=4 563 B12R0.205 C=CCCOCC(OCC)OCC 34a_100011216334_100000754431 [0,1,1,0,0,0|0,0,2]=4 564 B12R0.205 C=CCCOCC(OCC)OCC 7a_100011216334_100000754431 [0,1,1,0,0,0|0,0,2]=4 565 B12R0.205 C=CCCSCC(OCC)OCC 62a_100000210512_100000754431 [0,1,1,0,0,0|0,0,2]=4 566 B12R0.205 C=CCCSCC(OCC)OCC 62a_100000754431_100000210512 [0,1,1,0,0,0|0,0,2]=4 567 B12R0.205 C=CCNCCC(OCC)OCC 2230a_100020586998_100000033671 [0,1,1,0,0,0|0,0,2]=4 568 B12R0.205 C=CCNCCC(OCC)OCC 34a_100000748396_100015514636 [0,1,1,0,0,0|0,0,2]=4 569 B12R0.205 C=CCOCCC(OCC)OCC 34a_100011218310_100015514636 [0,1,1,0,0,0|0,0,2]=4 570 B12R0.205 C=CCOCCC(OCC)OCC 34a_200000210373_100000033671 [0,1,1,0,0,0|0,0,2]=4 571 B12R0.205 C=CCOCCC(OCC)OCC 7a_100011218310_100015514636 [0,1,1,0,0,0|0,0,2]=4 572 B12R0.205 C=CCSCCC(OCC)OCC 62a_100000033671_100000210623 [0,1,1,0,0,0|0,0,2]=4 573 B12R0.205 C=CCSCCC(OCC)OCC 62a_100000210623_100000033671 [0,1,1,0,0,0|0,0,2]=4 574 B12R0.205 CC#CCNCC(OCC)OCC 2230a_100000685387_100000210512 [0,1,1,0,0,0|0,0,2]=4 575 B12R0.205 CC#CCNCC(OCC)OCC 34a_100000211098_100000748600 [0,1,1,0,0,0|0,0,2]=4 576 B12R0.205 CC#CCNCC(OCC)OCC 34a_100000685387_100000210512 [0,1,1,0,0,0|0,0,2]=4 577 B12R0.205 CC#CCOCC(OCC)OCC 34a_100000761923_100000210512 [0,1,1,0,0,0|0,0,2]=4 578 B12R0.205 CC#CCOCC(OCC)OCC 34a_100011216334_100000748600 [0,1,1,0,0,0|0,0,2]=4 579 B12R0.205 CC#CCOCC(OCC)OCC 7a_100011216334_100000748600 [0,1,1,0,0,0|0,0,2]=4 580 B12R0.205 CC#CCSCC(OCC)OCC 62a_100000210512_100000748600 [0,1,1,0,0,0|0,0,2]=4 581 B12R0.205 CC#CCSCC(OCC)OCC 62a_100000748600_100000210512 [0,1,1,0,0,0|0,0,2]=4 582 B12R0.205 CC=CCNCC(OCC)OCC 34a_100000211098_100000070051 [0,1,1,0,0,0|0,0,2]=4 583 B12R0.205 CC=CCOCC(OCC)OCC 34a_100011216334_100000070051 [0,1,1,0,0,0|0,0,2]=4 584 B12R0.205 CC=CCOCC(OCC)OCC 7a_100011216334_100000070051 [0,1,1,0,0,0|0,0,2]=4 585 B12R0.205 CC=CCSCC(OCC)OCC 62a_100000070051_100000210512 [0,1,1,0,0,0|0,0,2]=4 586 B12R0.205 CC=CCSCC(OCC)OCC 62a_100000210512_100000070051 [0,1,1,0,0,0|0,0,2]=4 587 B12R0.205 CCCCCCC(CCC)NCC 270004a_100015525214_200011215359 [0,1,1,0,0,0|2,0,0]=4 588 B12R0.205 CCCCCCC(CCC)OCC 34a_200011215193_100000210202 [0,1,1,0,0,0|1,0,0]=3 589 B12R0.205 CCCCCCC(CCC)OCC 7a_200011215193_100000210202 [0,1,1,0,0,0|1,0,0]=3 590 B12R0.205 CCCCCCC(CCC)OCF 34a_200011215193_100015361967 [0,1,1,0,0,0|2,0,0]=4 591 B12R0.205 CCCCCCC(CCC)OCF 7a_200011215193_100015361967 [0,1,1,0,0,0|2,0,0]=4 592 B12R0.205 CCCCCNC(CCC)CCC 2230a_100011207992_100000210326 [0,1,1,0,0,0|2,0,0]=4 593 B12R0.205 CCCCCNC(CCC)CCC 270004a_100000209983_100000210088 [0,1,1,0,0,0|2,0,0]=4 594 B12R0.205 CCCCCNC(CCC)CCC 34a_100011207992_100000718602 [0,1,1,0,0,0|2,0,0]=4 595 B12R0.205 CCCCCOC(CCC)CCC 34a_100000210253_200011218217 [0,1,1,0,0,0|2,0,0]=4 596 B12R0.205 CCCCCOC(CCC)CCC 34a_200011218534_100000718602 [0,1,1,0,0,0|2,0,0]=4 597 B12R0.205 CCCCCOC(CCC)CCC 7a_100000210253_200011218217 [0,1,1,0,0,0|2,0,0]=4 598 B12R0.205 CCCCCOC(CCC)CCC 7a_200011218534_100000210326 [0,1,1,0,0,0|2,0,0]=4 599 B12R0.205 CCCCCSC(CCC)CCC 62a_100000210326_200011218217 [0,1,1,0,0,0|2,0,0]=4 600 B12R0.205 CCCCCSC(CCC)CCC 62a_200011218217_100000210326 [0,1,1,0,0,0|2,0,0]=4 601 B12R0.205 CCCCNCC(OCC)OCC 2230a_100000102301_100000210512 [0,1,1,0,0,0|0,0,0]=2 602 B12R0.205 CCCCNCC(OCC)OCC 34a_100000211098_100000210210 [0,1,1,0,0,0|0,0,0]=2 603 B12R0.205 CCCCNCC(OCC)OCC 7a_106832991798_100000210512 [0,1,1,0,0,0|0,0,0]=2 604 B12R0.205 CCCCOCC(CCC)CCC 34a_200011215456_100000210210 [0,1,1,0,0,0|2,0,0]=4 605 B12R0.205 CCCCOCC(CCC)CCC 7a_200011215456_100000210211 [0,1,1,0,0,0|2,0,0]=4 606 B12R0.205 CCCCOCC(OCC)OCC 34a_100000210227_100000210512 [0,1,1,0,0,0|0,0,0]=2 607 B12R0.205 CCCCOCC(OCC)OCC 34a_100011216334_100000210210 [0,1,1,0,0,0|0,0,0]=2 608 B12R0.205 CCCCOCC(OCC)OCC 7a_100000210227_100000210512 [0,1,1,0,0,0|0,0,0]=2 609 B12R0.205 CCCCOCC(OCC)OCC 7a_100011216334_100000210211 [0,1,1,0,0,0|0,0,0]=2 610 B12R0.205 CCCCSCC(OCC)OCC 62a_100000210211_100000210512 [0,1,1,0,0,0|0,0,0]=2 611 B12R0.205 CCCCSCC(OCC)OCC 62a_100000210512_100000210210 [0,1,1,0,0,0|0,0,0]=2 612 B12R0.205 CCCNCCC(OCC)OCC 34a_100000748396_100000210303 [0,1,1,0,0,0|0,0,0]=2 613 B12R0.205 CCCOCCC(OCC)OCC 34a_100000210258_100000033671 [0,1,1,0,0,0|0,0,0]=2 614 B12R0.205 CCCOCCC(OCC)OCC 34a_100011218310_100000210303 [0,1,1,0,0,0|0,0,0]=2 615 B12R0.205 CCCOCCC(OCC)OCC 7a_100011218310_100000210303 [0,1,1,0,0,0|0,0,0]=2 616 B12R0.205 CCCSCCC(OCC)OCC 62a_100000033671_100000210303 [0,1,1,0,0,0|0,0,0]=2 617 B12R0.205 CCCSCCC(OCC)OCC 62a_100000210303_100000033671 [0,1,1,0,0,0|0,0,0]=2 618 B12R0.205 CCNCCCC(OCC)OCC 2230a_100015525214_100000034166 [0,1,1,0,0,0|0,0,0]=2 619 B12R0.205 CCNCCCC(OCC)OCC 34a_100000211155_100000210202 [0,1,1,0,0,0|0,0,0]=2 620 B12R0.205 CCOC(CCCNCF)OCC 34a_100000211155_100015361967 [0,1,1,0,0,0|1,0,0]=3 621 B12R0.205 CCOC(CCCSCC)OCC 62a_100000034166_100000210202 [0,1,1,0,0,0|0,0,0]=2 622 B12R0.205 CCOC(CCCSCC)OCC 62a_100000210202_100000034166 [0,1,1,0,0,0|0,0,0]=2 623 B12R0.205 CCOC(CCCSCF)OCC 62a_100000034166_100015361967 [0,1,1,0,0,0|1,0,0]=3 624 B12R0.205 CCOC(CCCSCF)OCC 62a_100015361967_100000034166 [0,1,1,0,0,0|1,0,0]=3 