0 B13R2.6173 CC1(C2CCC1(C(C2)N[13CH3])C)C 2230a_100000716156_200025704644 [0,1,0,0,0,0|1,0,1]=3 1 B13R2.6173 CC1(C2CCC1(C(C2)N[13CH3])C)C 34a_100000716156_200025704644 [0,1,0,0,0,0|1,0,1]=3 2 B13R2.6173 CC1([C@H]2CC[C@@]1([C@@H](C2)O[13CH3])C)C 34a_100000686805_200025704644 [0,1,0,0,0,0|0,0,2]=3 3 B13R2.6173 CC1([C@H]2CC[C@@]1([C@@H](C2)O[13CH3])C)C 7a_100000686805_200025704644 [0,1,0,0,0,0|0,0,2]=3 4 B13R2.6173 CNC1CC2CCC1(C2(C)C)C 2230a_100000716156_200000210301 [0,1,0,0,0,0|1,0,1]=3 5 B13R2.6173 CNC1CC2CCC1(C2(C)C)C 34a_100000716156_200000210301 [0,1,0,0,0,0|1,0,1]=3 6 B13R2.6173 CO[C@@H]1C[C@@H]2CC[C@]1(C2(C)C)C 34a_100000686805_200000210301 [0,1,0,0,0,0|0,0,2]=3 7 B13R2.6173 CO[C@@H]1C[C@@H]2CC[C@]1(C2(C)C)C 7a_100000686805_200000210301 [0,1,0,0,0,0|0,0,2]=3 8 B11R1.21 CC(=O)C1CCN(C(=O)C1)C 1458a_100000043916_200000210301 [0,0,1,0,0,0|2,0,1]=4 9 B11R1.21 CC(C)N1CCN(C(=O)C1)C 2230a_100000187256_100000210206 [0,0,1,0,0,0|2,0,0]=3 10 B11R1.21 CC(C)N1CCN(C(=O)C1)C 269982a_100000187256_100000210206 [0,0,1,0,0,0|2,0,0]=3 11 B11R1.21 CC1CCC(CC1C)N(C)C 270004a_100102631434_100000759390 [0,0,1,0,0,0|2,0,1]=4 12 B11R1.21 CC1CCN(CC1O)C(C)C 2230a_100000696640_100000210206 [0,0,1,0,0,0|1,0,2]=4 13 B11R1.21 CC1CCN(CC1O)C(C)C 269982a_100000696640_100000210206 [0,0,1,0,0,0|1,0,2]=4 14 B11R1.21 CN1CCC(CC1=O)C(=O)[13CH3] 1458a_100000043916_200025704644 [0,0,1,0,0,0|2,0,1]=4 15 B11R1.126 C#CCN1CCC(C1(C)C)C 2230a_102516457003_100000038162 [0,0,1,0,0,0|2,0,1]=4 16 B11R1.126 C#CCN1CCC(C1(C)C)C 34a_102516457003_100000184674 [0,0,1,0,0,0|2,0,1]=4 17 B11R1.126 C=CCN1CCC(C1(C)C)C 2230a_102516457003_100000210623 [0,0,1,0,0,0|2,0,0]=3 18 B11R1.126 C=CCN1CCC(C1(C)C)C 269982a_102516457003_100000210623 [0,0,1,0,0,0|2,0,0]=3 19 B11R1.126 C=CCN1CCC(C1(C)C)C 34a_102516457003_100015514636 [0,0,1,0,0,0|2,0,0]=3 20 B11R1.126 CC1CCN(C1(C)C)CC#N 2230a_102516457003_100011215382 [0,0,1,0,0,0|2,0,1]=4 21 B11R1.126 CC1CCN(C1(C)C)CC#N 269982a_102516457003_100011214920 [0,0,1,0,0,0|2,0,1]=4 22 B11R1.126 CC1CCN(C1(C)C)CC=O 2230a_102516457003_200015260668 [0,0,1,0,0,0|1,0,0]=2 23 B11R1.126 CC1CCN(C1(C)C)CC=O 269982a_102516457003_200015260668 [0,0,1,0,0,0|1,0,0]=2 24 B11R1.126 CC1CCN(C1(C)C)CC=O 34a_102516457003_200009817547 [0,0,1,0,0,0|1,0,0]=2 25 B11R1.126 CC1CCN(C1(C)C)CCF 2230a_102516457003_100011217306 [0,0,1,0,0,0|2,0,1]=4 26 B11R1.126 CC1CCN(C1(C)C)CCF 269982a_102516457003_100011217306 [0,0,1,0,0,0|2,0,1]=4 27 B11R1.126 CC1CCN(C1(C)C)CCF 34a_102516457003_100011217306 [0,0,1,0,0,0|2,0,1]=4 28 B11R1.126 CC1CCN(C1(C)C)CCO 2230a_102516457003_100000211926 [0,0,1,0,0,0|1,0,2]=4 29 B11R1.126 CC1CCN(C1(C)C)CCO 269982a_102516457003_100000211926 [0,0,1,0,0,0|1,0,2]=4 30 B11R1.126 CC1CCN(C1(C)C)CCO 34a_102516457003_100000211926 [0,0,1,0,0,0|1,0,2]=4 31 B11R1.126 CCCN1CCC(C1(C)C)C 2230a_102516457003_100000210303 [0,0,1,0,0,0|2,0,1]=4 32 B11R1.126 CCCN1CCC(C1(C)C)C 269982a_102516457003_100000210303 [0,0,1,0,0,0|2,0,1]=4 33 B11R1.126 CCCN1CCC(C1(C)C)C 34a_102516457003_100000210303 [0,0,1,0,0,0|2,0,1]=4 34 B11R1.126 COCN1CCC(C1(C)C)C 2230a_102516457003_100000766300 [0,0,1,0,0,0|3,0,0]=4 35 B11R1.126 COCN1CCC(C1(C)C)C 269982a_102516457003_100000766300 [0,0,1,0,0,0|3,0,0]=4 36 B11R1.126 CSCN1CCC(C1(C)C)C 2230a_102516457003_100011218213 [0,0,1,0,0,0|3,0,0]=4 37 B11R1.126 CSCN1CCC(C1(C)C)C 269982a_102516457003_100011218213 [0,0,1,0,0,0|3,0,0]=4 38 B11R1.126 CSCN1CCC(C1(C)C)C 34a_102516457003_100011218213 [0,0,1,0,0,0|3,0,0]=4 39 B10R1.13 CC(C)C1CCN(CC1)C 2230a_100000762885_200000210301 [1,0,1,0,0,0|1,0,1]=4 40 B10R1.13 CC(C)C1CCN(CC1)C 269982a_100000762885_200000210301 [1,0,1,0,0,0|1,0,1]=4 41 B10R1.13 CC(C)C1CCN(CC1)C 34a_100000762885_200000210301 [1,0,1,0,0,0|1,0,1]=4 42 B10R1.13 CC(C)C1CCN(CC1)[13CH3] 2230a_100000762885_200025704644 [1,0,1,0,0,0|1,0,1]=4 43 B10R1.13 CC(C)C1CCN(CC1)[13CH3] 269982a_100000762885_200025704644 [1,0,1,0,0,0|1,0,1]=4 44 B10R1.13 CC(C)C1CCN(CC1)[13CH3] 34a_100000762885_200025704644 [1,0,1,0,0,0|1,0,1]=4 45 B10R1.13 CC1=CCN(CC1)C(C)C 2230a_100000693516_100000210206 [1,0,1,0,0,0|1,0,1]=4 46 B10R1.13 CC1=CCN(CC1)C(C)C 269982a_100000693516_100000210206 [1,0,1,0,0,0|1,0,1]=4 47 B10R1.13 CC1=CCN(CC1)C(C)C 34a_100000693516_100000210206 [1,0,1,0,0,0|1,0,1]=4 48 B10R1.13 CC1CCC(CC1)N(C)C 269982a_100102631434_200011216234 [1,0,1,0,0,0|1,0,1]=4 