0 B11R2.432 CN1CC2CCC(C1)N2C 2230a_100016987348_200000210301 [0,0,0,0,0,0|2,0,0]=2 1 B11R2.432 CN1CC2CCC(C1)N2C 269982a_100016987348_200000210301 [0,0,0,0,0,0|2,0,0]=2 2 B11R2.432 CN1CC2CCC(C1)N2[13CH3] 2230a_100016987348_200025704644 [0,0,0,0,0,0|2,0,0]=2 3 B11R2.432 CN1CC2CCC(C1)N2[13CH3] 269982a_100016987348_200025704644 [0,0,0,0,0,0|2,0,0]=2 4 B11R2.432 CN1[C@@H]2CC[C@H]1C[C@H](C2)O 2230a_100103153168_200000210301 [0,0,0,0,0,0|0,0,2]=2 5 B11R2.432 CN1[C@@H]2CC[C@H]1C[C@H](C2)O 269982a_100103153168_200000210301 [0,0,0,0,0,0|0,0,2]=2 6 B11R2.432 [13CH3]N1[C@@H]2CC[C@H]1C[C@H](C2)O 2230a_100103153168_200025704644 [0,0,0,0,0,0|0,0,2]=2 7 B11R2.432 [13CH3]N1[C@@H]2CC[C@H]1C[C@H](C2)O 269982a_100103153168_200025704644 [0,0,0,0,0,0|0,0,2]=2 8 B10R2.41 CN1C2CCC1COC2 2230a_100015205251_200000210301 [1,0,0,0,0,0|1,0,0]=2 9 B10R2.41 CN1C2CCC1COC2 269982a_100015205251_200000210301 [1,0,0,0,0,0|1,0,0]=2 10 B10R2.41 CN1C2CCC1COC2 34a_100015205251_200000210301 [1,0,0,0,0,0|1,0,0]=2 11 B10R2.41 [13CH3]N1C2CCC1COC2 2230a_100015205251_200025704644 [1,0,0,0,0,0|1,0,0]=2 12 B10R2.41 [13CH3]N1C2CCC1COC2 269982a_100015205251_200025704644 [1,0,0,0,0,0|1,0,0]=2 13 B10R2.41 [13CH3]N1C2CCC1COC2 34a_100015205251_200025704644 [1,0,0,0,0,0|1,0,0]=2 14 B10R2.71 CN1CC2CCC(C1)O2 2230a_100015188616_200000210301 [1,0,0,0,0,0|3,0,0]=4 15 B10R2.71 CN1CC2CCC(C1)O2 269982a_100015188616_200000210301 [1,0,0,0,0,0|3,0,0]=4 16 B10R2.71 CN1CC2CCC(C1)O2 34a_100015188616_200000210301 [1,0,0,0,0,0|3,0,0]=4 17 B10R2.71 [13CH3]N1CC2CCC(C1)O2 2230a_100015188616_200025704644 [1,0,0,0,0,0|3,0,0]=4 18 B10R2.71 [13CH3]N1CC2CCC(C1)O2 269982a_100015188616_200025704644 [1,0,0,0,0,0|3,0,0]=4 19 B10R2.71 [13CH3]N1CC2CCC(C1)O2 34a_100015188616_200025704644 [1,0,0,0,0,0|3,0,0]=4 20 B12R2.1841 CN1[C@@H]2CC[C@H]1C[C@@H](C2)CO 2230a_100103153839_200000210301 [0,1,0,0,0,0|0,0,2]=3 21 B12R2.1841 CN1[C@@H]2CC[C@H]1C[C@@H](C2)CO 269982a_100103153839_200000210301 [0,1,0,0,0,0|0,0,2]=3 22 B12R2.1841 CN1[C@@H]2CC[C@H]1C[C@@H](C2)CO 34a_100103153839_200000210301 [0,1,0,0,0,0|0,0,2]=3 23 B12R2.1841 CO[C@H]1C[C@H]2CC[C@@H](C1)N2C 2230a_100103153749_200000210301 [0,1,0,0,0,0|0,0,2]=3 24 B12R2.1841 CO[C@H]1C[C@H]2CC[C@@H](C1)N2C 269982a_100103153749_200000210301 [0,1,0,0,0,0|0,0,2]=3 25 B12R2.1841 CO[C@H]1C[C@H]2CC[C@@H](C1)N2[13CH3] 2230a_100103153749_200025704644 [0,1,0,0,0,0|0,0,2]=3 26 B12R2.1841 CO[C@H]1C[C@H]2CC[C@@H](C1)N2[13CH3] 269982a_100103153749_200025704644 [0,1,0,0,0,0|0,0,2]=3 27 B12R2.1841 [13CH3]N1[C@@H]2CC[C@H]1C[C@@H](C2)CO 2230a_100103153839_200025704644 [0,1,0,0,0,0|0,0,2]=3 28 B12R2.1841 [13CH3]N1[C@@H]2CC[C@H]1C[C@@H](C2)CO 269982a_100103153839_200025704644 [0,1,0,0,0,0|0,0,2]=3 29 B12R2.1841 [13CH3]N1[C@@H]2CC[C@H]1C[C@@H](C2)CO 34a_100103153839_200025704644 [0,1,0,0,0,0|0,0,2]=3 30 B12R2.2257 CCN1C2CCC1CN(C2)C 2230a_100016987348_100000210202 [0,1,0,0,0,0|2,0,0]=3 31 B12R2.2257 CCN1C2CCC1CN(C2)C 269982a_100016987348_100000204670 [0,1,0,0,0,0|2,0,0]=3 32 B12R2.2257 CCN1[C@@H]2CC[C@H]1C[C@H](C2)O 2230a_100103153168_100000210202 [0,1,0,0,0,0|0,0,2]=3 33 B12R2.2257 CCN1[C@@H]2CC[C@H]1C[C@H](C2)O 269982a_100103153168_100000204670 [0,1,0,0,0,0|0,0,2]=3 34 B12R2.2257 CN1CC2CCC(C1)N2CF 269982a_100016987348_100015361967 [0,1,0,0,0,0|2,0,0]=3 35 B12R2.2257 O[C@H]1C[C@H]2CC[C@@H](C1)N2CF 269982a_100103153168_100015361967 [0,1,0,0,0,0|0,0,2]=3 36 B10R1.22 C[C@@H]1CN(C[C@@H](N1C)C)C 2230a_100009821712_200000210301 [0,0,1,0,0,0|2,0,0]=3 37 B10R1.22 C[C@@H]1CN(C[C@@H](N1C)C)C 269982a_100009821712_200000210301 [0,0,1,0,0,0|2,0,0]=3 38 B10R1.22 C[C@@H]1CN(C[C@@H](N1C)C)[13CH3] 2230a_100009821712_200025704644 [0,0,1,0,0,0|2,0,0]=3 39 B10R1.22 C[C@@H]1CN(C[C@@H](N1C)C)[13CH3] 269982a_100009821712_200025704644 [0,0,1,0,0,0|2,0,0]=3 40 B10R1.30 CCC1CN(CCN1C)C 2230a_100011941019_200000210301 [0,0,1,0,0,0|2,0,0]=3 41 B10R1.30 CCC1CN(CCN1C)C 269982a_100011941019_200000210301 [0,0,1,0,0,0|2,0,0]=3 42 B10R1.30 CCC1CN(CCN1[13CH3])C 2230a_100011941019_200025704644 [0,0,1,0,0,0|2,0,0]=3 43 B10R1.30 CCC1CN(CCN1[13CH3])C 269982a_100011941019_200025704644 [0,0,1,0,0,0|2,0,0]=3 44 B10R1.64 C=C(C)CN1CCC[C@@H]1C 2230a_100020605311_100000748629 [0,0,1,0,0,0|3,0,0]=4 45 B10R1.64 C=C(C)CN1CCC[C@@H]1C 269982a_100020605311_100000748629 [0,0,1,0,0,0|3,0,0]=4 46 B10R1.64 C=C(C)CN1CCC[C@H]1C 2230a_100015189458_100000748629 [0,0,1,0,0,0|3,0,0]=4 47 B10R1.64 C=C(C)CN1CCC[C@H]1C 269982a_100015189458_100000748629 [0,0,1,0,0,0|3,0,0]=4 48 B10R1.64 C=C(C)CN1CCC[C@H]1C 34a_100015189458_100000748629 [0,0,1,0,0,0|3,0,0]=4 49 B10R1.64 CC(=O)CN1CCCC1=O 1458a_100000189602_200000210301 [0,0,1,0,0,0|3,0,0]=4 50 B10R1.64 CC(=O)N[C@H]1CCC[C@@H]1O 11a_100000748460_100015343762 [0,0,1,0,0,0|3,0,0]=4 51 B10R1.64 CC(=O)N[C@H]1CCC[C@@H]1O 240690a_100000748460_100015343762 [0,0,1,0,0,0|3,0,0]=4 52 B10R1.64 CC(C)CC1CCCN1C 2230a_100000748429_200000210301 [0,0,1,0,0,0|1,0,1]=3 53 B10R1.64 CC(C)CC1CCCN1C 269982a_100000748429_200000210301 [0,0,1,0,0,0|1,0,1]=3 54 B10R1.64 CC(C)CC1CCCN1C 34a_100000748429_200000210301 [0,0,1,0,0,0|1,0,1]=3 55 B10R1.64 CC(C)CC1CCCN1[13CH3] 2230a_100000748429_200025704644 [0,0,1,0,0,0|1,0,1]=3 56 B10R1.64 CC(C)CC1CCCN1[13CH3] 269982a_100000748429_200025704644 [0,0,1,0,0,0|1,0,1]=3 57 B10R1.64 CC(C)CC1CCCN1[13CH3] 34a_100000748429_200025704644 [0,0,1,0,0,0|1,0,1]=3 58 B10R1.64 CN(C)C[C@H]1CCCN1C 269982a_200020645772_200000210301 [0,0,1,0,0,0|2,0,0]=3 59 B10R1.64 CN(C)C[C@H]1CCCN1[13CH3] 269982a_200020645772_200025704644 [0,0,1,0,0,0|2,0,0]=3 60 B10R1.64 C[C@@H]1CCCN1CC(=O)N 2230a_100015189458_100000747473 [0,0,1,0,0,0|3,0,0]=4 61 B10R1.64 C[C@@H]1CCCN1CC(=O)N 269982a_100015189458_100000187820 [0,0,1,0,0,0|3,0,0]=4 62 B10R1.64 C[C@@H]1CCCN1CC(=O)N 34a_100015189458_100000187820 [0,0,1,0,0,0|3,0,0]=4 63 B10R1.64 C[C@@H]1CCCN1CC(=O)[O-] 269982a_100015189458_100020667443 [0,0,1,0,0,0|3,0,0]=4 64 B10R1.64 C[C@@H]1CCCN1CC(=O)[O-] 34a_100015189458_100020667443 [0,0,1,0,0,0|3,0,0]=4 65 B10R1.64 C[C@H]1CCCN1CC(=O)N 2230a_100020605311_100000747473 [0,0,1,0,0,0|3,0,0]=4 66 B10R1.64 C[C@H]1CCCN1CC(=O)N 269982a_100020605311_100000187820 [0,0,1,0,0,0|3,0,0]=4 67 B10R1.64 C[C@H]1CCCN1CC(=O)[O-] 269982a_100020605311_100020667443 [0,0,1,0,0,0|3,0,0]=4 68 B10R1.64 [13CH3]C(=O)CN1CCCC1=O 1458a_100000189602_200025704644 [0,0,1,0,0,0|3,0,0]=4 69 B10R1.162 CCN1CCCNC(=O)C1 2230a_100015190381_100000210202 [0,0,1,0,0,0|3,0,0]=4 70 B12R2.1154 CN1C2CCCC1CC(C2)O 2230a_100102523664_200000210301 [0,0,0,0,0,1|0,0,2]=3 71 B12R2.1154 CN1C2CCCC1CC(C2)O 269982a_100102523664_200000210301 [0,0,0,0,0,1|0,0,2]=3 72 B12R2.1154 CN1[C@@H]2COC[C@H]1C[C@H](C2)O 2230a_100103153818_200000210301 [0,0,0,0,0,1|0,0,2]=3 73 B12R2.1154 CN1[C@@H]2COC[C@H]1C[C@H](C2)O 269982a_100103153818_200000210301 [0,0,0,0,0,1|0,0,2]=3 74 B12R2.1154 [13CH3]N1C2CCCC1CC(C2)O 2230a_100102523664_200025704644 [0,0,0,0,0,1|0,0,2]=3 75 B12R2.1154 [13CH3]N1C2CCCC1CC(C2)O 269982a_100102523664_200025704644 [0,0,0,0,0,1|0,0,2]=3 76 B12R2.1154 [13CH3]N1[C@@H]2COC[C@H]1C[C@H](C2)O 2230a_100103153818_200025704644 [0,0,0,0,0,1|0,0,2]=3 77 B12R2.1154 [13CH3]N1[C@@H]2COC[C@H]1C[C@H](C2)O 269982a_100103153818_200025704644 [0,0,0,0,0,1|0,0,2]=3 78 B9R1.3 CC1CCCC(N1C)C 2230a_100000210447_200000210301 [1,0,1,0,0,0|0,0,1]=3 79 B9R1.3 CC1CCCC(N1C)C 269982a_100000210447_200000210301 [1,0,1,0,0,0|0,0,1]=3 80 B9R1.3 CC1CCCC(N1C)C 34a_100000210447_200000210301 [1,0,1,0,0,0|0,0,1]=3 81 B9R1.3 CC1CCCC(N1[13CH3])C 2230a_100000210447_200025704644 [1,0,1,0,0,0|0,0,1]=3 82 B9R1.3 CC1CCCC(N1[13CH3])C 269982a_100000210447_200025704644 [1,0,1,0,0,0|0,0,1]=3 83 B9R1.3 CC1CCCC(N1[13CH3])C 34a_100000210447_200025704644 [1,0,1,0,0,0|0,0,1]=3 84 B9R1.3 C[C@@H]1COC[C@@H](N1C)C 2230a_100103153222_200000210301 [1,0,1,0,0,0|1,0,0]=3 85 B9R1.3 C[C@@H]1COC[C@@H](N1C)C 269982a_100103153222_200000210301 [1,0,1,0,0,0|1,0,0]=3 86 B9R1.3 C[C@@H]1COC[C@@H](N1C)C 34a_100103153222_200000210301 [1,0,1,0,0,0|1,0,0]=3 87 B9R1.3 C[C@@H]1COC[C@@H](N1[13CH3])C 2230a_100103153222_200025704644 [1,0,1,0,0,0|1,0,0]=3 88 B9R1.3 C[C@@H]1COC[C@@H](N1[13CH3])C 269982a_100103153222_200025704644 [1,0,1,0,0,0|1,0,0]=3 89 B9R1.3 C[C@@H]1COC[C@@H](N1[13CH3])C 34a_100103153222_200025704644 [1,0,1,0,0,0|1,0,0]=3 90 B9R1.69 C[C@H]1CN(CCN1C)C 2230a_100012002466_200000210301 [1,0,1,0,0,0|2,0,0]=4 91 B9R1.69 C[C@H]1CN(CCN1C)C 2230a_100020603432_200000210301 [1,0,1,0,0,0|2,0,0]=4 92 B9R1.69 C[C@H]1CN(CCN1C)C 269982a_100012002466_200000210301 [1,0,1,0,0,0|2,0,0]=4 93 B9R1.69 C[C@H]1CN(CCN1C)C 269982a_100020603432_200000210301 [1,0,1,0,0,0|2,0,0]=4 94 B9R1.69 C[C@H]1CN(CCN1C)[13CH3] 2230a_100020603432_200025704644 [1,0,1,0,0,0|2,0,0]=4 95 B9R1.69 C[C@H]1CN(CCN1C)[13CH3] 269982a_100020603432_200025704644 [1,0,1,0,0,0|2,0,0]=4 96 B9R1.69 C[C@H]1CN(CCN1[13CH3])C 2230a_100012002466_200025704644 [1,0,1,0,0,0|2,0,0]=4 97 B9R1.69 C[C@H]1CN(CCN1[13CH3])C 269982a_100012002466_200025704644 [1,0,1,0,0,0|2,0,0]=4 98 B9R1.2 COC1CCCC(=O)C1 34a_100012613340_200000210301 [1,0,1,0,0,0|2,0,0]=4 99 B9R1.2 [13CH3]OC1CCCC(=O)C1 34a_100012613340_200025704644 [1,0,1,0,0,0|2,0,0]=4 100 B9R1.15 CCC1CCCCN1C 2230a_100000210034_200000210301 [1,0,1,0,0,0|0,0,1]=3 101 B9R1.15 CCC1CCCCN1C 269982a_100000210034_200000210301 [1,0,1,0,0,0|0,0,1]=3 102 B9R1.15 CCC1CCCCN1C 34a_100000210034_200000210301 [1,0,1,0,0,0|0,0,1]=3 103 B9R1.15 CCC1CCCCN1[13CH3] 2230a_100000210034_200025704644 [1,0,1,0,0,0|0,0,1]=3 104 B9R1.15 CCC1CCCCN1[13CH3] 269982a_100000210034_200025704644 [1,0,1,0,0,0|0,0,1]=3 105 B9R1.15 CCC1CCCCN1[13CH3] 34a_100000210034_200025704644 [1,0,1,0,0,0|0,0,1]=3 106 B9R1.15 CC[C@H]1COCCN1C 2230a_100016988097_200000210301 [1,0,1,0,0,0|1,0,0]=3 107 B9R1.15 CC[C@H]1COCCN1C 269982a_100016988097_200000210301 [1,0,1,0,0,0|1,0,0]=3 108 B9R1.15 CC[C@H]1COCCN1C 34a_100016988097_200000210301 [1,0,1,0,0,0|1,0,0]=3 109 B9R1.15 CC[C@H]1COCCN1[13CH3] 2230a_100016988097_200025704644 [1,0,1,0,0,0|1,0,0]=3 110 B9R1.15 CC[C@H]1COCCN1[13CH3] 269982a_100016988097_200025704644 [1,0,1,0,0,0|1,0,0]=3 111 B9R1.15 CC[C@H]1COCCN1[13CH3] 34a_100016988097_200025704644 [1,0,1,0,0,0|1,0,0]=3 112 B9R1.15 CN1CCCCC1CO 2230a_100000210821_200000210301 [1,0,1,0,0,0|1,0,1]=4 113 B9R1.15 CN1CCCCC1CO 269982a_100000210821_200000210301 [1,0,1,0,0,0|1,0,1]=4 114 B9R1.15 CN1CCCCC1CO 34a_100000210821_200000210301 [1,0,1,0,0,0|1,0,1]=4 115 B9R1.15 CN1CCOC[C@H]1CO 2230a_100000717676_200000210301 [1,0,1,0,0,0|2,0,0]=4 116 B9R1.15 CN1CCOC[C@H]1CO 269982a_100000717676_200000210301 [1,0,1,0,0,0|2,0,0]=4 117 B9R1.15 CN1CCOC[C@H]1CO 34a_100000717676_200000210301 [1,0,1,0,0,0|2,0,0]=4 118 B9R1.15 [13CH3]N1CCCCC1CO 2230a_100000210821_200025704644 [1,0,1,0,0,0|1,0,1]=4 119 B9R1.15 [13CH3]N1CCCCC1CO 269982a_100000210821_200025704644 [1,0,1,0,0,0|1,0,1]=4 120 B9R1.15 [13CH3]N1CCCCC1CO 34a_100000210821_200025704644 [1,0,1,0,0,0|1,0,1]=4 121 B9R1.15 [13CH3]N1CCOC[C@H]1CO 2230a_100000717676_200025704644 [1,0,1,0,0,0|2,0,0]=4 122 B9R1.15 [13CH3]N1CCOC[C@H]1CO 269982a_100000717676_200025704644 [1,0,1,0,0,0|2,0,0]=4 123 B9R1.15 [13CH3]N1CCOC[C@H]1CO 34a_100000717676_200025704644 [1,0,1,0,0,0|2,0,0]=4 124 B9R1.13 CC(=O)CC1=CCCC1 1458a_100000050221_200000210301 [1,0,1,0,0,0|1,0,1]=4 125 B9R1.13 CC(=O)CC1C=CCC1 1458a_100000212241_200000210301 [1,0,1,0,0,0|1,0,1]=4 126 B9R1.13 CC(=O)CC1CCCC1 1458a_100000070787_100000740388 [1,0,1,0,0,0|1,0,0]=3 127 B9R1.13 CC(=O)CC1CCCC1 1458a_100000210891_200000210301 [1,0,1,0,0,0|1,0,0]=3 128 B9R1.13 CC(=O)CC1CCCO1 1458a_100000070787_100000203698 [1,0,1,0,0,0|1,0,0]=3 129 B9R1.13 CC(=O)CC1CCOC1 1458a_100000070787_100000702531 [1,0,1,0,0,0|2,0,0]=4 130 B9R1.13 CC(=O)CC1CCOC1 1458a_100011218419_200000210301 [1,0,1,0,0,0|2,0,0]=4 131 B9R1.13 CC(=O)CC1OCCO1 1458a_100000070787_100000755774 [1,0,1,0,0,0|2,0,0]=4 132 B9R1.13 CC(=O)CN1CCCC1 1458a_100000740243_200000210301 [1,0,1,0,0,0|2,0,0]=4 133 B9R1.13 CC(=O)NC1CCCC1 11a_100000211070_100015343762 [1,0,1,0,0,0|2,0,0]=4 134 B9R1.13 CC(=O)NC1CCCC1 1626a_100000211070_100015343762 [1,0,1,0,0,0|2,0,0]=4 135 B9R1.13 CC(=O)NC1CCCC1 240690a_100000211070_100015343762 [1,0,1,0,0,0|2,0,0]=4 136 B9R1.13 CC(=O)NC1CCCC1 527a_100000211070_100103153847 [1,0,1,0,0,0|2,0,0]=4 137 B9R1.13 [13CH3]C(=O)CC1=CCCC1 1458a_100000050221_200025704644 [1,0,1,0,0,0|1,0,1]=4 138 B9R1.13 [13CH3]C(=O)CC1C=CCC1 1458a_100000212241_200025704644 [1,0,1,0,0,0|1,0,1]=4 139 B9R1.13 [13CH3]C(=O)CC1CCCC1 1458a_100000210891_200025704644 [1,0,1,0,0,0|1,0,0]=3 140 B9R1.13 [13CH3]C(=O)CC1CCOC1 1458a_100011218419_200025704644 [1,0,1,0,0,0|2,0,0]=4 141 B9R1.13 [13CH3]C(=O)CN1CCCC1 1458a_100000740243_200025704644 [1,0,1,0,0,0|2,0,0]=4 142 B9R1.33 CN1CCCC1CO[13CH3] 34a_100000743107_200025704644 [1,0,1,0,0,0|1,0,0]=3 143 B9R1.33 COCC1CCCN1C 34a_100000743107_200000210301 [1,0,1,0,0,0|1,0,0]=3 144 B9R1.33 COC[C@@H]1CCCN1C 2230a_100020646714_200000210301 [1,0,1,0,0,0|1,0,0]=3 145 B9R1.33 COC[C@@H]1CCCN1C 269982a_100020646714_200000210301 [1,0,1,0,0,0|1,0,0]=3 146 B9R1.33 COC[C@@H]1CCCN1C 34a_100020646714_200000210301 [1,0,1,0,0,0|1,0,0]=3 147 B9R1.33 COC[C@@H]1CCCN1[13CH3] 2230a_100020646714_200025704644 [1,0,1,0,0,0|1,0,0]=3 148 B9R1.33 COC[C@@H]1CCCN1[13CH3] 269982a_100020646714_200025704644 [1,0,1,0,0,0|1,0,0]=3 149 B9R1.33 COC[C@@H]1CCCN1[13CH3] 34a_100020646714_200025704644 [1,0,1,0,0,0|1,0,0]=3 150 B9R1.33 C[C@@H]1CCCN1CC=O 2230a_100015189458_200015260668 [1,0,1,0,0,0|2,0,0]=4 151 B9R1.33 C[C@@H]1CCCN1CC=O 269982a_100015189458_200015260668 [1,0,1,0,0,0|2,0,0]=4 152 B9R1.33 C[C@@H]1CCCN1CC=O 34a_100015189458_200009817547 [1,0,1,0,0,0|2,0,0]=4 153 B9R1.33 C[C@H]1CCCN1CC=O 2230a_100020605311_200015260668 [1,0,1,0,0,0|2,0,0]=4 154 B9R1.33 C[C@H]1CCCN1CC=O 269982a_100020605311_200015260668 [1,0,1,0,0,0|2,0,0]=4 155 B9R1.7 C[C@@H]1CCN(C1)CC=O 2230a_100016987628_200015260668 [1,0,1,0,0,0|2,0,0]=4 156 B9R1.7 C[C@@H]1CCN(C1)CC=O 269982a_100016987628_200015260668 [1,0,1,0,0,0|2,0,0]=4 157 B9R1.7 C[C@@H]1CCN(C1)CC=O 34a_100016987628_200009817547 [1,0,1,0,0,0|2,0,0]=4 158 B9R1.48 CN1CCCNC(=O)C1 2230a_100015190381_200000210301 [1,0,1,0,0,0|2,0,0]=4 159 B9R1.48 [13CH3]N1CCCNC(=O)C1 2230a_100015190381_200025704644 [1,0,1,0,0,0|2,0,0]=4 160 B9R1.89 CNC1CCCCCC1 2230a_100000210984_200000210301 [1,0,1,0,0,0|0,0,1]=3 161 B9R1.89 CNC1CCCCCC1 270004a_106832991635_100000210131 [1,0,1,0,0,0|0,0,1]=3 162 B9R1.89 CNC1CCCCCC1 34a_100000210984_200000210301 [1,0,1,0,0,0|0,0,1]=3 163 B9R1.89 CNC1CCCCCC1 34a_100102657272_100011217769 [1,0,1,0,0,0|0,0,1]=3 164 B9R1.89 CNC1CCCNCC1 270004a_106832991635_100015187895 [1,0,1,0,0,0|1,0,1]=4 165 B9R1.89 CNC1CSCCSC1 270004a_106832991635_100000068409 [1,0,1,0,0,0|2,0,0]=4 166 B9R1.89 COC1CCCCCC1 34a_100000210887_200000210301 [1,0,1,0,0,0|1,0,1]=4 167 B9R1.89 COC1CCCCCC1 34a_100138415774_100011217769 [1,0,1,0,0,0|1,0,1]=4 168 B9R1.89 COC1CCCCCC1 7a_100000210887_200000210301 [1,0,1,0,0,0|1,0,1]=4 169 B9R1.89 CSC1CCCCCC1 62a_100011217769_200000210301 [1,0,1,0,0,0|1,0,1]=4 170 B9R1.89 CSC1CCCCCC1 62a_200000210301_100011217769 [1,0,1,0,0,0|1,0,1]=4 171 B9R1.89 [13CH3]NC1CCCCCC1 2230a_100000210984_200025704644 [1,0,1,0,0,0|0,0,1]=3 172 B9R1.89 [13CH3]NC1CCCCCC1 34a_100000210984_200025704644 [1,0,1,0,0,0|0,0,1]=3 173 B9R1.89 [13CH3]OC1CCCCCC1 34a_100000210887_200025704644 [1,0,1,0,0,0|1,0,1]=4 174 B9R1.89 [13CH3]OC1CCCCCC1 7a_100000210887_200025704644 [1,0,1,0,0,0|1,0,1]=4 175 B9R1.89 [13CH3]SC1CCCCCC1 62a_100011217769_200025704644 [1,0,1,0,0,0|1,0,1]=4 176 B9R1.89 [13CH3]SC1CCCCCC1 62a_200025704644_100011217769 [1,0,1,0,0,0|1,0,1]=4 177 B11R1.14 CCN1C[C@H](N([C@H](C1)C)C)C 2230a_100009821712_100000210202 [0,1,1,0,0,0|2,0,0]=4 178 B11R1.14 CCN1C[C@H](N([C@H](C1)C)C)C 269982a_100009821712_100000204670 [0,1,1,0,0,0|2,0,0]=4 179 B11R1.14 C[C@@H]1CN(C[C@@H](N1C)C)CF 269982a_100009821712_100015361967 [0,1,1,0,0,0|2,0,0]=4 180 B11R1.37 CCC1CN(CCN1CC)C 2230a_100011941019_100000210202 [0,1,1,0,0,0|2,0,0]=4 181 B11R1.37 CCC1CN(CCN1CC)C 269982a_100011941019_100000204670 [0,1,1,0,0,0|2,0,0]=4 182 B11R1.37 CCC1CN(CCN1CF)C 269982a_100011941019_100015361967 [0,1,1,0,0,0|2,0,0]=4 183 B11R1.57 CC(C)CC1CCCN1CF 269982a_100000748429_100015361967 [0,1,1,0,0,0|1,0,1]=4 184 B11R1.57 CC(C)CC1CCCN1CF 34a_100000748429_100015361967 [0,1,1,0,0,0|1,0,1]=4 185 B11R1.57 CCN1CCCC1CC(C)C 2230a_100000748429_100000210202 [0,1,1,0,0,0|1,0,1]=4 186 B11R1.57 CCN1CCCC1CC(C)C 269982a_100000748429_100000204670 [0,1,1,0,0,0|1,0,1]=4 187 B11R1.57 CCN1CCCC1CC(C)C 34a_100000748429_100000210202 [0,1,1,0,0,0|1,0,1]=4 188 B11R1.57 CCN1CCC[C@@H]1CN(C)C 269982a_200020645772_100000204670 [0,1,1,0,0,0|2,0,0]=4 189 B11R1.57 CN(C)C[C@H]1CCCN1CF 269982a_200020645772_100015361967 [0,1,1,0,0,0|2,0,0]=4 190 B11R1.89 CC(=O)C(C)N1CCC[C@@H]1C 2230a_100020605311_100009814033 [0,1,1,0,0,0|2,0,0]=4 191 B11R1.89 CC(=O)C(C)N1CCC[C@@H]1C 269982a_100020605311_100009814033 [0,1,1,0,0,0|2,0,0]=4 192 B11R1.89 CC(=O)C(C)N1CCC[C@H]1C 2230a_100015189458_100009814033 [0,1,1,0,0,0|2,0,0]=4 193 B11R1.89 CC(=O)C(C)N1CCC[C@H]1C 269982a_100015189458_100009814033 [0,1,1,0,0,0|2,0,0]=4 194 B11R1.228 CCC(=O)CN1CCC[C@@H]1C 269982a_100020605311_100000747405 [0,1,1,0,0,0|2,0,0]=4 195 B11R1.228 CCC(=O)CN1CCC[C@H]1C 269982a_100015189458_100000747405 [0,1,1,0,0,0|2,0,0]=4 196 B11R1.228 CNC(=O)CN1CCC[C@@H]1C 2230a_100020605311_100000183359 [0,1,1,0,0,0|2,0,0]=4 197 B11R1.228 CNC(=O)CN1CCC[C@@H]1C 269982a_100020605311_100000183359 [0,1,1,0,0,0|2,0,0]=4 198 B11R1.228 CNC(=O)CN1CCC[C@H]1C 2230a_100015189458_100000183359 [0,1,1,0,0,0|2,0,0]=4 199 B11R1.228 CNC(=O)CN1CCC[C@H]1C 269982a_100015189458_100000183359 [0,1,1,0,0,0|2,0,0]=4 200 B11R1.228 CNC(=O)CN1CCC[C@H]1C 34a_100015189458_100000183359 [0,1,1,0,0,0|2,0,0]=4 201 B11R1.228 COC(=O)CN1CCC[C@@H]1C 2230a_100020605311_100000747449 [0,1,1,0,0,0|2,0,0]=4 202 B11R1.228 COC(=O)CN1CCC[C@@H]1C 269982a_100020605311_100000747449 [0,1,1,0,0,0|2,0,0]=4 203 B11R1.228 COC(=O)CN1CCC[C@H]1C 2230a_100015189458_100000747449 [0,1,1,0,0,0|2,0,0]=4 204 B11R1.228 COC(=O)CN1CCC[C@H]1C 269982a_100015189458_100000747449 [0,1,1,0,0,0|2,0,0]=4 205 B11R1.228 COC(=O)CN1CCC[C@H]1C 34a_100015189458_100000747449 [0,1,1,0,0,0|2,0,0]=4 206 B11R1.228 COC(=O)C[C@H]1CCCN1C 2230a_100025726698_200000210301 [0,1,1,0,0,0|0,0,0]=2 207 B11R1.228 COC(=O)C[C@H]1CCCN1C 269982a_100025726698_200000210301 [0,1,1,0,0,0|0,0,0]=2 208 B11R1.228 COC(=O)C[C@H]1CCCN1C 34a_100025726698_200000210301 [0,1,1,0,0,0|0,0,0]=2 209 B11R1.228 COC(=O)C[C@H]1CCCN1[13CH3] 2230a_100025726698_200025704644 [0,1,1,0,0,0|0,0,0]=2 210 B11R1.228 COC(=O)C[C@H]1CCCN1[13CH3] 269982a_100025726698_200025704644 [0,1,1,0,0,0|0,0,0]=2 211 B11R1.228 COC(=O)C[C@H]1CCCN1[13CH3] 34a_100025726698_200025704644 [0,1,1,0,0,0|0,0,0]=2 212 B11R1.234 CC(=O)N[C@@H]1CCC[C@@]1(C)O 11a_100015977457_100015343762 [0,1,1,0,0,0|2,0,0]=4 213 B11R1.234 CC(=O)N[C@@H]1CCC[C@@]1(C)O 1626a_100015977457_100015343762 [0,1,1,0,0,0|2,0,0]=4 214 B11R1.234 CC(=O)N[C@@H]1CCC[C@@]1(C)O 240690a_100015977457_100015343762 [0,1,1,0,0,0|2,0,0]=4 215 B11R1.234 CC(=O)N[C@@H]1CCC[C@@]1(C)O 527a_100015977457_100103153847 [0,1,1,0,0,0|2,0,0]=4 216 B11R1.126 CC1CCN(C1(C)C)CC=O 2230a_102516457003_200015260668 [0,1,1,0,0,0|2,0,0]=4 217 B11R1.126 CC1CCN(C1(C)C)CC=O 269982a_102516457003_200015260668 [0,1,1,0,0,0|2,0,0]=4 218 B11R1.126 CC1CCN(C1(C)C)CC=O 34a_102516457003_200009817547 [0,1,1,0,0,0|2,0,0]=4 219 B11R1.761 CC1N(CCC1(C)C)CC=O 2230a_100102837566_200015260668 [0,1,1,0,0,0|2,0,0]=4 220 B11R1.761 CC1N(CCC1(C)C)CC=O 269982a_100102837566_200015260668 [0,1,1,0,0,0|2,0,0]=4 221 B11R1.761 CC1N(CCC1(C)C)CC=O 34a_100102837566_200009817547 [0,1,1,0,0,0|2,0,0]=4 222 B11R2.232 CCN1C2CCC1COC2 2230a_100015205251_100000210202 [1,1,0,0,0,0|1,0,0]=3 223 B11R2.232 CCN1C2CCC1COC2 269982a_100015205251_100000204670 [1,1,0,0,0,0|1,0,0]=3 224 B11R2.232 CCN1C2CCC1COC2 34a_100015205251_100000210202 [1,1,0,0,0,0|1,0,0]=3 225 B11R2.232 FCN1C2CCC1COC2 269982a_100015205251_100015361967 [1,1,0,0,0,0|1,0,0]=3 226 B11R2.232 FCN1C2CCC1COC2 34a_100015205251_100015361967 [1,1,0,0,0,0|1,0,0]=3 227 B11R2.16 CNC1CC2CCC(C1)N2 270004a_106832991635_100000708817 [1,1,0,0,0,0|1,0,1]=4 228 B11R2.603 CN1C2CC1CS(=O)(=O)C2 269982a_214929135312_200000210301 [0,1,0,0,1,0|1,0,0]=3 229 B11R2.603 [13CH3]N1C2CC1CS(=O)(=O)C2 269982a_214929135312_200025704644 [0,1,0,0,1,0|1,0,0]=3 230 B13R2.2377 CCN1C2CCCC1CC(C2)O 2230a_100102523664_100000210202 [0,1,0,0,0,1|0,0,2]=4 231 B13R2.2377 CCN1C2CCCC1CC(C2)O 269982a_100102523664_100000204670 [0,1,0,0,0,1|0,0,2]=4 232 B13R2.2377 CCN1[C@@H]2COC[C@H]1C[C@H](C2)O 2230a_100103153818_100000210202 [0,1,0,0,0,1|0,0,2]=4 233 B13R2.2377 CCN1[C@@H]2COC[C@H]1C[C@H](C2)O 269982a_100103153818_100000204670 [0,1,0,0,0,1|0,0,2]=4 234 B13R2.2377 OC1CC2CCCC(C1)N2CF 269982a_100102523664_100015361967 [0,1,0,0,0,1|0,0,2]=4 235 B13R2.2377 O[C@H]1C[C@H]2COC[C@@H](C1)N2CF 269982a_100103153818_100015361967 [0,1,0,0,0,1|0,0,2]=4 236 B13R2.604 CCN1[C@@H]2CC[C@H]1C[C@@H](C2)CO 2230a_100103153839_100000210202 [0,2,0,0,0,0|0,0,2]=4 237 B13R2.604 CCN1[C@@H]2CC[C@H]1C[C@@H](C2)CO 269982a_100103153839_100000204670 [0,2,0,0,0,0|0,0,2]=4 238 B13R2.604 CCN1[C@@H]2CC[C@H]1C[C@@H](C2)CO 34a_100103153839_100000210202 [0,2,0,0,0,0|0,0,2]=4 239 B13R2.604 CCN1[C@@H]2CC[C@H]1C[C@H](C2)OC 2230a_100103153749_100000210202 [0,2,0,0,0,0|0,0,2]=4 240 B13R2.604 CCN1[C@@H]2CC[C@H]1C[C@H](C2)OC 269982a_100103153749_100000204670 [0,2,0,0,0,0|0,0,2]=4 241 B13R2.604 CO[C@H]1C[C@H]2CC[C@@H](C1)N2CF 269982a_100103153749_100015361967 [0,2,0,0,0,0|0,0,2]=4 242 B13R2.604 OC[C@@H]1C[C@H]2CC[C@@H](C1)N2CF 269982a_100103153839_100015361967 [0,2,0,0,0,0|0,0,2]=4 243 B13R2.604 OC[C@@H]1C[C@H]2CC[C@@H](C1)N2CF 34a_100103153839_100015361967 [0,2,0,0,0,0|0,0,2]=4 244 B13R2.249 C#CCN1C2CCC1CN(C2)C 2230a_100016987348_100000038162 [0,2,0,0,0,0|2,0,0]=4 245 B13R2.249 C#CCN1[C@@H]2CC[C@H]1C[C@H](C2)O 2230a_100103153168_100000038162 [0,2,0,0,0,0|0,0,2]=4 246 B13R2.249 C=CCN1C2CCC1CN(C2)C 2230a_100016987348_100000210623 [0,2,0,0,0,0|2,0,0]=4 247 B13R2.249 C=CCN1C2CCC1CN(C2)C 269982a_100016987348_100000210623 [0,2,0,0,0,0|2,0,0]=4 248 B13R2.249 C=CCN1[C@@H]2CC[C@H]1C[C@H](C2)O 2230a_100103153168_100000210623 [0,2,0,0,0,0|0,0,2]=4 249 B13R2.249 C=CCN1[C@@H]2CC[C@H]1C[C@H](C2)O 269982a_100103153168_100000210623 [0,2,0,0,0,0|0,0,2]=4 250 B13R2.249 CCCN1C2CCC1CN(C2)C 2230a_100016987348_100000210303 [0,2,0,0,0,0|2,0,0]=4 251 B13R2.249 CCCN1C2CCC1CN(C2)C 269982a_100016987348_100000210303 [0,2,0,0,0,0|2,0,0]=4 252 B13R2.249 CCCN1[C@@H]2CC[C@H]1C[C@H](C2)O 2230a_100103153168_100000210303 [0,2,0,0,0,0|0,0,2]=4 253 B13R2.249 CCCN1[C@@H]2CC[C@H]1C[C@H](C2)O 269982a_100103153168_100000210303 [0,2,0,0,0,0|0,0,2]=4 254 B13R2.249 CN1CC2CCC(C1)N2CC#N 2230a_100016987348_100011215382 [0,2,0,0,0,0|2,0,0]=4 255 B13R2.249 CN1CC2CCC(C1)N2CC#N 269982a_100016987348_100011214920 [0,2,0,0,0,0|2,0,0]=4 256 B13R2.249 CN1CC2CCC(C1)N2CC=O 2230a_100016987348_200015260668 [0,2,0,0,0,0|2,0,0]=4 257 B13R2.249 CN1CC2CCC(C1)N2CC=O 269982a_100016987348_200015260668 [0,2,0,0,0,0|2,0,0]=4 258 B13R2.249 CN1CC2CCC(C1)N2CCF 2230a_100016987348_100011217306 [0,2,0,0,0,0|2,0,0]=4 259 B13R2.249 CN1CC2CCC(C1)N2CCF 269982a_100016987348_100011217306 [0,2,0,0,0,0|2,0,0]=4 260 B13R2.249 CN1CC2CCC(C1)N2CCO 2230a_100016987348_100000211926 [0,2,0,0,0,0|2,0,0]=4 261 B13R2.249 CN1CC2CCC(C1)N2CCO 269982a_100016987348_100000211926 [0,2,0,0,0,0|2,0,0]=4 262 B13R2.249 COCN1C2CCC1CN(C2)C 2230a_100016987348_100000766300 [0,2,0,0,0,0|2,0,0]=4 263 B13R2.249 COCN1C2CCC1CN(C2)C 269982a_100016987348_100000766300 [0,2,0,0,0,0|2,0,0]=4 264 B13R2.249 COCN1[C@@H]2CC[C@H]1C[C@H](C2)O 2230a_100103153168_100000766300 [0,2,0,0,0,0|0,0,2]=4 265 B13R2.249 COCN1[C@@H]2CC[C@H]1C[C@H](C2)O 269982a_100103153168_100000766300 [0,2,0,0,0,0|0,0,2]=4 266 B13R2.249 CSCN1C2CCC1CN(C2)C 