625 B12R0.205 CCOC(CCNCC=O)OCC 34a_100000748396_200009817547 [0,1,1,0,0,0|1,0,1]=4 626 B12R0.205 CCOC(CCNCCF)OCC 34a_100000724931_100000033671 [0,1,1,0,0,0|1,0,0]=3 627 B12R0.205 CCOC(CCNCCF)OCC 34a_100000748396_100011217306 [0,1,1,0,0,0|1,0,0]=3 628 B12R0.205 CCOC(CCNCCO)OCC 2230a_100016997473_100000033671 [0,1,1,0,0,0|1,0,0]=3 629 B12R0.205 CCOC(CCNCCO)OCC 34a_100000748396_100000211926 [0,1,1,0,0,0|1,0,0]=3 630 B12R0.205 CCOC(CCNCCO)OCC 34a_100016990907_100000033671 [0,1,1,0,0,0|1,0,0]=3 631 B12R0.205 CCOC(CCNCSC)OCC 34a_100000748396_100011218213 [0,1,1,0,0,0|1,0,0]=3 632 B12R0.205 CCOC(CCOCC#N)OCC 7a_100011218310_100011215382 [0,1,1,0,0,0|1,0,1]=4 633 B12R0.205 CCOC(CCOCC=O)OCC 34a_100011218310_200009817547 [0,1,1,0,0,0|1,0,1]=4 634 B12R0.205 CCOC(CCOCC=O)OCC 7a_100011218310_200015260668 [0,1,1,0,0,0|1,0,1]=4 635 B12R0.205 CCOC(CCOCCBr)OCC 34a_100000211926_100000033671 [0,1,1,0,0,0|1,0,0]=3 636 B12R0.205 CCOC(CCOCCF)OCC 34a_100011218310_100011217306 [0,1,1,0,0,0|1,0,0]=3 637 B12R0.205 CCOC(CCOCCF)OCC 7a_100011218310_100011217306 [0,1,1,0,0,0|1,0,0]=3 638 B12R0.205 CCOC(CCOCCN)OCC 34a_100000210304_100000033671 [0,1,1,0,0,0|1,0,0]=3 639 B12R0.205 CCOC(CCOCCO)OCC 34a_100011218310_100000211926 [0,1,1,0,0,0|1,0,0]=3 640 B12R0.205 CCOC(CCOCCO)OCC 7a_100011218310_100000211926 [0,1,1,0,0,0|1,0,0]=3 641 B12R0.205 CCOC(CCOCSC)OCC 34a_100011218310_100011218213 [0,1,1,0,0,0|1,0,0]=3 642 B12R0.205 CCOC(CCSCC#N)OCC 62a_100000033671_100011215382 [0,1,1,0,0,0|1,0,1]=4 643 B12R0.205 CCOC(CCSCC#N)OCC 62a_100011215382_100000033671 [0,1,1,0,0,0|1,0,1]=4 644 B12R0.205 CCOC(CCSCC=O)OCC 62a_100000033671_200015260668 [0,1,1,0,0,0|1,0,1]=4 645 B12R0.205 CCOC(CCSCC=O)OCC 62a_200015260668_100000033671 [0,1,1,0,0,0|1,0,1]=4 646 B12R0.205 CCOC(CCSCCF)OCC 62a_100000033671_100011217306 [0,1,1,0,0,0|1,0,0]=3 647 B12R0.205 CCOC(CCSCCF)OCC 62a_100011217306_100000033671 [0,1,1,0,0,0|1,0,0]=3 648 B12R0.205 CCOC(CCSCCO)OCC 62a_100000033671_100000211926 [0,1,1,0,0,0|1,0,0]=3 649 B12R0.205 CCOC(CCSCCO)OCC 62a_100000211926_100000033671 [0,1,1,0,0,0|1,0,0]=3 650 B12R0.205 CCOC(CCSCOC)OCC 62a_100000033671_100000766300 [0,1,1,0,0,0|1,0,0]=3 651 B12R0.205 CCOC(CCSCOC)OCC 62a_100000766300_100000033671 [0,1,1,0,0,0|1,0,0]=3 652 B12R0.205 CCOC(CCSCSC)OCC 62a_100000033671_100011218213 [0,1,1,0,0,0|1,0,0]=3 653 B12R0.205 CCOC(CCSCSC)OCC 62a_100011218213_100000033671 [0,1,1,0,0,0|1,0,0]=3 654 B12R0.205 CCOC(CNCCCF)OCC 2230a_100015189416_100000210512 [0,1,1,0,0,0|1,0,0]=3 655 B12R0.205 CCOC(CNCCCF)OCC 34a_100000211098_100011934791 [0,1,1,0,0,0|1,0,0]=3 656 B12R0.205 CCOC(CNCCCF)OCC 34a_100015189416_100000210512 [0,1,1,0,0,0|1,0,0]=3 657 B12R0.205 CCOC(CNCCCO)OCC 34a_100000211098_100000230001 [0,1,1,0,0,0|1,0,0]=3 658 B12R0.205 CCOC(CNCCOC)OCC 2230a_100000209980_100000210512 [0,1,1,0,0,0|1,0,0]=3 659 B12R0.205 CCOC(CNCCOC)OCC 34a_100000211098_100011201679 [0,1,1,0,0,0|1,0,0]=3 660 B12R0.205 CCOC(CNCCSC)OCC 2230a_100020590264_100000210512 [0,1,1,0,0,0|1,0,0]=3 661 B12R0.205 CCOC(CNCCSC)OCC 34a_100000211098_100000212216 [0,1,1,0,0,0|1,0,0]=3 662 B12R0.205 CCOC(COCCC#N)OCC 7a_100011216334_100000184422 [0,1,1,0,0,0|1,0,1]=4 663 B12R0.205 CCOC(COCCCBr)OCC 34a_100011217188_100000210512 [0,1,1,0,0,0|1,0,0]=3 664 B12R0.205 CCOC(COCCCCl)OCC 34a_100000230001_100000210512 [0,1,1,0,0,0|1,0,0]=3 665 B12R0.205 CCOC(COCCCF)OCC 34a_100000759539_100000210512 [0,1,1,0,0,0|1,0,0]=3 666 B12R0.205 CCOC(COCCCF)OCC 34a_100011216334_100011934791 [0,1,1,0,0,0|1,0,0]=3 667 B12R0.205 CCOC(COCCCF)OCC 7a_100011216334_100011934791 [0,1,1,0,0,0|1,0,0]=3 668 B12R0.205 CCOC(COCCCN)OCC 34a_100000182051_100000210512 [0,1,1,0,0,0|1,0,0]=3 669 B12R0.205 CCOC(COCCCO)OCC 34a_100011216334_100000230001 [0,1,1,0,0,0|1,0,0]=3 670 B12R0.205 CCOC(COCCCO)OCC 7a_100011216334_100011215043 [0,1,1,0,0,0|1,0,0]=3 671 B12R0.205 CCOC(COCCOC)OCC 34a_100000210237_100000210512 [0,1,1,0,0,0|1,0,0]=3 672 B12R0.205 CCOC(COCCOC)OCC 34a_100011216334_100011201679 [0,1,1,0,0,0|1,0,0]=3 673 B12R0.205 CCOC(COCCOC)OCC 7a_100011216334_100000233755 [0,1,1,0,0,0|1,0,0]=3 674 B12R0.205 CCOC(COCCON)OCC 34a_100000700252_100000210512 [0,1,1,0,0,0|2,0,0]=4 675 B12R0.205 CCOC(COCCSC)OCC 34a_100000230434_100000210512 [0,1,1,0,0,0|1,0,0]=3 676 B12R0.205 CCOC(COCCSC)OCC 34a_100011216334_100000212216 [0,1,1,0,0,0|1,0,0]=3 677 B12R0.205 CCOC(COCCSC)OCC 7a_100000230434_100000210512 [0,1,1,0,0,0|1,0,0]=3 678 B12R0.205 CCOC(COCCSC)OCC 7a_100011216334_100000212216 [0,1,1,0,0,0|1,0,0]=3 679 B12R0.205 CCOC(CSCCC#N)OCC 62a_100000210512_100011215226 [0,1,1,0,0,0|1,0,1]=4 680 B12R0.205 CCOC(CSCCC#N)OCC 62a_100011215226_100000210512 [0,1,1,0,0,0|1,0,1]=4 681 B12R0.205 CCOC(CSCCCF)OCC 62a_100000210512_100011934791 [0,1,1,0,0,0|1,0,0]=3 682 B12R0.205 CCOC(CSCCCF)OCC 62a_100011934791_100000210512 [0,1,1,0,0,0|1,0,0]=3 683 B12R0.205 CCOC(CSCCCO)OCC 62a_100000210512_100011215043 [0,1,1,0,0,0|1,0,0]=3 684 B12R0.205 CCOC(CSCCCO)OCC 62a_100011215043_100000210512 [0,1,1,0,0,0|1,0,0]=3 685 B12R0.205 CCOC(CSCCOC)OCC 62a_100000210512_100000233755 [0,1,1,0,0,0|1,0,0]=3 686 B12R0.205 CCOC(CSCCOC)OCC 62a_100000233755_100000210512 [0,1,1,0,0,0|1,0,0]=3 687 