49 B10R1.13 CC1CCC(CC1)N(C)C 270004a_100102631434_100000185489 [1,0,1,0,0,0|1,0,1]=4 50 B10R1.13 CC1CCN(CC1)C(C)C 2230a_100000188429_100000210206 [1,0,1,0,0,0|1,0,1]=4 51 B10R1.13 CC1CCN(CC1)C(C)C 269982a_100000188429_100000210206 [1,0,1,0,0,0|1,0,1]=4 52 B10R1.13 CC1CCN(CC1)C(C)C 34a_100000188429_100000210206 [1,0,1,0,0,0|1,0,1]=4 53 B10R1.113 CC(C)N1CCNC(=O)C1 2230a_100000184651_100000210206 [1,0,1,0,0,0|2,0,0]=4 54 B10R1.113 CC(C)N1CCOC(=O)C1 2230a_100000131268_100000210206 [1,0,1,0,0,0|2,0,0]=4 55 B10R1.176 CCC1CCC(N(C1)C)C 2230a_100011219223_200000210301 [1,0,1,0,0,0|2,0,0]=4 56 B10R1.176 CCC1CCC(N(C1)C)C 269982a_100011219223_200000210301 [1,0,1,0,0,0|2,0,0]=4 57 B10R1.176 CCC1CCC(N(C1)C)C 34a_100011219223_200000210301 [1,0,1,0,0,0|2,0,0]=4 58 B10R1.176 CCC1CCC(N(C1)[13CH3])C 2230a_100011219223_200025704644 [1,0,1,0,0,0|2,0,0]=4 59 B10R1.176 CCC1CCC(N(C1)[13CH3])C 269982a_100011219223_200025704644 [1,0,1,0,0,0|2,0,0]=4 60 B10R1.176 CCC1CCC(N(C1)[13CH3])C 34a_100011219223_200025704644 [1,0,1,0,0,0|2,0,0]=4 61 B10R1.176 CCN1CCN(C(=O)C1)C 2230a_100000187256_100000210202 [1,0,1,0,0,0|2,0,0]=4 62 B10R1.176 CCN1CCN(C(=O)C1)C 269982a_100000187256_100000204670 [1,0,1,0,0,0|2,0,0]=4 63 B10R1.176 CN1CCC(CC1=O)N[13CH3] 2230a_100000126938_200025704644 [1,0,1,0,0,0|2,0,0]=4 64 B10R1.176 CN1CCC(CC1=O)N[13CH3] 34a_100000126938_200025704644 [1,0,1,0,0,0|2,0,0]=4 65 B10R1.176 CNC1CCN(C(=O)C1)C 2230a_100000126938_200000210301 [1,0,1,0,0,0|2,0,0]=4 66 B10R1.176 CNC1CCN(C(=O)C1)C 34a_100000126938_200000210301 [1,0,1,0,0,0|2,0,0]=4 67 B10R1.133 C=CCN1CCCC1(C)C 2230a_100000761399_100000210623 [1,0,1,0,0,0|2,0,0]=4 68 B10R1.133 C=CCN1CCCC1(C)C 269982a_100000761399_100000210623 [1,0,1,0,0,0|2,0,0]=4 69 B10R1.133 C=CCN1CCCC1(C)C 34a_100000761399_100015514636 [1,0,1,0,0,0|2,0,0]=4 70 B10R1.133 CC1(CCCN1CC=O)C 2230a_100000761399_200015260668 [1,0,1,0,0,0|1,0,0]=3 71 B10R1.133 CC1(CCCN1CC=O)C 269982a_100000761399_200015260668 [1,0,1,0,0,0|1,0,0]=3 72 B10R1.133 CC1(CCCN1CC=O)C 34a_100000761399_200009817547 [1,0,1,0,0,0|1,0,0]=3 73 B10R1.133 CC1(COCN1CC=O)C 2230a_100000043020_200015260668 [1,0,1,0,0,0|2,0,0]=4 74 B10R1.133 