2230a_100016987348_100011218213 [0,2,0,0,0,0|2,0,0]=4 267 B13R2.249 CSCN1C2CCC1CN(C2)C 269982a_100016987348_100011218213 [0,2,0,0,0,0|2,0,0]=4 268 B13R2.249 CSCN1[C@@H]2CC[C@H]1C[C@H](C2)O 2230a_100103153168_100011218213 [0,2,0,0,0,0|0,0,2]=4 269 B13R2.249 CSCN1[C@@H]2CC[C@H]1C[C@H](C2)O 269982a_100103153168_100011218213 [0,2,0,0,0,0|0,0,2]=4 270 B13R2.249 N#CCN1[C@@H]2CC[C@H]1C[C@H](C2)O 2230a_100103153168_100011215382 [0,2,0,0,0,0|0,0,2]=4 271 B13R2.249 N#CCN1[C@@H]2CC[C@H]1C[C@H](C2)O 269982a_100103153168_100011214920 [0,2,0,0,0,0|0,0,2]=4 272 B13R2.249 O=CCN1[C@@H]2CC[C@H]1C[C@H](C2)O 2230a_100103153168_200015260668 [0,2,0,0,0,0|0,0,2]=4 273 B13R2.249 O=CCN1[C@@H]2CC[C@H]1C[C@H](C2)O 269982a_100103153168_200015260668 [0,2,0,0,0,0|0,0,2]=4 274 B13R2.249 OCCN1[C@@H]2CC[C@H]1C[C@H](C2)O 2230a_100103153168_100000211926 [0,2,0,0,0,0|0,0,2]=4 275 B13R2.249 OCCN1[C@@H]2CC[C@H]1C[C@H](C2)O 269982a_100103153168_100000211926 [0,2,0,0,0,0|0,0,2]=4 276 B13R2.249 O[C@H]1C[C@H]2CC[C@@H](C1)N2CCF 2230a_100103153168_100011217306 [0,2,0,0,0,0|0,0,2]=4 277 B13R2.249 O[C@H]1C[C@H]2CC[C@@H](C1)N2CCF 269982a_100103153168_100011217306 [0,2,0,0,0,0|0,0,2]=4 278 B13R2.4986 CC(=O)N1C2CCC1CN(C2)C 240690a_100016987348_100015343762 [0,2,0,0,0,0|2,0,0]=4 279 B13R2.4986 CC(=O)N1C2CCC1CN(C2)C 527a_100016987348_100103153847 [0,2,0,0,0,0|2,0,0]=4 280 B13R2.4986 CC(=O)N1[C@@H]2CC[C@H]1C[C@H](C2)O 240690a_100103153168_100015343762 [0,2,0,0,0,0|0,0,2]=4 281 B13R2.4986 CC(=O)N1[C@@H]2CC[C@H]1C[C@H](C2)O 527a_100103153168_100103153847 [0,2,0,0,0,0|0,0,2]=4 282 B13R2.4986 CC(C)N1C2CCC1CN(C2)C 2230a_100016987348_100000210206 [0,2,0,0,0,0|2,0,0]=4 283 B13R2.4986 CC(C)N1C2CCC1CN(C2)C 269982a_100016987348_100000210206 [0,2,0,0,0,0|2,0,0]=4 284 B13R2.4986 CC(C)N1[C@@H]2CC[C@H]1C[C@H](C2)O 2230a_100103153168_100000210206 [0,2,0,0,0,0|0,0,2]=4 285 B13R2.4986 CC(C)N1[C@@H]2CC[C@H]1C[C@H](C2)O 269982a_100103153168_100000210206 [0,2,0,0,0,0|0,0,2]=4 286 B13R2.9491 CN1[C@H]2CC(=O)C[C@@H]1C(C2)O[13CH3] 34a_200016113559_200025704644 [0,2,0,0,0,0|0,0,0]=2 287 B13R2.9491 COC1C[C@@H]2CC(=O)C[C@H]1N2C 34a_200016113559_200000210301 [0,2,0,0,0,0|0,0,0]=2 288 B9R0.6 CC(C)C(C)N(C)CC=O 2230a_100000228512_200015260668 [0,0,2,0,0,0|2,0,0]=4 289 B9R0.6 CC(C)C(C)N(C)CC=O 269982a_100000228512_200015260668 [0,0,2,0,0,0|2,0,0]=4 290 B9R0.6 CC(C)N(C)C(C)CC#N 269982a_200000211004_100009813641 [0,0,2,0,0,0|1,0,1]=4 291 B9R0.6 CC(C)N(C)C(C)CCO 2230a_100000731037_100000210206 [0,0,2,0,0,0|0,0,2]=4 292 B9R0.6 CC(C)N(C)C(C)CCO 269982a_100000731037_100000210206 [0,0,2,0,0,0|0,0,2]=4 293 B9R0.6 CC(C)N(C)C(C)CCO 269982a_200000211004_100009893172 [0,0,2,0,0,0|0,0,2]=4 294 B9R0.6 CCCC(C)N(C)C(C)C 269982a_200000211004_100000766640 [0,0,2,0,0,0|1,0,1]=4 295 B9R0.6 CCCC(C)N(C)C(C)C 270004a_200000211004_100000211909 [0,0,2,0,0,0|1,0,1]=4 296 B9R0.6 COCC(C)N(C)C(C)C 269982a_200000211004_100000765312 [0,0,2,0,0,0|2,0,0]=4 297 B9R0.6 COCC(C)N(C)C(C)C 270004a_200000211004_100000749346 [0,0,2,0,0,0|2,0,0]=4 298 B9R0.6 CSCC(C)N(C)C(C)C 270004a_200000211004_100011216314 [0,0,2,0,0,0|2,0,0]=4 299 B9R0.23 CCN(C)C(=O)CC(=O)C 1458a_100000070787_100011894763 [0,0,2,0,0,0|1,0,1]=4 300 B9R0.23 CCN(C)C(C)CC(=O)C 1458a_200015187196_200000210301 [0,0,2,0,0,0|0,0,0]=2 301 B9R0.23 CCN(C)C(C)CC(=O)[13CH3] 1458a_200015187196_200025704644 [0,0,2,0,0,0|0,0,0]=2 302 B9R0.23 CCN(C)C(C)CC(C)C 2230a_100000225621_100000731052 [0,0,2,0,0,0|1,0,1]=4 303 B9R0.23 CCN(C)C(C)CC(C)C 2230a_100000745462_100000210202 [0,0,2,0,0,0|1,0,1]=4 304 B9R0.23 CCN(C)C(C)CC(C)C 269982a_100000225621_100000731052 [0,0,2,0,0,0|1,0,1]=4 305 B9R0.23 CCN(C)C(C)CC(C)C 269982a_100000745462_100000204670 [0,0,2,0,0,0|1,0,1]=4 306 B9R0.23 CCN(C)C(C)CN(C)C 269982a_100000225621_100020606517 [0,0,2,0,0,0|2,0,0]=4 307 B9R0.23 CCN(C)C(C)OC(=O)C 269982a_100000225621_100009818208 [0,0,2,0,0,0|1,0,0]=3 308 B9R0.34 C=CC(C)CC(=O)CCC 1458a_100011934298_100000210303 [0,0,2,0,0,0|1,0,1]=4 309 B9R0.34 CCC(C)CC(=O)CCF 1458a_100000708755_100011217306 [0,0,2,0,0,0|2,0,0]=4 310 B9R0.34 CCC(C)CC(=O)CCO 1458a_100000708755_100000211926 [0,0,2,0,0,0|2,0,0]=4 311 B9R0.34 CCC(C)CC(=O)CCO 1458a_100011216618_100000748023 [0,0,2,0,0,0|2,0,0]=4 312 B9R0.34 CCC(C)CC(=O)COC 1458a_100000210968_100000748023 [0,0,2,0,0,0|2,0,0]=4 313 B9R0.34 CCC(C)CC(=O)CSC 1458a_100000184570_100000748023 [0,0,2,0,0,0|2,0,0]=4 314 B9R0.34 CCCC(=O)CC(=O)NC 1458a_100000211992_100000183359 [0,0,2,0,0,0|1,0,1]=4 315 B9R0.34 CCCC(=O)CC(C)CC 1458a_100000211992_100000748023 [0,0,2,0,0,0|1,0,0]=3 316 B9R0.34 CCCC(=O)CC(C)CC 1458a_100000708755_100000210303 [0,0,2,0,0,0|1,0,0]=3 317 B9R0.34 CCCC(=O)CC(O)CC 1458a_100000211992_100011218378 [0,0,2,0,0,0|2,0,0]=4 318 B9R0.34 CCCC(=O)CC(O)CC 1458a_100011667805_100000210303 [0,0,2,0,0,0|2,0,0]=4 319 B9R0.34 CCCC(=O)CN(C)CC 1458a_100116209913_100000210303 [0,0,2,0,0,0|2,0,0]=4 320 B9R0.34 CCCC(=O)CN(C)CC 2230a_100000225621_100000747444 [0,0,2,0,0,0|2,0,0]=4 321 B9R0.34 CCCC(=O)CN(C)CC 269982a_100000225621_100000747444 [0,0,2,0,0,0|2,0,0]=4 322 B9R0.34 CCCC(=O)C[C@@H](C)CC 1458a_100000211992_100009816398 [0,0,2,0,0,0|1,0,0]=3 323 B9R0.34 CCCC(=O)C[C@@H](C)CO 1458a_100000211992_100000059175 [0,0,2,0,0,0|2,0,0]=4 324 B9R0.34 CCCC(=O)NC(C)CC 11a_100000209981_100000211992 [0,0,2,0,0,0|2,0,0]=4 325 B9R0.34 CCCC(=O)NC(C)CC 1626a_100000209981_100000211992 [0,0,2,0,0,0|2,0,0]=4 326 B9R0.34 CCCC(=O)NC(C)CC 240690a_100000209981_100000211992 [0,0,2,0,0,0|2,0,0]=4 327 B9R0.34 CCCC(=O)NC(C)CC 527a_100000209981_100000211992 [0,0,2,0,0,0|2,0,0]=4 328 B9R0.34 CCNC(=O)CC(C)CC 11a_100015525214_100000708755 [0,0,2,0,0,0|2,0,0]=4 329 B9R0.34 CCNC(=O)CC(C)CC 240690a_100015525214_100000708755 [0,0,2,0,0,0|2,0,0]=4 330 B9R0.34 CCNC(=O)CC(C)CC 527a_100015525214_100000708755 [0,0,2,0,0,0|2,0,0]=4 331 B9R0.34 CCOC(=O)CC(C)NC 2230a_106832991635_100009817359 [0,0,2,0,0,0|1,0,0]=3 332 B9R0.34 CCOC(=O)CC(C)NC 7a_106832991635_100009817359 [0,0,2,0,0,0|1,0,0]=3 333 B9R0.34 CCOC(=O)CC(C)SC 62a_100009817359_200000210301 [0,0,2,0,0,0|2,0,0]=4 334 B9R0.34 CCOC(=O)CC(C)SC 62a_200000210301_100009817359 [0,0,2,0,0,0|2,0,0]=4 335 B9R0.34 CCOC(=O)CC(C)S[13CH3] 62a_100009817359_200025704644 [0,0,2,0,0,0|2,0,0]=4 336 B9R0.34 CCOC(=O)CC(C)S[13CH3] 62a_200025704644_100009817359 [0,0,2,0,0,0|2,0,0]=4 337 B9R0.34 CCOC(=O)C[C@@H](C)OC 7a_100009816390_200000210301 [0,0,2,0,0,0|2,0,0]=4 338 B9R0.34 CCOC(=O)C[C@@H](C)O[13CH3] 7a_100009816390_200025704644 [0,0,2,0,0,0|2,0,0]=4 339 B9R0.34 CC[C@H](C)CC(=O)CCO 1458a_100011216618_100009816398 [0,0,2,0,0,0|2,0,0]=4 340 B9R0.34 CC[C@H](C)CC(=O)COC 1458a_100000210968_100009816398 [0,0,2,0,0,0|2,0,0]=4 341 B9R0.34 CC[C@H](C)CC(=O)CSC 1458a_100000184570_100009816398 [0,0,2,0,0,0|2,0,0]=4 342 B9R0.8 C#CCCN(C)C(C)CC 2230a_100000741768_100000688953 [0,0,2,0,0,0|1,0,1]=4 343 B9R0.8 C#CCCN(C)C(C)CC 269982a_100000741768_100000730999 [0,0,2,0,0,0|1,0,1]=4 344 B9R0.8 C/C=C/CN(C)C(C)CC 2230a_100020603311_200000210301 [0,0,2,0,0,0|1,0,1]=4 345 B9R0.8 C/C=C/CN(C)C(C)CC 269982a_100000741768_100102629194 [0,0,2,0,0,0|1,0,1]=4 346 B9R0.8 C/C=C/CN(C)C(C)CC 269982a_100020603311_200000210301 [0,0,2,0,0,0|1,0,1]=4 347 B9R0.8 C/C=C/CN([13CH3])C(C)CC 2230a_100020603311_200025704644 [0,0,2,0,0,0|1,0,1]=4 348 B9R0.8 C/C=C/CN([13CH3])C(C)CC 269982a_100020603311_200025704644 [0,0,2,0,0,0|1,0,1]=4 349 B9R0.8 C=CCCN(C)C(C)CC 2230a_100000741768_100000754431 [0,0,2,0,0,0|1,0,0]=3 350 B9R0.8 C=CCCN(C)C(C)CC 2230a_100020639649_100000758301 [0,0,2,0,0,0|1,0,0]=3 351 B9R0.8 C=CCCN(C)C(C)CC 269982a_100000741768_100000754431 [0,0,2,0,0,0|1,0,0]=3 352 B9R0.8 C=CCCN(C)C(C)CC 269982a_100020639649_100000758301 [0,0,2,0,0,0|1,0,0]=3 353 B9R0.8 C=CCCN(C)C(C)CO 2230a_100000693034_100000754431 [0,0,2,0,0,0|2,0,0]=4 354 B9R0.8 C=CCCN(C)C(C)CO 2230a_100020639649_100012180447 [0,0,2,0,0,0|2,0,0]=4 355 B9R0.8 C=CCCN(C)C(C)CO 269982a_100000693034_100000754431 [0,0,2,0,0,0|2,0,0]=4 356 B9R0.8 