B12R0.205 CCOC(CSCCSC)OCC 62a_100000210512_100000751147 [0,1,1,0,0,0|1,0,0]=3 688 B12R0.205 CCOC(CSCCSC)OCC 62a_100000212216_100000210512 [0,1,1,0,0,0|1,0,0]=3 689 B12R0.205 CCOCCCC(OCC)OCC 34a_100121572206_100000034166 [0,1,1,0,0,0|0,0,0]=2 690 B12R0.205 CCOCSCC(OCC)OCC 62a_100000210512_100000739092 [0,1,1,0,0,0|1,0,0]=3 691 B12R0.205 CCOCSCC(OCC)OCC 62a_100000739092_100000210512 [0,1,1,0,0,0|1,0,0]=3 692 B12R0.246 CCCCCC(CCC)C(=O)CC 1458a_200011416452_100000210202 [0,1,1,0,0,0|2,0,0]=4 693 B12R0.256 CCCCCC(CCC)OC(C)C 34a_200011215058_100000210206 [0,1,1,0,0,0|1,0,0]=3 694 B12R0.256 CCCCCC(CCC)OC(C)C 7a_200011215058_100000210206 [0,1,1,0,0,0|1,0,0]=3 695 B12R0.647 CCCCCC(C)(CCC)OCC 7a_200011290780_100000210202 [0,1,1,0,0,0|1,0,0]=3 696 B12R0.647 CCCCCC(C)(CCC)OCF 7a_200011290780_100015361967 [0,1,1,0,0,0|2,0,0]=4 697 B12R0.647 CCCOCP(=O)(OCC)OCC 34a_100000033165_100000210303 [0,1,1,0,0,0|2,0,0]=4 698 B12R0.647 CCCOCP(=O)(OCC)OCC 34a_100000210258_100010393119 [0,1,1,0,0,0|2,0,0]=4 699 B12R0.647 CCCOC[Si](C)(OCC)OCC 34a_100000210258_100000061259 [0,1,1,0,0,0|1,1,0]=4 700 B12R0.647 CCCSCP(=O)(OCC)OCC 62a_100000210303_100010393119 [0,1,1,0,0,0|2,0,0]=4 701 B12R0.647 CCCSCP(=O)(OCC)OCC 62a_100010393119_100000210303 [0,1,1,0,0,0|2,0,0]=4 702 B12R0.647 CCCSC[Si](C)(OCC)OCC 62a_100000061259_100000210303 [0,1,1,0,0,0|1,1,0]=4 703 B12R0.647 CCCSC[Si](C)(OCC)OCC 62a_100000210303_100000061259 [0,1,1,0,0,0|1,1,0]=4 704 B12R0.647 CCNCCP(=O)(OCC)OCC 2230a_100015525214_100000766911 [0,1,1,0,0,0|2,0,0]=4 705 B12R0.647 CCOCCP(=O)(OCC)OCC 34a_100121572206_100000766911 [0,1,1,0,0,0|2,0,0]=4 706 B12R0.647 CCOP(=O)(CCCNC)OCC 2230a_106832991635_100009827982 [0,1,1,0,0,0|2,0,0]=4 707 B12R0.647 CCOP(=O)(CCCNC)OCC 34a_100102657272_100009827982 [0,1,1,0,0,0|2,0,0]=4 708 B12R0.647 CCOP(=O)(CCCOC)OCC 34a_100138415774_100009827982 [0,1,1,0,0,0|2,0,0]=4 709 B12R0.647 CCOP(=O)(CCCSC)OCC 62a_100009827982_200000210301 [0,1,1,0,0,0|2,0,0]=4 710 B12R0.647 CCOP(=O)(CCCSC)OCC 62a_200000210301_100009827982 [0,1,1,0,0,0|2,0,0]=4 711 B12R0.647 CCOP(=O)(CCCS[13CH3])OCC 62a_100009827982_200025704644 [0,1,1,0,0,0|2,0,0]=4 712 B12R0.647 CCOP(=O)(CCCS[13CH3])OCC 62a_200025704644_100009827982 [0,1,1,0,0,0|2,0,0]=4 713 B12R0.647 CCOP(=O)(CCSCC)OCC 62a_100000210202_100000766911 [0,1,1,0,0,0|2,0,0]=4 714 B12R0.647 CCOP(=O)(CCSCC)OCC 62a_100000766911_100000210202 [0,1,1,0,0,0|2,0,0]=4 715 B12R0.647 CCO[Si](C)(CCCNC)OCC 34a_100102657272_100010162046 [0,1,1,0,0,0|1,1,0]=4 716 B12R0.647 CCO[Si](C)(CCCNC)OCC 7a_106832991635_100010162046 [0,1,1,0,0,0|1,1,0]=4 717 B12R0.647 CCO[Si](C)(CCCOC)OCC 34a_100138415774_100010162046 [0,1,1,0,0,0|1,1,0]=4 718 B12R0.647 CCO[Si](C)(CCCSC)OCC 62a_100010162046_200000210301 [0,1,1,0,0,0|1,1,0]=4 719 B12R0.647 CCO[Si](C)(CCCSC)OCC 62a_200000210301_100010162046 [0,1,1,0,0,0|1,1,0]=4 720 B12R0.647 CCO[Si](C)(CCCS[13CH3])OCC 62a_100010162046_200025704644 [0,1,1,0,0,0|1,1,0]=4 721 B12R0.647 CCO[Si](C)(CCCS[13CH3])OCC 62a_200025704644_100010162046 [0,1,1,0,0,0|1,1,0]=4 722 B12R0.876 C=CCC(CCC)(CCC)OCC 7a_200011218772_100000210202 [0,1,1,0,0,0|1,0,1]=4 723 B12R0.876 CCOC(CNC)(OCC)OCC 34a_100102657272_200000034185 [0,1,1,0,0,0|1,0,0]=3 724 B12R0.876 CCOC(COC)(OCC)OCC 34a_100138415774_200000034185 [0,1,1,0,0,0|1,0,0]=3 725 B12R0.876 CCOC(CSC)(OCC)OCC 62a_200000034185_200000210301 [0,1,1,0,0,0|1,0,0]=3 726 B12R0.876 CCOC(CSC)(OCC)OCC 62a_200000210301_200000034185 [0,1,1,0,0,0|1,0,0]=3 727 B12R0.876 CCOC(CS[13CH3])(OCC)OCC 62a_200000034185_200025704644 [0,1,1,0,0,0|1,0,0]=3 728 B12R0.876 CCOC(CS[13CH3])(OCC)OCC 62a_200025704644_200000034185 [0,1,1,0,0,0|1,0,0]=3 729 B12R0.876 CCO[Si](CNC)(OCC)OCC 34a_100102657272_100000038985 [0,1,1,0,0,0|1,1,0]=4 730 B12R0.876 CCO[Si](COC)(OCC)OCC 34a_100138415774_100000038985 [0,1,1,0,0,0|1,1,0]=4 731 B12R0.876 CCO[Si](CSC)(OCC)OCC 62a_100000038985_200000210301 [0,1,1,0,0,0|1,1,0]=4 732 B12R0.876 CCO[Si](CSC)(OCC)OCC 62a_200000210301_100000038985 [0,1,1,0,0,0|1,1,0]=4 733 B12R0.876 CCO[Si](CS[13CH3])(OCC)OCC 62a_100000038985_200025704644 [0,1,1,0,0,0|1,1,0]=4 734 B12R0.876 CCO[Si](CS[13CH3])(OCC)OCC 62a_200025704644_100000038985 [0,1,1,0,0,0|1,1,0]=4 735 B12R0.355 CCCCC(C)(CCCC)OCC 7a_200000033930_100000210202 [0,1,1,0,0,0|1,0,0]=3 736 B12R0.355 CCCCC(C)(CCCC)OCF 7a_200000033930_100015361967 [0,1,1,0,0,0|2,0,0]=4 737 B12R0.739 CCO[Si](C)(CN(C)CC)OCC 269982a_100000225621_100000061259 [0,1,1,0,0,0|1,1,0]=4 738 B12R0.740 CCO[Si](C)(CNC(C)C)OCC 34a_100138425928_100000061259 [0,1,1,0,0,0|1,1,0]=4 739 B12R0.740 CCO[Si](C)(COC(C)C)OCC 34a_100000212225_100000061259 [0,1,1,0,0,0|1,1,0]=4 740 B12R0.740 CCO[Si](C)(CSC(C)C)OCC 62a_100000061259_100000210206 [0,1,1,0,0,0|1,1,0]=4 741 B12R0.740 CCO[Si](C)(CSC(C)C)OCC 62a_100000210206_100000061259 [0,1,1,0,0,0|1,1,0]=4 742 B12R1.2279 C#CC1(CCCCC1)OCCC 34a_100011215672_100000210303 [1,1,0,0,0,0|0,0,2]=4 743 B12R1.2279 C#CC1(CCCCC1)OCCC 7a_100011215672_100000210303 [1,1,0,0,0,0|0,0,2]=4 744 B12R1.2279 C#CC1(CCCCC1)OCCF 34a_100011215672_100011217306 [1,1,0,0,0,0|0,0,2]=4 745 B12R1.2279 C#CC1(CCCCC1)OCCF 7a_100011215672_100011217306 [1,1,0,0,0,0|0,0,2]=4 746 B12R1.2279 