CC1(COCN1CC=O)C 269982a_100000043020_200015260668 [1,0,1,0,0,0|2,0,0]=4 75 B10R1.133 CC1(SCCN1CC=O)C 2230a_100011217261_200015260668 [1,0,1,0,0,0|2,0,0]=4 76 B10R1.133 CC1(SCCN1CC=O)C 269982a_100011217261_200015260668 [1,0,1,0,0,0|2,0,0]=4 77 B10R1.133 CC1(SCCN1CC=O)C 34a_100011217261_200009817547 [1,0,1,0,0,0|2,0,0]=4 78 B10R1.259 CC1CCN(C1(C)C)CF 269982a_102516457003_100015361967 [1,0,1,0,0,0|2,0,0]=4 79 B10R1.259 CC1CCN(C1(C)C)CF 34a_102516457003_100015361967 [1,0,1,0,0,0|2,0,0]=4 80 B10R1.259 CCN1CCC(C1(C)C)C 2230a_102516457003_100000210202 [1,0,1,0,0,0|1,0,1]=4 81 B10R1.259 CCN1CCC(C1(C)C)C 269982a_102516457003_100000204670 [1,0,1,0,0,0|1,0,1]=4 82 B10R1.259 CCN1CCC(C1(C)C)C 34a_102516457003_100000210202 [1,0,1,0,0,0|1,0,1]=4 83 B10R1.61 CC(=O)C1CCCCC1=O 1458a_100000070787_100000204591 [1,0,1,0,0,0|1,0,1]=4 84 B10R1.61 CC(C)C1CCCCN1C 2230a_100000757267_200000210301 [1,0,1,0,0,0|2,0,0]=4 85 B10R1.61 CC(C)C1CCCCN1C 269982a_100000757267_200000210301 [1,0,1,0,0,0|2,0,0]=4 86 B10R1.61 CC(C)C1CCCCN1C 34a_100000757267_200000210301 [1,0,1,0,0,0|2,0,0]=4 87 B10R1.61 CC(C)C1CCCCN1[13CH3] 2230a_100000757267_200025704644 [1,0,1,0,0,0|2,0,0]=4 88 B10R1.61 CC(C)C1CCCCN1[13CH3] 269982a_100000757267_200025704644 [1,0,1,0,0,0|2,0,0]=4 89 B10R1.61 CC(C)C1CCCCN1[13CH3] 34a_100000757267_200025704644 [1,0,1,0,0,0|2,0,0]=4 90 B10R1.61 CN(C)C1CCCCC1=O 269982a_100102631434_100000204591 [1,0,1,0,0,0|1,0,0]=3 91 B10R1.61 CN(C)C1CCCNC1=O 2230a_100102631434_100000687798 [1,0,1,0,0,0|2,0,0]=4 92 B10R1.61 CN(C)C1CCCNC1=O 269982a_100102631434_100000687798 [1,0,1,0,0,0|2,0,0]=4 93 B10R1.43 CC1(COC(=O)[C@@H]1O[13CH3])C 34a_100009815050_200025704644 [1,0,1,0,0,0|2,0,0]=4 94 B10R1.43 CC1(COC(=O)[C@@H]1O[13CH3])C 7a_100009815050_200025704644 [1,0,1,0,0,0|2,0,0]=4 95 B10R1.43 CO[C@H]1C(=O)OCC1(C)C 34a_100009815050_200000210301 [1,0,1,0,0,0|2,0,0]=4 96 B10R1.43 CO[C@H]1C(=O)OCC1(C)C 7a_100009815050_200000210301 [1,0,1,0,0,0|2,0,0]=4 97 B10R1.128 CC(=O)N1CCCC1(C)C 11a_100000761399_100015343762 [1,0,1,0,0,0|1,0,0]=3 98 B10R1.128 CC(=O)N1CCCC1(C)C 1626a_100000761399_100015343762 [1,0,1,0,0,0|1,0,0]=3 99 B10R1.128 CC(=O)N1CCCC1(C)C 