C=CCCN(C)C(C)OC 269982a_100020639649_100009879195 [0,0,2,0,0,0|2,0,0]=4 357 B9R0.8 C=CCCN(C)[C@H](C)CO 269982a_100020639649_100016084084 [0,0,2,0,0,0|2,0,0]=4 358 B9R0.8 CC=CCN(C)C(C)CC 2230a_100000741768_100000070051 [0,0,2,0,0,0|1,0,1]=4 359 B9R0.8 CCC(C)C(C)OCC=O 7a_100011215189_200015260668 [0,0,2,0,0,0|2,0,0]=4 360 B9R0.8 CCC(C)N(C)CCC#N 2230a_100000184479_100000758301 [0,0,2,0,0,0|1,0,1]=4 361 B9R0.8 CCC(C)N(C)CCC#N 2230a_100000741768_100011215226 [0,0,2,0,0,0|1,0,1]=4 362 B9R0.8 CCC(C)N(C)CCC#N 269982a_100000741768_100011215226 [0,0,2,0,0,0|1,0,1]=4 363 B9R0.8 CCC(C)N(C)CCCF 2230a_100000741768_100011934791 [0,0,2,0,0,0|1,0,1]=4 364 B9R0.8 CCC(C)N(C)CCCF 269982a_100000741768_100011934791 [0,0,2,0,0,0|1,0,1]=4 365 B9R0.8 CCC(C)N(C)CCCO 2230a_100000213112_100000758301 [0,0,2,0,0,0|0,0,2]=4 366 B9R0.8 CCC(C)N(C)CCCO 2230a_100000741768_100000230001 [0,0,2,0,0,0|0,0,2]=4 367 B9R0.8 CCC(C)N(C)CCCO 269982a_100000213112_100000758301 [0,0,2,0,0,0|0,0,2]=4 368 B9R0.8 CCC(C)N(C)CCCO 269982a_100000741768_100011215043 [0,0,2,0,0,0|0,0,2]=4 369 B9R0.8 CCC(C)N(C)CCOC 2230a_100000741768_100011201679 [0,0,2,0,0,0|2,0,0]=4 370 B9R0.8 CCC(C)N(C)CCOC 2230a_100000743101_100000758301 [0,0,2,0,0,0|2,0,0]=4 371 B9R0.8 CCC(C)N(C)CCOC 2230a_200000740884_200000210301 [0,0,2,0,0,0|2,0,0]=4 372 B9R0.8 CCC(C)N(C)CCOC 269982a_100000741768_100000233755 [0,0,2,0,0,0|2,0,0]=4 373 B9R0.8 CCC(C)N(C)CCOC 269982a_100000743101_100000758301 [0,0,2,0,0,0|2,0,0]=4 374 B9R0.8 CCC(C)N(C)CCOC 269982a_200000740884_200000210301 [0,0,2,0,0,0|2,0,0]=4 375 B9R0.8 CCC(C)N(C)CCSC 2230a_100000686725_100000758301 [0,0,2,0,0,0|2,0,0]=4 376 B9R0.8 CCC(C)N(C)CCSC 2230a_100000741768_100000751147 [0,0,2,0,0,0|2,0,0]=4 377 B9R0.8 CCC(C)N(C)CCSC 269982a_100000686725_100000758301 [0,0,2,0,0,0|2,0,0]=4 378 B9R0.8 CCC(C)N(C)CCSC 269982a_100000741768_100000212216 [0,0,2,0,0,0|2,0,0]=4 379 B9R0.8 CCC(C)N([13CH3])CCOC 2230a_200000740884_200025704644 [0,0,2,0,0,0|2,0,0]=4 380 B9R0.8 CCC(C)N([13CH3])CCOC 269982a_200000740884_200025704644 [0,0,2,0,0,0|2,0,0]=4 381 B9R0.8 CCCCN(C)C(C)CC 2230a_100000207357_200000210301 [0,0,2,0,0,0|1,0,1]=4 382 B9R0.8 CCCCN(C)C(C)CC 2230a_100000207549_100000758301 [0,0,2,0,0,0|1,0,1]=4 383 B9R0.8 CCCCN(C)C(C)CC 2230a_100000741768_100000210211 [0,0,2,0,0,0|1,0,1]=4 384 B9R0.8 CCCCN(C)C(C)CC 269982a_100000207357_200000210301 [0,0,2,0,0,0|1,0,1]=4 385 B9R0.8 CCCCN(C)C(C)CC 269982a_100000207549_100000758301 [0,0,2,0,0,0|1,0,1]=4 386 B9R0.8 CCCCN(C)C(C)CC 269982a_100000741768_100000210211 [0,0,2,0,0,0|1,0,1]=4 387 B9R0.8 CCCCN([13CH3])C(C)CC 2230a_100000207357_200025704644 [0,0,2,0,0,0|1,0,1]=4 388 B9R0.8 CCCCN([13CH3])C(C)CC 269982a_100000207357_200025704644 [0,0,2,0,0,0|1,0,1]=4 389 B9R0.12 CCC(C)N(CC)CC=O 2230a_100000732650_200015260668 [0,0,2,0,0,0|2,0,0]=4 390 B9R0.12 CCC(C)N(CC)CC=O 269982a_100000732650_200015260668 [0,0,2,0,0,0|2,0,0]=4 391 B9R0.12 CCCC(CC)N(C)CC 269982a_100000225621_100011219200 [0,0,2,0,0,0|1,0,1]=4 392 B9R0.18 C#CCCC(=O)CCCC 1458a_100000210183_100000753159 [0,0,2,0,0,0|1,0,1]=4 393 B9R0.18 C#CCCC(=O)CCCC 1458a_100000692101_100000210211 [0,0,2,0,0,0|1,0,1]=4 394 B9R0.18 C/C=C/CC(=O)CCCC 1458a_100000210183_100102629194 [0,0,2,0,0,0|1,0,1]=4 395 B9R0.18 C=CCCC(=O)CCCC 1458a_100000210183_100000754431 [0,0,2,0,0,0|1,0,1]=4 396 B9R0.18 C=CCCC(=O)CCCC 1458a_100000749702_100000210211 [0,0,2,0,0,0|1,0,1]=4 397 B9R0.18 CC#CCC(=O)CCCC 1458a_100000210183_100000748600 [0,0,2,0,0,0|1,0,1]=4 398 B9R0.18 CC=CCC(=O)CCCC 1458a_100000210183_100000070051 [0,0,2,0,0,0|1,0,1]=4 399 B9R0.18 CC=CCC(=O)CCCC 1458a_100121576822_100000210211 [0,0,2,0,0,0|1,0,1]=4 400 B9R0.18 CCCCC(=O)CCC#N 1458a_100000210183_100011215226 [0,0,2,0,0,0|2,0,0]=4 401 B9R0.18 CCCCC(=O)CCC#N 1458a_100011934036_100000210211 [0,0,2,0,0,0|2,0,0]=4 402 B9R0.18 CCCCC(=O)CCCC 1458a_100000210183_100000210211 [0,0,2,0,0,0|1,0,0]=3 403 B9R0.18 CCCCC(=O)CCCF 1458a_100000210183_100011934791 [0,0,2,0,0,0|2,0,0]=4 404 B9R0.18 CCCCC(=O)CCCO 1458a_100000210183_100011215043 [0,0,2,0,0,0|2,0,0]=4 405 B9R0.18 CCCCC(=O)CCOC 1458a_100000210183_100000233755 [0,0,2,0,0,0|1,0,0]=3 406 B9R0.18 CCCCC(=O)CCOC 1458a_100000749529_100000210211 [0,0,2,0,0,0|1,0,0]=3 407 B9R0.18 CCCCC(=O)CCSC 1458a_100000174002_100000210211 [0,0,2,0,0,0|1,0,0]=3 408 B9R0.18 CCCCC(=O)CCSC 1458a_100000210183_100000751147 [0,0,2,0,0,0|1,0,0]=3 409 B9R0.18 CCCCC(=O)COCC 1458a_100000211967_100000210211 [0,0,2,0,0,0|2,0,0]=4 410 B9R0.18 CCCCC(=O)CSCC 1458a_100000230394_100000210211 [0,0,2,0,0,0|2,0,0]=4 411 B9R0.18 CCCCC(=O)NCCC 11a_100020643023_100000210183 [0,0,2,0,0,0|2,0,0]=4 412 B9R0.18 CCCCC(=O)NCCC 1626a_100020643023_100000210183 [0,0,2,0,0,0|2,0,0]=4 413 B9R0.18 CCCCC(=O)NCCC 240690a_100020643023_100000210183 [0,0,2,0,0,0|2,0,0]=4 414 B9R0.18 CCCCC(=O)NCCC 527a_100020643023_100000210183 [0,0,2,0,0,0|2,0,0]=4 415 B9R0.18 CCCNC(=O)CCOC 11a_100020643023_100000749529 [0,0,2,0,0,0|2,0,0]=4 416 B9R0.18 CCCNC(=O)CCOC 1626a_100020643023_100000749529 [0,0,2,0,0,0|2,0,0]=4 417 B9R0.18 CCCNC(=O)CCOC 240690a_100020643023_100000749529 [0,0,2,0,0,0|2,0,0]=4 418 B9R0.18 CCCNC(=O)CCOC 527a_100020643023_100000749529 [0,0,2,0,0,0|2,0,0]=4 419 B9R0.18 CCCNC(=O)CCSC 11a_100020643023_100000174002 [0,0,2,0,0,0|2,0,0]=4 420 B9R0.18 CCCNC(=O)CCSC 1626a_100020643023_100000174002 [0,0,2,0,0,0|2,0,0]=4 421 B9R0.18 CCCNC(=O)CCSC 240690a_100020643023_100000174002 [0,0,2,0,0,0|2,0,0]=4 422 B9R0.18 CCCNC(=O)CCSC 527a_100020643023_100000174002 [0,0,2,0,0,0|2,0,0]=4 423 B9R0.18 CCCOC(=O)OCNC 34a_100102657272_200000139673 [0,0,2,0,0,0|2,0,0]=4 424 B9R0.18 CCCOC(=O)OCNC 7a_106832991635_200000139673 [0,0,2,0,0,0|2,0,0]=4 425 B9R0.18 CCOCC(=O)CCOC 1458a_100000211967_100000233755 [0,0,2,0,0,0|2,0,0]=4 426 B9R0.18 CCOCC(=O)CCSC 1458a_100000211967_100000751147 [0,0,2,0,0,0|2,0,0]=4 427 B9R0.18 CCSCC(=O)CCOC 1458a_100000230394_100000233755 [0,0,2,0,0,0|2,0,0]=4 428 B9R0.18 CCSCC(=O)CCSC 1458a_100000230394_100000751147 [0,0,2,0,0,0|2,0,0]=4 429 B9R0.18 COCCC(=O)CCCF 1458a_100000749529_100011934791 [0,0,2,0,0,0|2,0,0]=4 430 B9R0.18 COCCC(=O)CCCO 1458a_100000749529_100011215043 [0,0,2,0,0,0|2,0,0]=4 431 B9R0.18 COCCC(=O)CCOC 1458a_100000749529_100000233755 [0,0,2,0,0,0|2,0,0]=4 432 B9R0.18 COCCC(=O)CCSC 1458a_100000174002_100000233755 [0,0,2,0,0,0|2,0,0]=4 433 B9R0.18 COCCC(=O)CCSC 1458a_100000749529_100000751147 [0,0,2,0,0,0|2,0,0]=4 434 B9R0.18 CSCCC(=O)CCCF 1458a_100000174002_100011934791 [0,0,2,0,0,0|2,0,0]=4 435 B9R0.18 CSCCC(=O)CCCO 1458a_100000174002_100011215043 [0,0,2,0,0,0|2,0,0]=4 436 B9R0.18 CSCCC(=O)CCSC 1458a_100000174002_100000751147 [0,0,2,0,0,0|2,0,0]=4 437 B9R0.26 CCC(=O)CC(CC)CC 1458a_100000210414_100011215472 [0,0,2,0,0,0|1,0,0]=3 438 B9R0.26 CCC(=O)CC(OC)OC 1458a_100000082724_100000210202 [0,0,2,0,0,0|2,0,0]=4 439 B9R0.26 CCC(=O)CC(OC)OC 1458a_100000210414_100000751394 [0,0,2,0,0,0|2,0,0]=4 440 B9R0.26 CCC(=O)CN(CC)CC 1458a_100000758533_100000210202 [0,0,2,0,0,0|2,0,0]=4 441 B9R0.26 CCC(=O)CN(CC)CC 269956a_100000042499_100000747405 [0,0,2,0,0,0|2,0,0]=4 442 B9R0.26 CCC(=O)CN(CC)CC 269982a_100000724800_100000747405 [0,0,2,0,0,0|2,0,0]=4 443 B9R0.26 CCC(=O)NC(CC)CC 11a_100000199018_100000210414 [0,0,2,0,0,0|2,0,0]=4 444 B9R0.26 CCC(=O)NC(CC)CC 1626a_100000199018_100000210414 [0,0,2,0,0,0|2,0,0]=4 445 B9R0.26 CCC(=O)NC(CC)CC 240690a_100000199018_100000210414 [0,0,2,0,0,0|2,0,0]=4 446 B9R0.26 CCC(=O)NC(CC)CC 527a_100000199018_100000210414 [0,0,2,0,0,0|2,0,0]=4 447 B9R0.26 CCC(C)CC(CC)NC 270004a_106832991635_100000184709 [0,0,2,0,0,0|1,0,1]=4 448 B9R0.26 CCC(CC)CC(=O)CO 1458a_100000210174_100011215472 [0,0,2,0,0,0|2,0,0]=4 449 B9R0.26 CC[C@@H](CC(=O)OC)OC 7a_200015357724_200000210301 [0,0,2,0,0,0|2,0,0]=4 450 B9R0.26 CC[C@@H](CC(=O)OC)O[13CH3] 7a_200015357724_200025704644 [0,0,2,0,0,0|2,0,0]=4 451 B9R0.39 CCC(NC(=O)C)C(C)C 11a_100000745074_100015343762 [0,0,2,0,0,0|2,0,0]=4 452 B9R0.39 CCC(NC(=O)C)C(C)C 1626a_100000745074_100015343762 [0,0,2,0,0,0|2,0,0]=4 453 B9R0.39 CCC(NC(=O)C)C(C)C 240690a_100000745074_100015343762 [0,0,2,0,0,0|2,0,0]=4 454 B9R0.39 CCC(NC(=O)C)C(C)C 527a_100000745074_100103153847 [0,0,2,0,0,0|2,0,0]=4 455 B9R0.48 C=C(C)CCN(C)CCC 2230a_100000747261_100000730704 [0,0,2,0,0,0|1,0,0]=3 456 B9R0.48 C=C(C)CCN(C)CCC 269982a_100000747261_100000730704 [0,0,2,0,0,0|1,0,0]=3 457 B9R0.48 C=C(C)CCN(C)CCO 2230a_100000210263_100000730704 [0,0,2,0,0,0|2,0,0]=4 458 B9R0.48 C=C(C)CCN(C)CCO 269982a_100000210263_100000730704 [0,0,2,0,0,0|2,0,0]=4 459 B9R0.48 C=CCN(C)CCC(=O)C 269982a_100000225617_100000053229 [0,0,2,0,0,0|0,0,2]=4 460 B9R0.48 CC(=O)CCN(C)CCO 269982a_100000210263_100000053229 [0,0,2,0,0,0|1,0,0]=3 461 B9R0.48 CC(=O)OCN(C)CCO 269982a_100000210263_100000076356 [0,0,2,0,0,0|2,0,0]=4 462 B9R0.48 CCCC(C)OCC(=O)C 34a_100000211253_100000766640 [0,0,2,0,0,0|2,0,0]=4 463 B9R0.48 CCCN(C)CC=C(C)C 2230a_100000747261_100000761012 [0,0,2,0,0,0|1,0,1]=4 464 B9R0.48 CCCN(C)CC=C(C)C 269982a_100000747261_100000761012 [0,0,2,0,0,0|1,0,1]=4 465 B9R0.48 CCCN(C)CCC(=O)C 269982a_100000747261_100000053229 [0,0,2,0,0,0|0,0,0]=2 466 B9R0.48 CCCN(C)CCC(=O)N 2230a_100000730477_100000210303 [0,0,2,0,0,0|1,0,0]=3 467 B9R0.48 CCCN(C)CCC(=O)N 2230a_100000747261_100000744528 [0,0,2,0,0,0|1,0,0]=3 468 B9R0.48 CCCN(C)CCC(=O)N 269982a_100000747261_100000744528 [0,0,2,0,0,0|1,0,0]=3 469 B9R0.48 CCCN(C)CCC(C)C 2230a_100000742789_100000210303 [0,0,2,0,0,0|1,0,1]=4 470 B9R0.48 CCCN(C)CCC(C)C 2230a_100000747261_100000210312 [0,0,2,0,0,0|1,0,1]=4 471 B9R0.48 CCCN(C)CCC(C)C 269982a_100000742789_100000210303 [0,0,2,0,0,0|1,0,1]=4 472 B9R0.48 CCCN(C)CCC(C)C 269982a_100000747261_100000210312 [0,0,2,0,0,0|1,0,1]=4 473 B9R0.48 CCCN(C)CCC(C)O 2230a_100000747261_100012276601 [0,0,2,0,0,0|0,0,2]=4 474 B9R0.48 CCCN(C)CCC(C)O 269982a_100000747261_100012276601 [0,0,2,0,0,0|0,0,2]=4 475 B9R0.48 CCCN(C)CCN(C)C 2230a_100000226821_200000210301 [0,0,2,0,0,0|2,0,0]=4 476 B9R0.48 CCCN(C)CCN(C)C 269982a_100000225618_100000210303 [0,0,2,0,0,0|2,0,0]=4 477 B9R0.48 CCCN(C)CCN(C)C 269982a_100000226821_200000210301 [0,0,2,0,0,0|2,0,0]=4 478 B9R0.48 CCCN(C)CCN(C)C 269982a_100000747261_100000755713 [0,0,2,0,0,0|2,0,0]=4 479 B9R0.48 CCCN(C)COC(=O)C 269982a_100000747261_100000076356 [0,0,2,0,0,0|1,0,0]=3 480 B9R0.48 CCCN([13CH3])CCN(C)C 2230a_100000226821_200025704644 [0,0,2,0,0,0|2,0,0]=4 481 B9R0.48 CCCN([13CH3])CCN(C)C 269982a_100000226821_200025704644 [0,0,2,0,0,0|2,0,0]=4 482 B9R0.48 CN(CCF)CCC(=O)N 2230a_100000730477_100011217306 [0,0,2,0,0,0|2,0,0]=4 483 B9R0.48 CN(CCO)CCC(=O)N 2230a_100000210263_100000744528 [0,0,2,0,0,0|2,0,0]=4 484 B9R0.48 CN(CCO)CCC(=O)N 2230a_100000730477_100000211926 [0,0,2,0,0,0|2,0,0]=4 485 B9R0.48 CN(CCO)CCC(=O)N 269982a_100000210263_100000744528 [0,0,2,0,0,0|2,0,0]=4 486 B9R0.48 COCN(C)CCC(=O)N 2230a_100000730477_100000766300 [0,0,2,0,0,0|2,0,0]=4 487 B9R0.48 CSCN(C)CCC(=O)N 2230a_100000730477_100011218213 [0,0,2,0,0,0|2,0,0]=4 488 B9R0.2 C#CCCCCCC(=O)C 1458a_100000070787_100012094781 [0,0,2,0,0,0|1,0,1]=4 489 B9R0.2 C#CCCCCCC(=O)C 1458a_100000694772_200000210301 [0,0,2,0,0,0|1,0,1]=4 490 B9R0.2 C#CCCCCCC(=O)[13CH3] 1458a_100000694772_200025704644 [0,0,2,0,0,0|1,0,1]=4 491 B9R0.2 C=C(C)COCCCNC 34a_100000213112_100000748629 [0,0,2,0,0,0|2,0,0]=4 492 B9R0.2 C=CCCCCCC(=O)C 1458a_100000070787_100000700193 [0,0,2,0,0,0|1,0,1]=4 493 B9R0.2 C=CCCCCCC(=O)C 1458a_100011934241_200000210301 [0,0,2,0,0,0|1,0,1]=4 494 B9R0.2 C=CCCCCCC(=O)[13CH3] 1458a_100011934241_200025704644 [0,0,2,0,0,0|1,0,1]=4 495 B9R0.2 CC(=O)CCCCCC#N 1458a_100000070787_100009813376 [0,0,2,0,0,0|2,0,0]=4 496 B9R0.2 CC(=O)CCCCCCF 1458a_100000070787_100015922095 [0,0,2,0,0,0|2,0,0]=4 497 B9R0.2 CC(=O)CCCCCCO 1458a_100000070787_100000766143 [0,0,2,0,0,0|2,0,0]=4 498 B9R0.2 CC(=O)CCCCCCO 1458a_100011996774_200000210301 [0,0,2,0,0,0|2,0,0]=4 499 B9R0.2 CC(=O)NCCCCN[13CH3] 2230a_200011368371_200025704644 [0,0,2,0,0,0|1,0,0]=3 500 B9R0.2 CC(=O)NCCCCN[13CH3] 34a_200011368371_200025704644 [0,0,2,0,0,0|1,0,0]=3 501 B9R0.2 CC(=O)OCCCCO[13CH3] 34a_100000073216_200025704644 [0,0,2,0,0,0|2,0,0]=4 502 B9R0.2 CC(=O)OCCCCO[13CH3] 7a_100000073216_200025704644 [0,0,2,0,0,0|2,0,0]=4 503 B9R0.2 CC(=O)OCCCCS[13CH3] 62a_100000033659_200025704644 [0,0,2,0,0,0|2,0,0]=4 504 B9R0.2 CC(=O)OCCCCS[13CH3] 62a_200025704644_100000033659 [0,0,2,0,0,0|2,0,0]=4 505 B9R0.2 CC(=O)SCCCCS[13CH3] 62a_200010402107_200025704644 [0,0,2,0,0,0|2,0,0]=4 506 B9R0.2 CC(=O)SCCCCS[13CH3] 62a_200025704644_200010402107 [0,0,2,0,0,0|2,0,0]=4 507 B9R0.2 CC(C)CCCCCN[13CH3] 2230a_100011290863_200025704644 [0,0,2,0,0,0|1,0,1]=4 508 B9R0.2 CC(C)CCCCCN[13CH3] 34a_100011290863_200025704644 [0,0,2,0,0,0|1,0,1]=4 509 B9R0.2 CCCCCCCC(=O)C 1458a_100000070787_100000210614 [0,0,2,0,0,0|1,0,0]=3 510 B9R0.2 CCCCCCCC(=O)C 1458a_100000211969_200000210301 [0,0,2,0,0,0|1,0,0]=3 511 B9R0.2 CCCCCCCC(=O)[13CH3] 1458a_100000211969_200025704644 [0,0,2,0,0,0|1,0,0]=3 512 B9R0.2 CCCCCCNC(=O)C 11a_100000210581_100015343762 [0,0,2,0,0,0|2,0,0]=4 513 B9R0.2 CCCCCCNC(=O)C 1626a_100000210581_100015343762 [0,0,2,0,0,0|2,0,0]=4 514 B9R0.2 CCCCCCNC(=O)C 240690a_100000210581_100015343762 [0,0,2,0,0,0|2,0,0]=4 515 B9R0.2 CCCCCCNC(=O)C 527a_100000210581_100103153847 [0,0,2,0,0,0|2,0,0]=4 516 B9R0.2 CCCCCOCC(=O)C 34a_100000211253_100000718602 [0,0,2,0,0,0|2,0,0]=4 517 B9R0.2 CCCCNCCC(=O)C 7a_106832991798_100000053229 [0,0,2,0,0,0|2,0,0]=4 518 B9R0.2 CCCCOCCC(=O)C 1458a_100000070787_100000743108 [0,0,2,0,0,0|2,0,0]=4 519 B9R0.2 CCCCOCCC(=O)C 34a_100000759926_100000210210 [0,0,2,0,0,0|2,0,0]=4 520 B9R0.2 CCCCOCCC(=O)C 7a_100000210227_100000053229 [0,0,2,0,0,0|2,0,0]=4 521 B9R0.2 CCCCOCCC(=O)C 7a_100000759926_100000210211 [0,0,2,0,0,0|2,0,0]=4 522 B9R0.2 CCCCSCCC(=O)C 62a_100000053229_100000210210 [0,0,2,0,0,0|2,0,0]=4 523 B9R0.2 CCCCSCCC(=O)C 62a_100000210211_100000053229 [0,0,2,0,0,0|2,0,0]=4 524 B9R0.2 CCCOCCCC(=O)C 34a_100000210258_100000685027 [0,0,2,0,0,0|2,0,0]=4 525 B9R0.2 CCCOCCCC(=O)C 34a_100000759063_100000210303 [0,0,2,0,0,0|2,0,0]=4 526 B9R0.2 CCCOCCCC(=O)C 7a_100000759063_100000210303 [0,0,2,0,0,0|2,0,0]=4 527 B9R0.2 CCCSCCCC(=O)C 62a_100000210303_100011215641 [0,0,2,0,0,0|2,0,0]=4 528 B9R0.2 CCCSCCCC(=O)C 62a_100011215641_100000210303 [0,0,2,0,0,0|2,0,0]=4 529 B9R0.2 CCOCCCCC(=O)C 34a_100121572206_100009817362 [0,0,2,0,0,0|2,0,0]=4 530 B9R0.2 CCSCCCCC(=O)C 62a_100000210202_100000735457 [0,0,2,0,0,0|2,0,0]=4 531 B9R0.2 CCSCCCCC(=O)C 62a_100000735457_100000210202 [0,0,2,0,0,0|2,0,0]=4 532 B9R0.2 CNCCCCCC(=O)N 2230a_106832991635_100009817443 [0,0,2,0,0,0|1,0,0]=3 533 B9R0.2 CNCCCCCC(=O)N 34a_100102657272_100009817443 [0,0,2,0,0,0|1,0,0]=3 534 B9R0.2 CNCCCCCC(=O)N 7a_106832991635_100009817443 [0,0,2,0,0,0|1,0,0]=3 535 B9R0.2 CNCCCCCC(C)C 2230a_100011290863_200000210301 [0,0,2,0,0,0|1,0,1]=4 536 B9R0.2 CNCCCCCC(C)C 2230a_106832991635_100000210682 [0,0,2,0,0,0|1,0,1]=4 537 B9R0.2 CNCCCCCC(C)C 34a_100011290863_200000210301 [0,0,2,0,0,0|1,0,1]=4 538 B9R0.2 CNCCCCCC(C)C 34a_100102657272_100000210682 [0,0,2,0,0,0|1,0,1]=4 539 B9R0.2 CNCCCCCC(C)C 7a_106832991635_100000210682 [0,0,2,0,0,0|1,0,1]=4 540 B9R0.2 CNCCCCNC(=O)C 2230a_200011368371_200000210301 [0,0,2,0,0,0|1,0,0]=3 541 B9R0.2 CNCCCCNC(=O)C 34a_200011368371_200000210301 [0,0,2,0,0,0|1,0,0]=3 542 B9R0.2 CNCCCCOC(=O)C 34a_100102657272_100000033659 [0,0,2,0,0,0|1,0,0]=3 543 B9R0.2 CNCCCCOC(=O)C 7a_106832991635_100000033659 [0,0,2,0,0,0|1,0,0]=3 544 B9R0.2 CNCCCCSC(=O)C 2230a_106832991635_200010402107 [0,0,2,0,0,0|1,0,0]=3 545 B9R0.2 CNCCCCSC(=O)C 34a_100102657272_200010402107 [0,0,2,0,0,0|1,0,0]=3 546 B9R0.2 CNCCCCSC(=O)C 7a_106832991635_200010402107 [0,0,2,0,0,0|1,0,0]=3 547 B9R0.2 CNCCCOCC(=O)N 34a_100000213112_100000187820 [0,0,2,0,0,0|2,0,0]=4 548 B9R0.2 CNCCCOCC(=O)[O-] 34a_100000213112_100020667443 [0,0,2,0,0,0|2,0,0]=4 549 B9R0.2 CNCOCCOC(=O)C 34a_100102657272_100000076355 [0,0,2,0,0,0|2,0,0]=4 550 B9R0.2 