C#CC1(CCCCC1)OCCO 34a_100011215672_100000211926 [1,1,0,0,0,0|0,0,2]=4 747 B12R1.2279 C#CC1(CCCCC1)OCCO 7a_100011215672_100000211926 [1,1,0,0,0,0|0,0,2]=4 748 B12R1.2279 C#CC1(CCCCC1)OCSC 34a_100011215672_100011218213 [1,1,0,0,0,0|0,0,2]=4 749 B12R1.2279 C#CCOC1(CCCCC1)CC 34a_100011216009_100000184674 [1,1,0,0,0,0|0,0,1]=3 750 B12R1.2279 C#CCOC1(CCCCC1)CC 7a_100011216009_100000038162 [1,1,0,0,0,0|0,0,1]=3 751 B12R1.2279 C#CCOC1(CCCCC1)CN 34a_100000748649_100000184674 [1,1,0,0,0,0|1,0,1]=4 752 B12R1.2279 C=CC1(CCCCC1)OCCC 34a_200011934219_100000210303 [1,1,0,0,0,0|0,0,2]=4 753 B12R1.2279 C=CC1(CCCCC1)OCCC 7a_200011934219_100000210303 [1,1,0,0,0,0|0,0,2]=4 754 B12R1.2279 C=CC1(CCCCC1)OCCF 34a_200011934219_100011217306 [1,1,0,0,0,0|0,0,2]=4 755 B12R1.2279 C=CC1(CCCCC1)OCCF 7a_200011934219_100011217306 [1,1,0,0,0,0|0,0,2]=4 756 B12R1.2279 C=CC1(CCCCC1)OCCO 34a_200011934219_100000211926 [1,1,0,0,0,0|0,0,2]=4 757 B12R1.2279 C=CC1(CCCCC1)OCCO 7a_200011934219_100000211926 [1,1,0,0,0,0|0,0,2]=4 758 B12R1.2279 C=CC1(CCCCC1)OCSC 34a_200011934219_100011218213 [1,1,0,0,0,0|0,0,2]=4 759 B12R1.2279 C=CCOC1(CCCCC1)CC 34a_100011216009_100015514636 [1,1,0,0,0,0|0,0,1]=3 760 B12R1.2279 C=CCOC1(CCCCC1)CC 7a_100011216009_100015514636 [1,1,0,0,0,0|0,0,1]=3 761 B12R1.2279 C=CCOC1(CCCCC1)CN 34a_100000748649_100015514636 [1,1,0,0,0,0|1,0,1]=4 762 B12R1.2279 CCC1(CCCCC1)OCC#N 7a_100011216009_100011215382 [1,1,0,0,0,0|0,0,1]=3 763 B12R1.2279 CCC1(CCCCC1)OCC=O 34a_100011216009_200009817547 [1,1,0,0,0,0|0,0,1]=3 764 B12R1.2279 CCC1(CCCCC1)OCC=O 7a_100011216009_200015260668 [1,1,0,0,0,0|0,0,1]=3 765 B12R1.2279 CCC1(CCCCC1)OCCF 34a_100011216009_100011217306 [1,1,0,0,0,0|0,0,0]=2 766 B12R1.2279 CCC1(CCCCC1)OCCF 7a_100011216009_100011217306 [1,1,0,0,0,0|0,0,0]=2 767 B12R1.2279 CCC1(CCCCC1)OCCO 34a_100011216009_100000211926 [1,1,0,0,0,0|0,0,0]=2 768 B12R1.2279 CCC1(CCCCC1)OCCO 7a_100011216009_100000211926 [1,1,0,0,0,0|0,0,0]=2 769 B12R1.2279 CCC1(CCCCC1)OCSC 34a_100011216009_100011218213 [1,1,0,0,0,0|0,0,0]=2 770 B12R1.2279 CCCCC1(CCCCC1)OC 34a_200011218111_200000210301 [1,1,0,0,0,0|1,0,0]=3 771 B12R1.2279 CCCCC1(CCCCC1)OC 7a_200011218111_200000210301 [1,1,0,0,0,0|1,0,0]=3 772 B12R1.2279 CCCCC1(CCCCC1)O[13CH3] 34a_200011218111_200025704644 [1,1,0,0,0,0|1,0,0]=3 773 B12R1.2279 CCCCC1(CCCCC1)O[13CH3] 7a_200011218111_200025704644 [1,1,0,0,0,0|1,0,0]=3 774 B12R1.2279 CCCNC1(CCCCC1)CO 2230a_100000740034_100000210303 [1,1,0,0,0,0|2,0,0]=4 775 B12R1.2279 CCCNC1(CCCCC1)CO 34a_100000740034_100000210303 [1,1,0,0,0,0|2,0,0]=4 776 B12R1.2279 CCCOC1(CCCCC1)CC 34a_100011216009_100000210303 [1,1,0,0,0,0|0,0,0]=2 777 B12R1.2279 CCCOC1(CCCCC1)CC 7a_100011216009_100000210303 [1,1,0,0,0,0|0,0,0]=2 778 B12R1.2279 CCCOC1(CCCCC1)CN 34a_100000748649_100000210303 [1,1,0,0,0,0|1,0,0]=3 779 B12R1.2279 CCCOC1(CCOCC1)CN 34a_100000704115_100000210303 [1,1,0,0,0,0|2,0,0]=4 780 B12R1.2279 CCCOC1(CCSCC1)CN 34a_100000758141_100000210303 [1,1,0,0,0,0|2,0,0]=4 781 B12R1.2279 CCOCC1(CCCCC1)C#N 34a_100121572206_100011219015 [1,1,0,0,0,0|1,0,1]=4 782 B12R1.2279 CCOCC1(CCOCC1)CN 34a_100000691804_100000210202 [1,1,0,0,0,0|2,0,0]=4 783 B12R1.2279 CCOCC1(COCOC1)CC 7a_200000042503_100000210202 [1,1,0,0,0,0|2,0,0]=4 784 B12R1.2279 COCNC1(CCCCC1)CO 2230a_100000740034_100000766300 [1,1,0,0,0,0|2,0,0]=4 785 B12R1.2279 CSCNC1(CCCCC1)CO 2230a_100000740034_100011218213 [1,1,0,0,0,0|2,0,0]=4 786 B12R1.2279 CSCNC1(CCCCC1)CO 34a_100000740034_100011218213 [1,1,0,0,0,0|2,0,0]=4 787 B12R1.2279 CSCOC1(CCCCC1)CN 34a_100000748649_100011218213 [1,1,0,0,0,0|1,0,0]=3 788 B12R1.2279 CSCOC1(CCOCC1)CN 34a_100000704115_100011218213 [1,1,0,0,0,0|2,0,0]=4 789 B12R1.2279 CSCOC1(CCSCC1)CN 34a_100000758141_100011218213 [1,1,0,0,0,0|2,0,0]=4 790 B12R1.2279 NCC1(CCCCC1)OCC=O 34a_100000748649_200009817547 [1,1,0,0,0,0|1,0,1]=4 791 B12R1.2279 NCC1(CCCCC1)OCCF 34a_100000748649_100011217306 [1,1,0,0,0,0|1,0,0]=3 792 B12R1.2279 NCC1(CCCCC1)OCCO 34a_100000748649_100000211926 [1,1,0,0,0,0|1,0,0]=3 793 B12R1.2279 NCC1(CCOCC1)OCCF 34a_100000704115_100011217306 [1,1,0,0,0,0|2,0,0]=4 794 B12R1.2279 NCC1(CCOCC1)OCCO 34a_100000704115_100000211926 [1,1,0,0,0,0|2,0,0]=4 795 B12R1.2279 NCC1(CCSCC1)OCCF 34a_100000758141_100011217306 [1,1,0,0,0,0|2,0,0]=4 796 B12R1.2279 NCC1(CCSCC1)OCCO 34a_100000758141_100000211926 [1,1,0,0,0,0|2,0,0]=4 797 B12R1.2279 OCC1(CCCCC1)NCCF 2230a_100000740034_100011217306 [1,1,0,0,0,0|2,0,0]=4 798 B12R1.2279 OCC1(CCCCC1)NCCF 34a_100000740034_100011217306 [1,1,0,0,0,0|2,0,0]=4 799 B12R1.2279 OCCNC1(CCCCC1)CO 2230a_100000740034_100000211926 [1,1,0,0,0,0|2,0,0]=4 800 B12R1.2279 OCCNC1(CCCCC1)CO 34a_100000740034_100000211926 [1,1,0,0,0,0|2,0,0]=4 801 B12R1.2627 CC(C)C1(CCCCC1)OCF 34a_100011345648_100015361967 [1,1,0,0,0,0|1,0,0]=3 802 B12R1.2627 CC(C)C1(CCCCC1)OCF 7a_100011345648_100015361967 [1,1,0,0,0,0|1,0,0]=3 803 B12R1.2627 CCOC1(CCCCC1)C(C)C 34a_100011345648_100000210202 [1,1,0,0,0,0|0,0,0]=2 804 B12R1.2627 CCOC1(CCCCC1)C(C)C 7a_100011345648_100000210202 [1,1,0,0,0,0|0,0,0]=2 805 B12R1.3454 COC(=O)C1(CCCCC1)OC 34a_100011242881_200000210301 [1,1,0,0,0,0|2,0,0]=4 806 B12R1.3454 COC(=O)C1(CCCCC1)OC 