240690a_100000761399_100015343762 [1,0,1,0,0,0|1,0,0]=3 100 B10R1.128 CC(=O)N1CCCC1(C)C 527a_100000761399_100103153847 [1,0,1,0,0,0|1,0,0]=3 101 B10R1.128 CC(=O)N1CCSC1(C)C 11a_100011217261_100015343762 [1,0,1,0,0,0|2,0,0]=4 102 B10R1.128 CC(=O)N1CCSC1(C)C 1626a_100011217261_100015343762 [1,0,1,0,0,0|2,0,0]=4 103 B10R1.128 CC(=O)N1CCSC1(C)C 240690a_100011217261_100015343762 [1,0,1,0,0,0|2,0,0]=4 104 B10R1.128 CC(=O)N1CCSC1(C)C 527a_100011217261_100103153847 [1,0,1,0,0,0|2,0,0]=4 105 B10R1.128 CC(=O)N1COCC1(C)C 1626a_100000043020_100015343762 [1,0,1,0,0,0|2,0,0]=4 106 B10R1.128 CC(=O)N1COCC1(C)C 240690a_100000043020_100015343762 [1,0,1,0,0,0|2,0,0]=4 107 B10R1.128 CC(=O)[C@@H]1CCC[N+]1(C)C 1458a_100016991750_200000210301 [1,0,1,0,0,0|1,0,0]=3 108 B10R1.128 C[N+]1(CCC[C@H]1C(=O)[13CH3])C 1458a_100016991750_200025704644 [1,0,1,0,0,0|1,0,0]=3 109 B10R1.291 CN1CCC[C@@]1(C)C(=O)O 269956a_100009816582_200000210301 [1,0,1,0,0,0|2,0,0]=4 110 B10R1.291 C[C@]1(CCCN1[13CH3])C(=O)O 269956a_100009816582_200025704644 [1,0,1,0,0,0|2,0,0]=4 111 B12R1.23 CN1CCN(CC1=O)C(C)(C)C 269982a_100000187256_100000210625 [0,1,1,0,0,0|2,0,0]=4 112 B12R1.48 CCN1CCN(CC1=O)C(C)C 2230a_100000701330_100000210206 [0,1,1,0,0,0|2,0,0]=4 113 B12R1.48 CCN1CCN(CC1=O)C(C)C 269982a_100000701330_100000210206 [0,1,1,0,0,0|2,0,0]=4 114 B12R1.232 CC(C)N1CC(=O)N(C[C@@H]1C)C 2230a_100016994881_100000210206 [0,1,1,0,0,0|2,0,0]=4 115 B12R1.232 CC(C)N1CC(=O)N(C[C@@H]1C)C 269982a_100016994881_100000210206 [0,1,1,0,0,0|2,0,0]=4 116 B12R1.232 CC(C)N1CC(=O)N(C[C@@H]1C)C 34a_100016994881_100000210206 [0,1,1,0,0,0|2,0,0]=4 117 B12R1.367 CC(CO)N1CCN(C(=O)C1)C 2230a_100000187256_100012180447 [0,1,1,0,0,0|2,0,0]=4 118 B12R1.367 CCC(C)N1CCN(C(=O)C1)C 2230a_100000187256_100000758301 [0,1,1,0,0,0|2,0,0]=4 119 B12R1.367 CCC(C)N1CCN(C(=O)C1)C 269982a_100000187256_100000758301 [0,1,1,0,0,0|2,0,0]=4 120 B12R1.367 COC(C)N1CCN(C(=O)C1)C 269982a_100000187256_100009879195 [0,1,1,0,0,0|2,0,0]=4 121 B12R1.367 C[C@H](CO)N1CCN(C(=O)C1)C 269982a_100000187256_100016084084 [0,1,1,0,0,0|2,0,0]=4 122 B12R1.893 CC(C)N1CCN(C(=O)C1C)C 2230a_100000708691_100000210206 [0,1,1,0,0,0|2,0,0]=4 123 B12R1.893 