COCCCCCC(=O)C 1458a_100011935119_200000210301 [0,0,2,0,0,0|1,0,0]=3 551 B9R0.2 COCCCCCC(=O)N 34a_100000123541_200000210301 [0,0,2,0,0,0|2,0,0]=4 552 B9R0.2 COCCCCCC(=O)N 34a_100138415774_100009817443 [0,0,2,0,0,0|2,0,0]=4 553 B9R0.2 COCCCCCC(=O)N 7a_100000123541_200000210301 [0,0,2,0,0,0|2,0,0]=4 554 B9R0.2 COCCCCCC(=O)[13CH3] 1458a_100011935119_200025704644 [0,0,2,0,0,0|1,0,0]=3 555 B9R0.2 COCCCCCC(=O)[O-] 7a_100102619762_200000210301 [0,0,2,0,0,0|2,0,0]=4 556 B9R0.2 COCCCCOC(=O)C 34a_100000073216_200000210301 [0,0,2,0,0,0|2,0,0]=4 557 B9R0.2 COCCCCOC(=O)C 34a_100138415774_100000033659 [0,0,2,0,0,0|2,0,0]=4 558 B9R0.2 COCCCCOC(=O)C 7a_100000073216_200000210301 [0,0,2,0,0,0|2,0,0]=4 559 B9R0.2 COCCCCSC(=O)C 34a_100138415774_200010402107 [0,0,2,0,0,0|2,0,0]=4 560 B9R0.2 COCCCOCC(=O)C 34a_100000211253_100000740836 [0,0,2,0,0,0|2,0,0]=4 561 B9R0.2 COCCOCCC(=O)C 1458a_100000070787_100000695917 [0,0,2,0,0,0|2,0,0]=4 562 B9R0.2 COCCOCCC(=O)C 1458a_100000745395_200000210301 [0,0,2,0,0,0|2,0,0]=4 563 B9R0.2 COCCOCCC(=O)C 34a_100000759926_100011201679 [0,0,2,0,0,0|2,0,0]=4 564 B9R0.2 COCCOCCC(=O)C 7a_100000759926_100000233755 [0,0,2,0,0,0|2,0,0]=4 565 B9R0.2 COCCOCCC(=O)[13CH3] 1458a_100000745395_200025704644 [0,0,2,0,0,0|2,0,0]=4 566 B9R0.2 COCCSCCC(=O)C 62a_100000053229_100000233755 [0,0,2,0,0,0|2,0,0]=4 567 B9R0.2 COCCSCCC(=O)C 62a_100000233755_100000053229 [0,0,2,0,0,0|2,0,0]=4 568 B9R0.2 COCSCCCC(=O)C 62a_100000766300_100011215641 [0,0,2,0,0,0|2,0,0]=4 569 B9R0.2 COCSCCCC(=O)C 62a_100011215641_100000766300 [0,0,2,0,0,0|2,0,0]=4 570 B9R0.2 CSCCCCCC(=O)N 62a_100009817443_200000210301 [0,0,2,0,0,0|2,0,0]=4 571 B9R0.2 CSCCCCCC(=O)N 62a_200000210301_100009817443 [0,0,2,0,0,0|2,0,0]=4 572 B9R0.2 CSCCCCOC(=O)C 62a_100000033659_200000210301 [0,0,2,0,0,0|2,0,0]=4 573 B9R0.2 CSCCCCOC(=O)C 62a_200000210301_100000033659 [0,0,2,0,0,0|2,0,0]=4 574 B9R0.2 CSCCCCSC(=O)C 62a_200000210301_200010402107 [0,0,2,0,0,0|2,0,0]=4 575 B9R0.2 CSCCCCSC(=O)C 62a_200010402107_200000210301 [0,0,2,0,0,0|2,0,0]=4 576 B9R0.2 CSCCOCCC(=O)C 34a_100000759926_100000212216 [0,0,2,0,0,0|2,0,0]=4 577 B9R0.2 CSCCOCCC(=O)C 7a_100000230434_100000053229 [0,0,2,0,0,0|2,0,0]=4 578 B9R0.2 CSCCOCCC(=O)C 7a_100000759926_100000212216 [0,0,2,0,0,0|2,0,0]=4 579 B9R0.2 CSCCSCCC(=O)C 62a_100000053229_100000751147 [0,0,2,0,0,0|2,0,0]=4 580 B9R0.2 CSCCSCCC(=O)C 62a_100000212216_100000053229 [0,0,2,0,0,0|2,0,0]=4 581 B9R0.2 CSCOCCCC(=O)C 34a_100000759063_100011218213 [0,0,2,0,0,0|2,0,0]=4 582 B9R0.2 CSCSCCCC(=O)C 62a_100011215641_100011218213 [0,0,2,0,0,0|2,0,0]=4 583 B9R0.2 CSCSCCCC(=O)C 62a_100011218213_100011215641 [0,0,2,0,0,0|2,0,0]=4 584 B9R0.2 [13CH3]C(=O)CCCCCCO 1458a_100011996774_200025704644 [0,0,2,0,0,0|2,0,0]=4 585 B9R0.2 [13CH3]OCCCCCC(=O)N 34a_100000123541_200025704644 [0,0,2,0,0,0|2,0,0]=4 586 B9R0.2 [13CH3]OCCCCCC(=O)N 7a_100000123541_200025704644 [0,0,2,0,0,0|2,0,0]=4 587 B9R0.2 [13CH3]OCCCCCC(=O)[O-] 7a_100102619762_200025704644 [0,0,2,0,0,0|2,0,0]=4 588 B9R0.2 [13CH3]SCCCCCC(=O)N 62a_100009817443_200025704644 [0,0,2,0,0,0|2,0,0]=4 589 B9R0.2 [13CH3]SCCCCCC(=O)N 62a_200025704644_100009817443 [0,0,2,0,0,0|2,0,0]=4 590 B9R0.14 CCCC(CC)NC(=O)C 11a_100000747048_100015343762 [0,0,2,0,0,0|2,0,0]=4 591 B9R0.14 CCCC(CC)NC(=O)C 1626a_100000747048_100015343762 [0,0,2,0,0,0|2,0,0]=4 592 B9R0.14 CCCC(CC)NC(=O)C 240690a_100000747048_100015343762 [0,0,2,0,0,0|2,0,0]=4 593 B9R0.14 CCCC(CC)NC(=O)C 527a_100000747048_100103153847 [0,0,2,0,0,0|2,0,0]=4 594 B9R0.40 C=CCC(CCCC)OC 34a_200011216941_200000210301 [0,0,2,0,0,0|2,0,0]=4 595 B9R0.40 C=CCC(CCCC)OC 7a_200011216941_200000210301 [0,0,2,0,0,0|2,0,0]=4 596 B9R0.40 C=CCC(CCCC)O[13CH3] 34a_200011216941_200025704644 [0,0,2,0,0,0|2,0,0]=4 597 B9R0.40 C=CCC(CCCC)O[13CH3] 7a_200011216941_200025704644 [0,0,2,0,0,0|2,0,0]=4 598 B9R0.40 CCCCC(CCC)NC 34a_100102657272_100000211913 [0,0,2,0,0,0|1,0,1]=4 599 B9R0.40 CCCCC(CCC)NC 7a_106832991635_100000211913 [0,0,2,0,0,0|1,0,1]=4 600 B9R0.40 CCCCN(CC)CC=O 2230a_100000207695_200015260668 [0,0,2,0,0,0|2,0,0]=4 601 B9R0.40 CCCCN(CC)CC=O 269982a_100000207695_200015260668 [0,0,2,0,0,0|2,0,0]=4 602 B9R0.46 CCC(C)CCNCC=O 2230a_100020591266_200015260668 [0,0,2,0,0,0|2,0,0]=4 603 B9R0.46 CCC(C)CCOCC=O 7a_100011215188_200015260668 [0,0,2,0,0,0|2,0,0]=4 604 B9R0.46 CCC(C)NCCCC=O 2230a_100000209981_200011292268 [0,0,2,0,0,0|2,0,0]=4 605 B9R0.46 CCC(C)OCCCC=O 7a_100000210228_200011292268 [0,0,2,0,0,0|2,0,0]=4 606 B9R0.46 CCC(C)SCCCC=O 62a_100000758301_200011292268 [0,0,2,0,0,0|2,0,0]=4 607 B9R0.46 CCC(C)SCCCC=O 62a_200011292268_100000758301 [0,0,2,0,0,0|2,0,0]=4 608 B9R0.46 CCCCCCC(C)NC 2230a_100000210919_200000210301 [0,0,2,0,0,0|1,0,1]=4 609 B9R0.46 CCCCCCC(C)NC 2230a_106832991635_100011215978 [0,0,2,0,0,0|1,0,1]=4 610 B9R0.46 CCCCCCC(C)NC 270004a_106832991635_100000210826 [0,0,2,0,0,0|1,0,1]=4 611 B9R0.46 CCCCCCC(C)NC 34a_100000210919_200000210301 [0,0,2,0,0,0|1,0,1]=4 612 B9R0.46 CCCCCCC(C)NC 34a_100102657272_100011215978 [0,0,2,0,0,0|1,0,1]=4 613 B9R0.46 CCCCCCC(C)NC 7a_106832991635_100011215978 [0,0,2,0,0,0|1,0,1]=4 614 B9R0.46 CCCCCCC(C)N[13CH3] 2230a_100000210919_200025704644 [0,0,2,0,0,0|1,0,1]=4 615 B9R0.46 CCCCCCC(C)N[13CH3] 34a_100000210919_200025704644 [0,0,2,0,0,0|1,0,1]=4 616 B9R0.46 CCN(C)CCCCC=O 2230a_100000225621_100000139335 [0,0,2,0,0,0|2,0,0]=4 617 B9R0.46 CCN(C)CCCCC=O 269982a_100000225621_100000139335 [0,0,2,0,0,0|2,0,0]=4 618 B9R0.46 COC(C)CCOCC=O 7a_100000764861_200015260668 [0,0,2,0,0,0|2,0,0]=4 619 B9R0.46 COC(C)SCCCC=O 62a_100009879195_200011292268 [0,0,2,0,0,0|2,0,0]=4 620 B9R0.46 COC(C)SCCCC=O 62a_200011292268_100009879195 [0,0,2,0,0,0|2,0,0]=4 621 B11R2.36 CN1CCN2CCC[C@@H]2C1 2230a_100000008389_200000210301 [0,0,1,1,0,0|2,0,0]=4 622 B11R2.36 CN1CCN2CCC[C@@H]2C1 269982a_100000008389_200000210301 [0,0,1,1,0,0|2,0,0]=4 623 B11R2.36 CN1CCN2CCC[C@@H]2C1 34a_100000008389_200000210301 [0,0,1,1,0,0|2,0,0]=4 624 B11R2.36 [13CH3]N1CCN2CCC[C@@H]2C1 2230a_100000008389_200025704644 [0,0,1,1,0,0|2,0,0]=4 625 B11R2.36 [13CH3]N1CCN2CCC[C@@H]2C1 269982a_100000008389_200025704644 [0,0,1,1,0,0|2,0,0]=4 626 B11R2.36 [13CH3]N1CCN2CCC[C@@H]2C1 34a_100000008389_200025704644 [0,0,1,1,0,0|2,0,0]=4 627 B11R2.66 CN1CC[C@H]2[C@@H]1CN(C2)[13CH3] 2230a_100132300928_200025704644 [0,0,1,1,0,0|2,0,0]=4 628 B11R2.66 CN1CC[C@H]2[C@@H]1CN(C2)[13CH3] 269982a_100132300928_200025704644 [0,0,1,1,0,0|2,0,0]=4 629 B11R2.66 CN1CC[C@H]2[C@@H]1CN(C2)[13CH3] 34a_100132300928_200025704644 [0,0,1,1,0,0|2,0,0]=4 630 B11R2.66 CN1C[C@H]2CCN([C@H]2C1)C 2230a_100132300928_200000210301 [0,0,1,1,0,0|2,0,0]=4 631 B11R2.66 CN1C[C@H]2CCN([C@H]2C1)C 269982a_100132300928_200000210301 [0,0,1,1,0,0|2,0,0]=4 632 B11R2.66 CN1C[C@H]2CCN([C@H]2C1)C 34a_100132300928_200000210301 [0,0,1,1,0,0|2,0,0]=4 633 B9R1.41 CC(=O)C1CCCC1=O 1458a_100000070787_100000211823 [0,0,1,0,1,0|2,0,0]=4 634 B9R1.41 CC(=O)C1CCCC1C 1458a_100000690547_200000210301 [0,0,1,0,1,0|1,0,0]=3 635 B9R1.41 CC(=O)N1CCC[C@@H]1C 240690a_100020605311_100015343762 [0,0,1,0,1,0|2,0,0]=4 636 B9R1.41 CC(=O)N1CCC[C@@H]1C 527a_100020605311_100103153847 [0,0,1,0,1,0|2,0,0]=4 637 B9R1.41 CC(=O)N1CCC[C@H]1C 11a_100015189458_100015343762 [0,0,1,0,1,0|2,0,0]=4 638 B9R1.41 CC(=O)N1CCC[C@H]1C 240690a_100015189458_100015343762 [0,0,1,0,1,0|2,0,0]=4 639 B9R1.41 CC(=O)N1CCC[C@H]1C 527a_100015189458_100103153847 [0,0,1,0,1,0|2,0,0]=4 640 B9R1.41 CC(=O)[C@@H]1CCCN1C 1458a_100009816429_200000210301 [0,0,1,0,1,0|0,0,0]=2 641 B9R1.41 CC(C)C1CCCN1C 2230a_100000762757_200000210301 [0,0,1,0,1,0|1,0,1]=4 642 B9R1.41 CC(C)C1CCCN1C 269982a_100000762757_200000210301 [0,0,1,0,1,0|1,0,1]=4 643 B9R1.41 CC(C)C1CCCN1C 34a_100000762757_200000210301 [0,0,1,0,1,0|1,0,1]=4 644 B9R1.41 CC(C)C1CCCN1[13CH3] 2230a_100000762757_200025704644 [0,0,1,0,1,0|1,0,1]=4 645 B9R1.41 CC(C)C1CCCN1[13CH3] 269982a_100000762757_200025704644 [0,0,1,0,1,0|1,0,1]=4 646 B9R1.41 CC(C)C1CCCN1[13CH3] 