34a_100138415774_100000700894 [1,1,0,0,0,0|2,0,0]=4 807 B12R1.3454 COC(=O)C1(CCCCC1)OC 7a_100011242881_200000210301 [1,1,0,0,0,0|2,0,0]=4 808 B12R1.3454 COC(=O)C1(CCCCC1)O[13CH3] 34a_100011242881_200025704644 [1,1,0,0,0,0|2,0,0]=4 809 B12R1.3454 COC(=O)C1(CCCCC1)O[13CH3] 7a_100011242881_200025704644 [1,1,0,0,0,0|2,0,0]=4 810 B12R1.3862 C#CC1(CCCCC1)OC(C)C 34a_100011215672_100000210206 [1,1,0,0,0,0|0,0,2]=4 811 B12R1.3862 C#CC1(CCCCC1)OC(C)C 7a_100011215672_100000210206 [1,1,0,0,0,0|0,0,2]=4 812 B12R1.3862 C=CC1(CCCCC1)OC(C)C 34a_200011934219_100000210206 [1,1,0,0,0,0|0,0,2]=4 813 B12R1.3862 C=CC1(CCCCC1)OC(C)C 7a_200011934219_100000210206 [1,1,0,0,0,0|0,0,2]=4 814 B12R1.3862 CC(C)NC1(CCCCC1)CO 2230a_100000740034_100000210206 [1,1,0,0,0,0|2,0,0]=4 815 B12R1.3862 CC(C)NC1(CCCCC1)CO 34a_100000740034_100000210206 [1,1,0,0,0,0|2,0,0]=4 816 B12R1.3862 CC(C)OC1(CCCCC1)CN 34a_100000748649_100000210206 [1,1,0,0,0,0|1,0,0]=3 817 B12R1.3862 CC(C)OC1(CCOCC1)CN 34a_100000704115_100000210206 [1,1,0,0,0,0|2,0,0]=4 818 B12R1.3862 CC(C)OC1(CCSCC1)CN 34a_100000758141_100000210206 [1,1,0,0,0,0|2,0,0]=4 819 B12R1.3862 CCC1(CCCCC1)OC(C)C 34a_100011216009_100000210206 [1,1,0,0,0,0|0,0,0]=2 820 B12R1.3862 CCC1(CCCCC1)OC(C)C 7a_100011216009_100000210206 [1,1,0,0,0,0|0,0,0]=2 821 B12R1.2267 C#CCOC1(CCCC1)CCC 34a_200011216196_100000184674 [0,1,0,0,1,0|1,0,1]=4 822 B12R1.2267 C#CCOC1(CCCC1)CCC 7a_200011216196_100000038162 [0,1,0,0,1,0|1,0,1]=4 823 B12R1.2267 C=CCOC1(CCCC1)CCC 34a_200011216196_100015514636 [0,1,0,0,1,0|1,0,1]=4 824 B12R1.2267 C=CCOC1(CCCC1)CCC 7a_200011216196_100015514636 [0,1,0,0,1,0|1,0,1]=4 825 B12R1.2267 CCCC1(CCCC1)OCC#N 7a_200011216196_100011215382 [0,1,0,0,1,0|1,0,1]=4 826 B12R1.2267 CCCC1(CCCC1)OCC=O 34a_200011216196_200009817547 [0,1,0,0,1,0|1,0,1]=4 827 B12R1.2267 CCCC1(CCCC1)OCC=O 7a_200011216196_200015260668 [0,1,0,0,1,0|1,0,1]=4 828 B12R1.2267 CCCC1(CCCC1)OCCF 34a_200011216196_100011217306 [0,1,0,0,1,0|1,0,0]=3 829 B12R1.2267 CCCC1(CCCC1)OCCF 7a_200011216196_100011217306 [0,1,0,0,1,0|1,0,0]=3 830 B12R1.2267 CCCC1(CCCC1)OCCO 34a_200011216196_100000211926 [0,1,0,0,1,0|1,0,0]=3 831 B12R1.2267 CCCC1(CCCC1)OCCO 7a_200011216196_100000211926 [0,1,0,0,1,0|1,0,0]=3 832 B12R1.2267 CCCC1(CCCC1)OCSC 34a_200011216196_100011218213 [0,1,0,0,1,0|1,0,0]=3 833 B12R1.2267 CCCOC1(CCCC1)CCC 34a_200011216196_100000210303 [0,1,0,0,1,0|1,0,0]=3 834 B12R1.2267 CCCOC1(CCCC1)CCC 7a_200011216196_100000210303 [0,1,0,0,1,0|1,0,0]=3 835 B12R1.2267 CCCOC1(CCCC1)CCN 34a_100000719956_100000210303 [0,1,0,0,1,0|2,0,0]=4 836 B12R1.2267 CSCOC1(CCCC1)CCN 34a_100000719956_100011218213 [0,1,0,0,1,0|2,0,0]=4 837 B12R1.2267 NCCC1(CCCC1)OCCF 34a_100000719956_100011217306 [0,1,0,0,1,0|2,0,0]=4 838 B12R1.2267 NCCC1(CCCC1)OCCO 34a_100000719956_100000211926 [0,1,0,0,1,0|2,0,0]=4 839 B12R1.2612 CC(C)OC1(CCCC1)CCN 34a_100000719956_100000210206 [0,1,0,0,1,0|2,0,0]=4 840 B12R1.2612 CCCC1(CCCC1)OC(C)C 34a_200011216196_100000210206 [0,1,0,0,1,0|1,0,0]=3 841 B12R1.2612 CCCC1(CCCC1)OC(C)C 7a_200011216196_100000210206 [0,1,0,0,1,0|1,0,0]=3 842 B14R1.10689 CCCOC1(CCCCC1)C(=O)OC 34a_100000210258_100000700894 [0,2,0,0,0,0|2,0,0]=4 843 B14R1.10689 CCCOC1(CCCCC1)C(=O)OC 34a_100011242881_100000210303 [0,2,0,0,0,0|2,0,0]=4 844 B14R1.10689 CCCOC1(CCCCC1)C(=O)OC 7a_100011242881_100000210303 [0,2,0,0,0,0|2,0,0]=4 845 B14R1.10689 COC(=O)C1(CCCCC1)OCCBr 34a_100000211926_100000700894 [0,2,0,0,0,0|2,0,0]=4 846 B14R1.10689 COC(=O)C1(CCCCC1)OCCF 34a_100011242881_100011217306 [0,2,0,0,0,0|2,0,0]=4 847 B14R1.10689 COC(=O)C1(CCCCC1)OCCF 7a_100011242881_100011217306 [0,2,0,0,0,0|2,0,0]=4 848 B14R1.10689 COC(=O)C1(CCCCC1)OCCN 34a_100000210304_100000700894 [0,2,0,0,0,0|2,0,0]=4 849 B14R1.10689 COC(=O)C1(CCCCC1)OCCO 34a_100011242881_100000211926 [0,2,0,0,0,0|2,0,0]=4 850 B14R1.10689 COC(=O)C1(CCCCC1)OCCO 7a_100011242881_100000211926 [0,2,0,0,0,0|2,0,0]=4 851 B14R1.10689 COC(=O)C1(CCCCC1)OCSC 34a_100011242881_100011218213 [0,2,0,0,0,0|2,0,0]=4 852 B14R1.10691 CC(C)CC1(CCCCC1)COCF 34a_100012399753_100015361967 [0,2,0,0,0,0|2,0,0]=4 853 B14R1.10691 CC(C)CC1(CCCCC1)COCF 7a_100012399753_100015361967 [0,2,0,0,0,0|2,0,0]=4 854 B14R1.10691 CCCCC1(CCCCC1)OC(C)C 34a_200011218111_100000210206 [0,2,0,0,0,0|1,0,0]=3 855 B14R1.10691 CCCCC1(CCCCC1)OC(C)C 7a_200011218111_100000210206 [0,2,0,0,0,0|1,0,0]=3 856 B14R1.10691 CCOCC1(CCCCC1)CC(C)C 34a_100012399753_100000210202 [0,2,0,0,0,0|1,0,0]=3 857 B14R1.10691 CCOCC1(CCCCC1)CC(C)C 7a_100012399753_100000210202 [0,2,0,0,0,0|1,0,0]=3 858 B14R1.10693 C#CCOC1(CCCCC1)CCCC 34a_200011218111_100000184674 [0,2,0,0,0,0|1,0,1]=4 859 B14R1.10693 C#CCOC1(CCCCC1)CCCC 7a_200011218111_100000038162 [0,2,0,0,0,0|1,0,1]=4 860 B14R1.10693 C=CCOC1(CCCCC1)CCCC 34a_200011218111_100015514636 [0,2,0,0,0,0|1,0,1]=4 861 B14R1.10693 C=CCOC1(CCCCC1)CCCC 7a_200011218111_100015514636 [0,2,0,0,0,0|1,0,1]=4 862 B14R1.10693 CCCCC1(CCCCC1)OCC#N 7a_200011218111_100011215382 [0,2,0,0,0,0|1,0,1]=4 863 B14R1.10693 CCCCC1(CCCCC1)OCC=O 34a_200011218111_200009817547 [0,2,0,0,0,0|1,0,1]=4 864 B14R1.10693 CCCCC1(CCCCC1)OCC=O 7a_200011218111_200015260668 [0,2,0,0,0,0|1,0,1]=4 865 B14R1.10693 CCCCC1(CCCCC1)OCCC 