34a_100000762757_200025704644 [0,0,1,0,1,0|1,0,1]=4 647 B9R1.41 CC1CCCC1C(=O)[13CH3] 1458a_100000690547_200025704644 [0,0,1,0,1,0|1,0,0]=3 648 B9R1.41 CN1CCC[C@H]1C(=O)N 2230a_100000003125_200000210301 [0,0,1,0,1,0|1,0,0]=3 649 B9R1.41 CN1CCC[C@H]1C(=O)O 269956a_100000743916_200000210301 [0,0,1,0,1,0|1,0,0]=3 650 B9R1.41 CN1CCC[C@H]1C(=O)[13CH3] 1458a_100009816429_200025704644 [0,0,1,0,1,0|0,0,0]=2 651 B9R1.41 CN1CCSC1C(=O)O 269956a_100000035718_200000210301 [0,0,1,0,1,0|2,0,0]=4 652 B9R1.41 CN1CSC[C@H]1C(=O)O 269956a_100000743924_200000210301 [0,0,1,0,1,0|2,0,0]=4 653 B9R1.41 [13CH3]N1CCC[C@H]1C(=O)N 2230a_100000003125_200025704644 [0,0,1,0,1,0|1,0,0]=3 654 B9R1.41 [13CH3]N1CCC[C@H]1C(=O)O 269956a_100000743916_200025704644 [0,0,1,0,1,0|1,0,0]=3 655 B9R1.41 [13CH3]N1CCSC1C(=O)O 269956a_100000035718_200025704644 [0,0,1,0,1,0|2,0,0]=4 656 B9R1.41 [13CH3]N1CSC[C@H]1C(=O)O 269956a_100000743924_200025704644 [0,0,1,0,1,0|2,0,0]=4 657 B9R2.24 CN1C2CCC1CC2 2230a_100000735658_200000210301 [1,0,0,0,1,0|0,0,0]=2 658 B9R2.24 CN1C2CCC1CC2 269982a_100000735658_200000210301 [1,0,0,0,1,0|0,0,0]=2 659 B9R2.24 CN1C2CCC1CC2 34a_100000735658_200000210301 [1,0,0,0,1,0|0,0,0]=2 660 B9R2.24 [13CH3]N1C2CCC1CC2 2230a_100000735658_200025704644 [1,0,0,0,1,0|0,0,0]=2 661 B9R2.24 [13CH3]N1C2CCC1CC2 269982a_100000735658_200025704644 [1,0,0,0,1,0|0,0,0]=2 662 B9R2.24 [13CH3]N1C2CCC1CC2 34a_100000735658_200025704644 [1,0,0,0,1,0|0,0,0]=2 663 B11R1.86 CC(=O)CC1CCCCN1C 1458a_100000070787_100015185383 [0,0,1,0,0,1|0,0,0]=2 664 B11R1.86 CC(=O)NC1CCCCC1C 11a_100000211402_100015343762 [0,0,1,0,0,1|2,0,0]=4 665 B11R1.86 CC(=O)NC1CCCCC1C 1626a_100000211402_100015343762 [0,0,1,0,0,1|2,0,0]=4 666 B11R1.86 CC(=O)NC1CCCCC1C 240690a_100000211402_100015343762 [0,0,1,0,0,1|2,0,0]=4 667 B11R1.86 CC(=O)NC1CCCCC1C 527a_100000211402_100103153847 [0,0,1,0,0,1|2,0,0]=4 668 B11R1.86 CC(C)CC1COCCN1C 2230a_100000755734_200000210301 [0,0,1,0,0,1|1,0,1]=4 669 B11R1.86 CC(C)CC1COCCN1C 269982a_100000755734_200000210301 [0,0,1,0,0,1|1,0,1]=4 670 B11R1.86 CC(C)CC1COCCN1C 34a_100000755734_200000210301 [0,0,1,0,0,1|1,0,1]=4 671 B11R1.86 CC(C)CC1COCCN1[13CH3] 2230a_100000755734_200025704644 [0,0,1,0,0,1|1,0,1]=4 672 B11R1.86 CC(C)CC1COCCN1[13CH3] 269982a_100000755734_200025704644 [0,0,1,0,0,1|1,0,1]=4 673 B11R1.86 CC(C)CC1COCCN1[13CH3] 34a_100000755734_200025704644 [0,0,1,0,0,1|1,0,1]=4 674 B11R1.86 CN(C)CC1CCCCN1C 2230a_100000746231_200000210301 [0,0,1,0,0,1|2,0,0]=4 675 B11R1.86 CN(C)CC1CCCCN1C 2230a_100015185953_200000210301 [0,0,1,0,0,1|2,0,0]=4 676 B11R1.86 CN(C)CC1CCCCN1C 269982a_100000746231_200000210301 [0,0,1,0,0,1|2,0,0]=4 677 B11R1.86 CN(C)CC1CCCCN1C 269982a_100015185953_200000210301 [0,0,1,0,0,1|2,0,0]=4 678 B11R1.86 CN(C)CC1CCCCN1C 269982a_100102631434_100015185383 [0,0,1,0,0,1|2,0,0]=4 679 B11R1.86 CN(C)CC1CCCCN1[13CH3] 2230a_100000746231_200025704644 [0,0,1,0,0,1|2,0,0]=4 680 B11R1.86 CN(C)CC1CCCCN1[13CH3] 269982a_100000746231_200025704644 [0,0,1,0,0,1|2,0,0]=4 681 B11R1.86 CN([13CH3])CC1CCCCN1C 2230a_100015185953_200025704644 [0,0,1,0,0,1|2,0,0]=4 682 B11R1.86 CN([13CH3])CC1CCCCN1C 269982a_100015185953_200025704644 [0,0,1,0,0,1|2,0,0]=4 683 B11R1.86 CN1CCCCC1CC(=O)N 2230a_100015184752_200000210301 [0,0,1,0,0,1|1,0,0]=3 684 B11R1.86 CN1CCCCC1CC(=O)N 269982a_100015184752_200000210301 [0,0,1,0,0,1|1,0,0]=3 685 B11R1.86 CN1CCCCC1CC(=O)N 34a_100015184752_200000210301 [0,0,1,0,0,1|1,0,0]=3 686 B11R1.86 [13CH3]N1CCCCC1CC(=O)N 2230a_100015184752_200025704644 [0,0,1,0,0,1|1,0,0]=3 687 B11R1.86 [13CH3]N1CCCCC1CC(=O)N 269982a_100015184752_200025704644 [0,0,1,0,0,1|1,0,0]=3 688 B11R1.86 [13CH3]N1CCCCC1CC(=O)N 34a_100015184752_200025704644 [0,0,1,0,0,1|1,0,0]=3 689 B11R1.90 C=C(C)COC1CCCC1C 34a_100011216460_100000748629 [0,0,1,0,0,1|2,0,0]=4 690 B11R1.90 C=C(C)COC1CCCC1C 7a_100011216460_100000748629 [0,0,1,0,0,1|2,0,0]=4 691 B11R1.90 CC(=O)CCC1CCCN1C 1458a_100000070787_100000005710 [0,0,1,0,0,1|0,0,0]=2 692 B11R1.90 CC(=O)CCN1CCC[C@@H]1C 269982a_100020605311_100000053229 [0,0,1,0,0,1|2,0,0]=4 693 B11R1.90 CC(=O)CCN1CCC[C@H]1C 269982a_100015189458_100000053229 [0,0,1,0,0,1|2,0,0]=4 694 B11R1.90 CC(=O)COC1CCCC1=O 34a_100000211253_100000709159 [0,0,1,0,0,1|2,0,0]=4 695 B11R1.90 CC(=O)NC[C@@H]1CCCN1C 240690a_100009821018_100015343762 [0,0,1,0,0,1|0,0,0]=2 696 B11R1.90 CC(=O)NC[C@@H]1CCCN1C 527a_100009821018_100103153847 [0,0,1,0,0,1|0,0,0]=2 697 B11R1.90 CC(=O)OCN1CCC[C@@H]1C 269982a_100020605311_100000076356 [0,0,1,0,0,1|2,0,0]=4 698 B11R1.90 CC(=O)OCN1CCC[C@H]1C 269982a_100015189458_100000076356 [0,0,1,0,0,1|2,0,0]=4 699 B11R1.90 CC(=O)OCN1CCC[C@H]1C 34a_100015189458_100009813279 [0,0,1,0,0,1|2,0,0]=4 700 B11R1.90 CC(C)OCC1CCCN1C 34a_100000743107_100000210206 [0,0,1,0,0,1|1,0,1]=4 701 B11R1.90 CC1CCCC1OCC(=O)N 34a_100011216460_100000187820 [0,0,1,0,0,1|2,0,0]=4 702 B11R1.90 CC1CCCC1OCC(=O)N 7a_100011216460_100000187820 [0,0,1,0,0,1|2,0,0]=4 703 B11R1.90 CC1CCCC1OCC(=O)[O-] 34a_100011216460_100020667443 [0,0,1,0,0,1|2,0,0]=4 704 B11R1.90 CN(C)CCC1CCCN1C 2230a_100102631434_100000005710 [0,0,1,0,0,1|2,0,0]=4 705 B11R1.90 CN(C)CCC1CCCN1C 269982a_100102631434_100000005710 [0,0,1,0,0,1|2,0,0]=4 706 B11R1.157 CC(=O)CC1CCCC(C1)C 1458a_100000748788_200000210301 [0,0,1,0,0,1|1,0,0]=3 707 B11R1.157 CC(=O)CC1CCCN(C1)C 1458a_100000070787_100015183302 [0,0,1,0,0,1|0,0,0]=2 708 B11R1.157 CC(=O)NC1CCCC(C1)C 11a_100011194320_100015343762 [0,0,1,0,0,1|2,0,0]=4 709 B11R1.157 CC(=O)NC1CCCC(C1)C 1626a_100011194320_100015343762 [0,0,1,0,0,1|2,0,0]=4 710 B11R1.157 CC(=O)NC1CCCC(C1)C 240690a_100011194320_100015343762 [0,0,1,0,0,1|2,0,0]=4 711 B11R1.157 CC(=O)NC1CCCC(C1)C 527a_100011194320_100103153847 [0,0,1,0,0,1|2,0,0]=4 712 B11R1.157 CC(=O)NC1CCCN(C1)C 2230a_106657272119_200000210301 [0,0,1,0,0,1|1,0,0]=3 713 B11R1.157 CC(=O)NC1CCCN(C1)C 269982a_106657272119_200000210301 [0,0,1,0,0,1|1,0,0]=3 714 B11R1.157 CC(=O)NC1CCCN(C1)[13CH3] 2230a_106657272119_200025704644 [0,0,1,0,0,1|1,0,0]=3 715 B11R1.157 CC(=O)NC1CCCN(C1)[13CH3] 269982a_106657272119_200025704644 [0,0,1,0,0,1|1,0,0]=3 716 B11R1.157 CC(=O)N[C@H]1CCCN(C1)C 240690a_100016992120_100015343762 [0,0,1,0,0,1|1,0,0]=3 717 B11R1.157 CC(=O)N[C@H]1CCCN(C1)C 527a_100016992120_100103153847 [0,0,1,0,0,1|1,0,0]=3 718 B11R1.157 CC1CCCC(C1)CC(=O)[13CH3] 1458a_100000748788_200025704644 [0,0,1,0,0,1|1,0,0]=3 719 B11R1.157 CN(C)CC1CCCN(C1)C 2230a_100000748423_200000210301 [0,0,1,0,0,1|2,0,0]=4 720 B11R1.157 CN(C)CC1CCCN(C1)C 2230a_100000756388_200000210301 [0,0,1,0,0,1|2,0,0]=4 721 B11R1.157 CN(C)CC1CCCN(C1)C 269982a_100000748423_200000210301 [0,0,1,0,0,1|2,0,0]=4 722 B11R1.157 CN(C)CC1CCCN(C1)C 269982a_100000756388_200000210301 [0,0,1,0,0,1|2,0,0]=4 723 B11R1.157 CN(C)CC1CCCN(C1)C 269982a_100102631434_100000752043 [0,0,1,0,0,1|2,0,0]=4 724 B11R1.157 CN(C)CC1CCCN(C1)[13CH3] 2230a_100000748423_200025704644 [0,0,1,0,0,1|2,0,0]=4 725 B11R1.157 CN(C)CC1CCCN(C1)[13CH3] 269982a_100000748423_200025704644 [0,0,1,0,0,1|2,0,0]=4 726 B11R1.157 CN([13CH3])CC1CCCN(C1)C 2230a_100000756388_200025704644 [0,0,1,0,0,1|2,0,0]=4 727 B11R1.157 CN([13CH3])CC1CCCN(C1)C 269982a_100000756388_200025704644 [0,0,1,0,0,1|2,0,0]=4 728 B11R1.157 CN1CCCC(C1)CC(=O)O 269956a_100015207179_200000210301 [0,0,1,0,0,1|1,0,0]=3 729 B11R1.157 CN1CCOC(C1)CC(=O)O 269956a_100015183369_200000210301 [0,0,1,0,0,1|2,0,0]=4 730 B11R1.157 [13CH3]N1CCCC(C1)CC(=O)O 269956a_100015207179_200025704644 [0,0,1,0,0,1|1,0,0]=3 731 B11R1.157 [13CH3]N1CCOC(C1)CC(=O)O 269956a_100015183369_200025704644 [0,0,1,0,0,1|2,0,0]=4 732 B11R1.13 C=CC[C@H]1CC=C[C@@H](N1C)C 2230a_200015295763_200000210301 [0,0,1,0,0,1|1,0,1]=4 733 B11R1.13 C=CC[C@H]1CC=C[C@@H](N1C)C 269982a_200015295763_200000210301 [0,0,1,0,0,1|1,0,1]=4 734 B11R1.13 C=CC[C@H]1CC=C[C@@H](N1[13CH3])C 2230a_200015295763_200025704644 [0,0,1,0,0,1|1,0,1]=4 735 B11R1.13 C=CC[C@H]1CC=C[C@@H](N1[13CH3])C 269982a_200015295763_200025704644 [0,0,1,0,0,1|1,0,1]=4