34a_200011218111_100000210303 [0,2,0,0,0,0|1,0,0]=3 866 B14R1.10693 CCCCC1(CCCCC1)OCCC 7a_200011218111_100000210303 [0,2,0,0,0,0|1,0,0]=3 867 B14R1.10693 CCCCC1(CCCCC1)OCCF 34a_200011218111_100011217306 [0,2,0,0,0,0|1,0,0]=3 868 B14R1.10693 CCCCC1(CCCCC1)OCCF 7a_200011218111_100011217306 [0,2,0,0,0,0|1,0,0]=3 869 B14R1.10693 CCCCC1(CCCCC1)OCCO 34a_200011218111_100000211926 [0,2,0,0,0,0|1,0,0]=3 870 B14R1.10693 CCCCC1(CCCCC1)OCCO 7a_200011218111_100000211926 [0,2,0,0,0,0|1,0,0]=3 871 B14R1.10693 CCCCC1(CCCCC1)OCSC 34a_200011218111_100011218213 [0,2,0,0,0,0|1,0,0]=3 872 B14R1.12777 C=C(C)COC1(CCCCC1)C#CC 34a_200011215096_100000748629 [0,2,0,0,0,0|1,0,1]=4 873 B14R1.12777 C=C(C)COC1(CCCCC1)C#CC 7a_200011215096_100000748629 [0,2,0,0,0,0|1,0,1]=4 874 B14R1.12777 C=C(C)COC1(CCCCC1)CCC 34a_200011215981_100000748629 [0,2,0,0,0,0|1,0,0]=3 875 B14R1.12777 C=C(C)COC1(CCCCC1)CCC 7a_200011215981_100000748629 [0,2,0,0,0,0|1,0,0]=3 876 B14R1.12777 C=C(C)COC1(CCCCC1)CCN 34a_100102740465_100000748629 [0,2,0,0,0,0|2,0,0]=4 877 B14R1.12777 C=C(F)COC1(CCCCC1)CCC 34a_200011215981_100009893438 [0,2,0,0,0,0|1,0,1]=4 878 B14R1.12777 C=C(F)COC1(CCCCC1)CCC 7a_200011215981_100000042424 [0,2,0,0,0,0|1,0,1]=4 879 B14R1.12777 CC#CC1(CCCCC1)OCC(C)C 34a_200011215096_100000210624 [0,2,0,0,0,0|1,0,1]=4 880 B14R1.12777 CC#CC1(CCCCC1)OCC(C)C 7a_200011215096_100000210760 [0,2,0,0,0,0|1,0,1]=4 881 B14R1.12777 CC#CC1(CCCCC1)OCC(C)O 34a_200011215096_100011218427 [0,2,0,0,0,0|1,0,1]=4 882 B14R1.12777 CC#CC1(CCCCC1)OCC(C)O 7a_200011215096_100011218427 [0,2,0,0,0,0|1,0,1]=4 883 B14R1.12777 CC#CC1(CCCCC1)OCC(F)F 34a_200011215096_100011934356 [0,2,0,0,0,0|1,0,1]=4 884 B14R1.12777 CC#CC1(CCCCC1)OCC(F)F 7a_200011215096_100011934356 [0,2,0,0,0,0|1,0,1]=4 885 B14R1.12777 CC#CC1(CCCCC1)OC[C@@H](C)O 34a_200011215096_100009817552 [0,2,0,0,0,0|1,0,1]=4 886 B14R1.12777 CC#CC1(CCCCC1)OC[C@@H](C)O 7a_200011215096_100009817552 [0,2,0,0,0,0|1,0,1]=4 887 B14R1.12777 CC(C)COC1(CCCCC1)CCN 34a_100102740465_100000210624 [0,2,0,0,0,0|2,0,0]=4 888 B14R1.12777 CC(O)COC1(CCCCC1)CCN 34a_100102740465_100011218427 [0,2,0,0,0,0|2,0,0]=4 889 B14R1.12777 CCCC1(CCCCC1)OCC(=O)N 34a_200011215981_100000187820 [0,2,0,0,0,0|1,0,1]=4 890 B14R1.12777 CCCC1(CCCCC1)OCC(=O)N 7a_200011215981_100000187820 [0,2,0,0,0,0|1,0,1]=4 891 B14R1.12777 CCCC1(CCCCC1)OCC(=O)[O-] 34a_200011215981_100020667443 [0,2,0,0,0,0|1,0,1]=4 892 B14R1.12777 CCCC1(CCCCC1)OCC(C)C 34a_200011215981_100000210624 [0,2,0,0,0,0|1,0,0]=3 893 B14R1.12777 CCCC1(CCCCC1)OCC(C)C 7a_200011215981_100000210760 [0,2,0,0,0,0|1,0,0]=3 894 B14R1.12777 CCCC1(CCCCC1)OCC(C)O 34a_200011215981_100011218427 [0,2,0,0,0,0|1,0,0]=3 895 B14R1.12777 CCCC1(CCCCC1)OCC(C)O 7a_200011215981_100011218427 [0,2,0,0,0,0|1,0,0]=3 896 B14R1.12777 CCCC1(CCCCC1)OCC(F)F 34a_200011215981_100011934356 [0,2,0,0,0,0|1,0,0]=3 897 B14R1.12777 CCCC1(CCCCC1)OCC(F)F 7a_200011215981_100011934356 [0,2,0,0,0,0|1,0,0]=3 898 B14R1.12777 CCCC1(CCCCC1)OC[C@@H](C)O 34a_200011215981_100009817552 [0,2,0,0,0,0|1,0,0]=3 899 B14R1.12777 CCCC1(CCCCC1)OC[C@@H](C)O 7a_200011215981_100009817552 [0,2,0,0,0,0|1,0,0]=3 900 B14R1.12777 CCCC1(CCCCC1)OC[N+](=O)[O-] 34a_200011215981_100000761209 [0,2,0,0,0,0|2,0,0]=4 901 B14R1.12777 C[C@@H](O)COC1(CCCCC1)CCN 34a_100102740465_100009817552 [0,2,0,0,0,0|2,0,0]=4 902 B14R1.12777 NCCC1(CCCCC1)OCC(F)F 34a_100102740465_100011934356 [0,2,0,0,0,0|2,0,0]=4 903 B14R1.17037 C#CCCOC1(CCCCC1)C#CC 34a_200011215096_100000688953 [0,2,0,0,0,0|1,0,1]=4 904 B14R1.17037 C#CCCOC1(CCCCC1)C#CC 7a_200011215096_100000688953 [0,2,0,0,0,0|1,0,1]=4 905 B14R1.17037 C#CCCOC1(CCCCC1)CCC 34a_200011215981_100000688953 [0,2,0,0,0,0|1,0,0]=3 906 B14R1.17037 C#CCCOC1(CCCCC1)CCC 7a_200011215981_100000688953 [0,2,0,0,0,0|1,0,0]=3 907 B14R1.17037 C#CCCOC1(CCCCC1)CCN 34a_100102740465_100000688953 [0,2,0,0,0,0|2,0,0]=4 908 B14R1.17037 C/C=C/COC1(CCCCC1)CCC 34a_200011215981_100102629194 [0,2,0,0,0,0|1,0,0]=3 909 B14R1.17037 C/C=C/COC1(CCCCC1)CCC 7a_200011215981_100102629194 [0,2,0,0,0,0|1,0,0]=3 910 B14R1.17037 C/C=C/COC1(CCCCC1)CCN 34a_100102740465_100102629194 [0,2,0,0,0,0|2,0,0]=4 911 B14R1.17037 C=CCCOC1(CCCCC1)C#CC 34a_200011215096_100000754431 [0,2,0,0,0,0|1,0,1]=4 912 B14R1.17037 C=CCCOC1(CCCCC1)C#CC 7a_200011215096_100000754431 [0,2,0,0,0,0|1,0,1]=4 913 B14R1.17037 C=CCCOC1(CCCCC1)CCC 34a_200011215981_100000754431 [0,2,0,0,0,0|1,0,0]=3 914 B14R1.17037 C=CCCOC1(CCCCC1)CCC 7a_200011215981_100000754431 [0,2,0,0,0,0|1,0,0]=3 915 B14R1.17037 C=CCCOC1(CCCCC1)CCN 34a_100102740465_100000754431 [0,2,0,0,0,0|2,0,0]=4 916 B14R1.17037 CC#CC1(CCCCC1)OC/C=C/C 34a_200011215096_100102629194 [0,2,0,0,0,0|1,0,1]=4 917 B14R1.17037 CC#CC1(CCCCC1)OC/C=C/C 7a_200011215096_100102629194 [0,2,0,0,0,0|1,0,1]=4 918 B14R1.17037 CC#CC1(CCCCC1)OCC=CC 34a_200011215096_100000070051 [0,2,0,0,0,0|1,0,1]=4 919 B14R1.17037 CC#CC1(CCCCC1)OCC=CC 7a_200011215096_100000070051 [0,2,0,0,0,0|1,0,1]=4 920 B14R1.17037 CC#CC1(CCCCC1)OCCC#N 7a_200011215096_100000184422 [0,2,0,0,0,0|1,0,1]=4 921 B14R1.17037 CC#CC1(CCCCC1)OCCCC 34a_200011215096_100000210210 [0,2,0,0,0,0|1,0,1]=4 922 B14R1.17037 CC#CC1(CCCCC1)OCCCC 7a_200011215096_100000210211 [0,2,0,0,0,0|1,0,1]=4 923 B14R1.17037 CC#CC1(CCCCC1)OCCCF 34a_200011215096_100011934791 [0,2,0,0,0,0|1,0,1]=4 924 B14R1.17037 CC#CC1(CCCCC1)OCCCF 7a_200011215096_100011934791 [0,2,0,0,0,0|1,0,1]=4 925 B14R1.17037 CC#CC1(CCCCC1)OCCCO 34a_200011215096_100000230001 [0,2,0,0,0,0|1,0,1]=4 926 B14R1.17037 CC#CC1(CCCCC1)OCCCO 7a_200011215096_100011215043 [0,2,0,0,0,0|1,0,1]=4 927 B14R1.17037 CC#CC1(CCCCC1)OCCOC 34a_200011215096_100011201679 [0,2,0,0,0,0|1,0,1]=4 928 B14R1.17037 CC#CC1(CCCCC1)OCCOC 7a_200011215096_100000233755 [0,2,0,0,0,0|1,0,1]=4 929 B14R1.17037 CC#CC1(CCCCC1)OCCSC 34a_200011215096_100000212216 [0,2,0,0,0,0|1,0,1]=4 930 B14R1.17037 CC#CC1(CCCCC1)OCCSC 7a_200011215096_100000212216 [0,2,0,0,0,0|1,0,1]=4 931 B14R1.17037 CC#CCOC1(CCCCC1)C#CC 34a_200011215096_100000748600 [0,2,0,0,0,0|1,0,1]=4 932 B14R1.17037 CC#CCOC1(CCCCC1)C#CC 7a_200011215096_100000748600 [0,2,0,0,0,0|1,0,1]=4 933 B14R1.17037 CC#CCOC1(CCCCC1)CCC 34a_200011215981_100000748600 [0,2,0,0,0,0|1,0,0]=3 934 B14R1.17037 CC#CCOC1(CCCCC1)CCC 7a_200011215981_100000748600 [0,2,0,0,0,0|1,0,0]=3 935 B14R1.17037 CC#CCOC1(CCCCC1)CCN 34a_100102740465_100000748600 [0,2,0,0,0,0|2,0,0]=4 936 B14R1.17037 CC=CCOC1(CCCCC1)CCC 34a_200011215981_100000070051 [0,2,0,0,0,0|1,0,0]=3 937 B14R1.17037 CC=CCOC1(CCCCC1)CCC 7a_200011215981_100000070051 [0,2,0,0,0,0|1,0,0]=3 938 B14R1.17037 CC=CCOC1(CCCCC1)CCN 34a_100102740465_100000070051 [0,2,0,0,0,0|2,0,0]=4 939 B14R1.17037 CCCC1(CCCCC1)OCCC#N 7a_200011215981_100000184422 [0,2,0,0,0,0|1,0,0]=3 940 B14R1.17037 CCCC1(CCCCC1)OCCCF 34a_200011215981_100011934791 [0,2,0,0,0,0|1,0,0]=3 941 B14R1.17037 CCCC1(CCCCC1)OCCCF 7a_200011215981_100011934791 [0,2,0,0,0,0|1,0,0]=3 942 B14R1.17037 CCCC1(CCCCC1)OCCCO 34a_200011215981_100000230001 [0,2,0,0,0,0|1,0,0]=3 943 B14R1.17037 CCCC1(CCCCC1)OCCCO 7a_200011215981_100011215043 [0,2,0,0,0,0|1,0,0]=3 944 B14R1.17037 CCCC1(CCCCC1)OCCOC 34a_200011215981_100011201679 [0,2,0,0,0,0|1,0,0]=3 945 B14R1.17037 CCCC1(CCCCC1)OCCOC 7a_200011215981_100000233755 [0,2,0,0,0,0|1,0,0]=3 946 B14R1.17037 CCCC1(CCCCC1)OCCSC 34a_200011215981_100000212216 [0,2,0,0,0,0|1,0,0]=3 947 B14R1.17037 CCCC1(CCCCC1)OCCSC 7a_200011215981_100000212216 [0,2,0,0,0,0|1,0,0]=3 948 B14R1.17037 CCCCOC1(CCCCC1)CCC 34a_200011215981_100000210210 [0,2,0,0,0,0|1,0,0]=3 949 B14R1.17037 CCCCOC1(CCCCC1)CCC 7a_200011215981_100000210211 [0,2,0,0,0,0|1,0,0]=3 950 B14R1.17037 CCCCOC1(CCCCC1)CCN 34a_100102740465_100000210210 [0,2,0,0,0,0|2,0,0]=4 951 B14R1.17037 COCCOC1(CCCCC1)CCN 34a_100102740465_100011201679 [0,2,0,0,0,0|2,0,0]=4 952 B14R1.17037 CSCCOC1(CCCCC1)CCN 34a_100102740465_100000212216 [0,2,0,0,0,0|2,0,0]=4 953 B14R1.17037 NCCC1(CCCCC1)OCCCF 34a_100102740465_100011934791 [0,2,0,0,0,0|2,0,0]=4 954 B14R1.17037 NCCC1(CCCCC1)OCCCO 34a_100102740465_100000230001 [0,2,0,0,0,0|2,0,0]=4 955 B14R1.17346 C#CC(C)OC1(CCCCC1)C#CC 34a_200011215096_200000035995 [0,2,0,0,0,0|1,0,1]=4 956 B14R1.17346 C#CC(C)OC1(CCCCC1)CCC 34a_200011215981_200000035995 [0,2,0,0,0,0|1,0,0]=3 957 B14R1.17346 C#CC(C)OC1(CCCCC1)CCN 34a_100102740465_200000035995 [0,2,0,0,0,0|2,0,0]=4 958 B14R1.17346 CC#CC1(CCCCC1)OC(C)C#N 7a_200011215096_100000703298 [0,2,0,0,0,0|1,0,1]=4 959 B14R1.17346 CC#CC1(CCCCC1)OC(C)CC 34a_200011215096_100011215416 [0,2,0,0,0,0|1,0,1]=4 960 B14R1.17346 CC#CC1(CCCCC1)OC(C)CC 7a_200011215096_100000758301 [0,2,0,0,0,0|1,0,1]=4 961 B14R1.17346 CC#CC1(CCCCC1)OC(C)CO 34a_200011215096_100012180447 [0,2,0,0,0,0|1,0,1]=4 962 B14R1.17346 CC#CC1(CCCCC1)OC(C)CO 7a_200011215096_100012180447 [0,2,0,0,0,0|1,0,1]=4 963 B14R1.17346 CC(CO)OC1(CCCCC1)CCN 34a_100102740465_100012180447 [0,2,0,0,0,0|2,0,0]=4 964 B14R1.17346 CCC(C)OC1(CCCCC1)CCN 34a_100102740465_100011215416 [0,2,0,0,0,0|2,0,0]=4 965 B14R1.17346 CCCC1(CCCCC1)OC(C)C#N 7a_200011215981_100000703298 [0,2,0,0,0,0|1,0,0]=3 966 B14R1.17346 CCCC1(CCCCC1)OC(C)CC 34a_200011215981_100011215416 [0,2,0,0,0,0|1,0,0]=3 967 B14R1.17346 CCCC1(CCCCC1)OC(C)CC 7a_200011215981_100000758301 [0,2,0,0,0,0|1,0,0]=3 968 B14R1.17346 CCCC1(CCCCC1)OC(C)CO 34a_200011215981_100012180447 [0,2,0,0,0,0|1,0,0]=3 969 B14R1.17346 CCCC1(CCCCC1)OC(C)CO 7a_200011215981_100012180447 [0,2,0,0,0,0|1,0,0]=3 970 B14R1.18834 CCOC(=O)C1(CCCCC1)OCC 34a_200011213212_100000210202 [0,2,0,0,0,0|0,0,0]=2 971 B14R1.18834 CCOC(=O)C1(CCCCC1)OCC 7a_200011213212_100000210202 [0,2,0,0,0,0|0,0,0]=2 972 B14R1.18834 CCOC(=O)C1(CCCCC1)OCF 34a_200011213212_100015361967 [0,2,0,0,0,0|1,0,0]=3 973 B14R1.18834 CCOC(=O)C1(CCCCC1)OCF 7a_200011213212_100015361967 [0,2,0,0,0,0|1,0,0]=3 974 B14R1.19512 COC(=O)C1(CCCCC1)OC(C)C 34a_100000212225_100000700894 [0,2,0,0,0,0|2,0,0]=4 975 B14R1.19512 COC(=O)C1(CCCCC1)OC(C)C 34a_100011242881_100000210206 [0,2,0,0,0,0|2,0,0]=4 976 B14R1.19512 COC(=O)C1(CCCCC1)OC(C)C 7a_100011242881_100000210206 [0,2,0,0,0,0|2,0,0]=4 977 B14R1.17345 CC#CC1(CCCCC1)OC(C)(C)C 34a_200011215096_100000210625 [0,2,0,0,0,0|1,0,1]=4 978 B14R1.17345 CC(C)(C)OC1(CCCCC1)CCN 34a_100102740465_100000210625 [0,2,0,0,0,0|2,0,0]=4 979 B14R1.17345 CCCC1(CCCCC1)OC(C)(C)C 34a_200011215981_100000210625 [0,2,0,0,0,0|1,0,0]=3 980 B14R1.17345 CCCC1(CCCCC1)OC(F)(F)F 34a_200011215981_200103152311 [0,2,0,0,0,0|2,0,0]=4 981 B14R1.17345 CCCC1(CCCCC1)OC(F)(F)F 7a_200011215981_200000243211 [0,2,0,0,0,0|2,0,0]=4 982 B12R1.173 CCNC1CCCCCCCC1 270004a_100015525214_100000038600 [0,0,1,1,0,0|2,0,0]=4 983 B12R1.278 CCCN1CCCC(C1)OCC 2230a_100000745229_100000210303 [0,0,1,1,0,0|2,0,0]=4 984 B12R1.278 CCCN1CCCC(C1)OCC 269982a_100000745229_100000210303 [0,0,1,1,0,0|2,0,0]=4 985 B12R1.278 CCCN1CCCC(C1)OCC 34a_100000745229_100000210303 [0,0,1,1,0,0|2,0,0]=4 986 B12R1.320 CCCCC1CCCC1NCC 269862a_100015525214_100000750825 [0,0,1,1,0,0|2,0,0]=4 987 B12R1.320 CCCCC1CCCC1NCC 270004a_100015525214_100000750825 [0,0,1,1,0,0|2,0,0]=4 988 B12R1.1510 CCOC(CN1CCC1)OCC 269982a_100000754969_100000733474 [0,0,1,1,0,0|1,0,0]=3 989 B12R1.1511 CCOC(CNC1CC1)OCC 34a_100000211098_100000211595 [0,0,1,1,0,0|1,0,0]=3 990 B12R1.1511 CCOC(CNC1CC1)OCC 34a_100000212008_100000210512 [0,0,1,1,0,0|1,0,0]=3 991 B12R1.1511 CCOC(COC1CC1)OCC 34a_100011216334_100000211595 [0,0,1,1,0,0|1,0,0]=3 992 B12R1.1511 CCOC(CSC1CC1)OCC 62a_100000210512_100000211595 [0,0,1,1,0,0|1,0,0]=3 993 B12R2.8 CN1CCOC12CCCCC2 269982a_200015422347_200000210301 [1,0,0,1,0,0|1,0,0]=3 994 B12R2.8 CN1CCOC12CCCCC2 34a_200015422347_200000210301 [1,0,0,1,0,0|1,0,0]=3 995 B12R2.8 [13CH3]N1CCOC12CCCCC2 269982a_200015422347_200025704644 [1,0,0,1,0,0|1,0,0]=3 996 B12R2.8 [13CH3]N1CCOC12CCCCC2 34a_200015422347_200025704644 [1,0,0,1,0,0|1,0,0]=3 997 B14R2.58 C#CCN1CCOC12CCCCC2 34a_200015422347_100000184674 [0,1,0,1,0,0|1,0,1]=4 998 B14R2.58 C=CCN1CCOC12CCCCC2 269982a_200015422347_100000210623 [0,1,0,1,0,0|1,0,1]=4 999 B14R2.58 C=CCN1CCOC12CCCCC2 34a_200015422347_100015514636 [0,1,0,1,0,0|1,0,1]=4 1000 B14R2.58 CCCN1CCOC12CCCCC2 269982a_200015422347_100000210303 [0,1,0,1,0,0|1,0,0]=3 1001 B14R2.58 CCCN1CCOC12CCCCC2 34a_200015422347_100000210303 [0,1,0,1,0,0|1,0,0]=3 1002 B14R2.58 COCN1CCOC12CCCCC2 269982a_200015422347_100000766300 [0,1,0,1,0,0|1,0,0]=3 1003 B14R2.58 CSCN1CCOC12CCCCC2 269982a_200015422347_100011218213 [0,1,0,1,0,0|1,0,0]=3 1004 B14R2.58 CSCN1CCOC12CCCCC2 34a_200015422347_100011218213 [0,1,0,1,0,0|1,0,0]=3 1005 B14R2.58 FCCN1CCOC12CCCCC2 269982a_200015422347_100011217306 [0,1,0,1,0,0|1,0,0]=3 1006 B14R2.58 FCCN1CCOC12CCCCC2 34a_200015422347_100011217306 [0,1,0,1,0,0|1,0,0]=3 1007 B14R2.58 N#CCN1CCOC12CCCCC2 269982a_200015422347_100011214920 [0,1,0,1,0,0|1,0,1]=4 1008 B14R2.58 O=CCN1CCOC12CCCCC2 269982a_200015422347_200015260668 [0,1,0,1,0,0|1,0,1]=4 1009 B14R2.58 O=CCN1CCOC12CCCCC2 34a_200015422347_200009817547 [0,1,0,1,0,0|1,0,1]=4 1010 B14R2.58 OCCN1CCOC12CCCCC2 269982a_200015422347_100000211926 [0,1,0,1,0,0|1,0,0]=3 1011 B14R2.58 OCCN1CCOC12CCCCC2 34a_200015422347_100000211926 [0,1,0,1,0,0|1,0,0]=3 1012 B14R2.38170 CNC1CCCC2(C1)CCCCC2 270004a_106832991635_100000142967 [0,1,0,1,0,0|2,0,0]=4 1013 B14R2.53070 CC#CC1(CCCCC1)OC2CC2 34a_200011215096_100000211595 [0,1,0,1,0,0|1,0,1]=4 1014 B14R2.53070 CCCC1(CCCCC1)OC2CC2 34a_200011215981_100000211595 [0,1,0,1,0,0|1,0,0]=3 1015 B14R2.53070 NCCC1(CCCCC1)OC2CC2 34a_100102740465_100000211595 [0,1,0,1,0,0|2,0,0]=4 1016 B14R2.55 CC(=O)N1CCOC12CCCCC2 11a_200015422347_100015343762 [0,1,0,1,0,0|1,0,1]=4 1017 B14R2.55 CC(=O)N1CCOC12CCCCC2 1626a_200015422347_100015343762 [0,1,0,1,0,0|1,0,1]=4 1018 B14R2.55 CC(=O)N1CCOC12CCCCC2 240690a_200015422347_100015343762 [0,1,0,1,0,0|1,0,1]=4 1019 B14R2.55 CC(=O)N1CCOC12CCCCC2 527a_200015422347_100103153847 [0,1,0,1,0,0|1,0,1]=4 1020 B14R2.55 CC(C)N1CCOC12CCCCC2 269982a_200015422347_100000210206 [0,1,0,1,0,0|1,0,0]=3 1021 B14R2.55 CC(C)N1CCOC12CCCCC2 34a_200015422347_100000210206 [0,1,0,1,0,0|1,0,0]=3 1022 B14R2.20134 CCOC12CCCC(C1)CC(=O)C2 34a_200009882635_100000210202 [0,1,0,1,0,0|1,0,1]=4 1023 B10R1.529 C#CC1(CCCC1)OCC 34a_100000189447_100000210202 [1,0,0,0,1,0|0,0,2]=4 1024 B10R1.529 C#CC1(CCCC1)OCC 7a_100000189447_100000210202 [1,0,0,0,1,0|0,0,2]=4 1025 B10R1.529 CCC1(CCCC1)OCF 7a_100000752416_100015361967 [1,0,0,0,1,0|1,0,0]=3 1026 B10R1.529 CCCC1(CCCC1)OC 34a_200011216196_200000210301 [1,0,0,0,1,0|1,0,0]=3 1027 B10R1.529 CCCC1(CCCC1)OC 7a_200011216196_200000210301 [1,0,0,0,1,0|1,0,0]=3 1028 B10R1.529 CCCC1(CCCC1)O[13CH3] 34a_200011216196_200025704644 [1,0,0,0,1,0|1,0,0]=3 1029 B10R1.529 CCCC1(CCCC1)O[13CH3] 7a_200011216196_200025704644 [1,0,0,0,1,0|1,0,0]=3 1030 B10R1.529 CCNC1(CCCC1)CC 2230a_100015183760_100000210202 [1,0,0,0,1,0|1,0,0]=3 1031 B10R1.529 CCNC1(CCCC1)CO 2230a_100000749328_100000210202 [1,0,0,0,1,0|2,0,0]=4 1032 B10R1.529 CCNC1(CCCC1)CO 34a_100000749328_100000210202 [1,0,0,0,1,0|2,0,0]=4 1033 B10R1.529 CCOC1(CCCC1)C#N 34a_100000744759_100000210202 [1,0,0,0,1,0|1,0,1]=4 1034 B10R1.529 CCOC1(CCCC1)C#N 7a_100000744759_100000210202 [1,0,0,0,1,0|1,0,1]=4 1035 B10R1.529 CCOC1(CCCC1)CC 7a_100000752416_100000210202 [1,0,0,0,1,0|0,0,0]=2 1036 B10R1.529 CCOC1(CCCC1)CN 34a_100000737848_100000210202 [1,0,0,0,1,0|1,0,0]=3 1037 B10R1.529 COC1(CCCC1)CCN 34a_100000719956_200000210301 [1,0,0,0,1,0|2,0,0]=4 1038 B10R1.529 NCC1(CCCC1)OCF 34a_100000737848_100015361967 [1,0,0,0,1,0|2,0,0]=4 1039 B10R1.529 [13CH3]OC1(CCCC1)CCN 34a_100000719956_200025704644 [1,0,0,0,1,0|2,0,0]=4