CC(C)N1CCN(C(=O)C1C)C 269982a_100000708691_100000210206 [0,1,1,0,0,0|2,0,0]=4 124 B12R1.893 CC(C)N1CCN(C(=O)C1C)C 34a_100000708691_100000210206 [0,1,1,0,0,0|2,0,0]=4 125 B12R1.339 C/C=C/CN1CCC(C1(C)C)C 269982a_102516457003_100102629194 [0,1,1,0,0,0|2,0,0]=4 126 B12R1.339 C/C=C/CN1CCC(C1(C)C)C 34a_102516457003_100102629194 [0,1,1,0,0,0|2,0,0]=4 127 B12R1.339 C=CCCN1CCC(C1(C)C)C 2230a_102516457003_100000754431 [0,1,1,0,0,0|2,0,0]=4 128 B12R1.339 C=CCCN1CCC(C1(C)C)C 269982a_102516457003_100000754431 [0,1,1,0,0,0|2,0,0]=4 129 B12R1.339 C=CCCN1CCC(C1(C)C)C 34a_102516457003_100000754431 [0,1,1,0,0,0|2,0,0]=4 130 B12R1.339 CC=CCN1CCC(C1(C)C)C 2230a_102516457003_100000070051 [0,1,1,0,0,0|2,0,0]=4 131 B12R1.339 CC=CCN1CCC(C1(C)C)C 34a_102516457003_100000070051 [0,1,1,0,0,0|2,0,0]=4 132 B12R1.898 C=C(C)CN1CCC(C1(C)C)C 2230a_102516457003_100000748629 [0,1,1,0,0,0|2,0,0]=4 133 B12R1.898 C=C(C)CN1CCC(C1(C)C)C 269982a_102516457003_100000748629 [0,1,1,0,0,0|2,0,0]=4 134 B12R1.898 C=C(C)CN1CCC(C1(C)C)C 34a_102516457003_100000748629 [0,1,1,0,0,0|2,0,0]=4 135 B12R1.898 C=C(F)CN1CCC(C1(C)C)C 2230a_102516457003_100009893438 [0,1,1,0,0,0|2,0,0]=4 136 B12R1.898 C=C(F)CN1CCC(C1(C)C)C 269982a_102516457003_100009893438 [0,1,1,0,0,0|2,0,0]=4 137 B12R1.898 C=C(F)CN1CCC(C1(C)C)C 34a_102516457003_100009893438 [0,1,1,0,0,0|2,0,0]=4 138 B12R1.898 CC1CCN(C1(C)C)CC(=O)N 2230a_102516457003_100000747473 [0,1,1,0,0,0|1,0,0]=3 139 B12R1.898 CC1CCN(C1(C)C)CC(=O)N 269982a_102516457003_100000187820 [0,1,1,0,0,0|1,0,0]=3 140 B12R1.898 CC1CCN(C1(C)C)CC(=O)N 34a_102516457003_100000187820 [0,1,1,0,0,0|1,0,0]=3 141 B12R1.898 CC1CCN(C1(C)C)CC(=O)[O-] 269982a_102516457003_100020667443 [0,1,1,0,0,0|1,0,0]=3 142 B12R1.898 CC1CCN(C1(C)C)CC(=O)[O-] 34a_102516457003_100020667443 [0,1,1,0,0,0|1,0,0]=3 143 B12R1.898 CC1CCN(C1(C)C)C[N+](=O)[O-] 269982a_102516457003_100000761209 [0,1,1,0,0,0|2,0,0]=4 144 B12R1.898 CC1CCN(C1(C)C)C[N+](=O)[O-] 34a_102516457003_100000761209 [0,1,1,0,0,0|2,0,0]=4 145 B12R1.1702 C=CC(C)N1CCC(C1(C)C)C 269982a_102516457003_100011215867 [0,1,1,0,0,0|2,0,0]=4 146 B14R2.27073 CC1(C2CCC1(C(C2)NCF)C)C 34a_100000716156_100015361967 [0,2,0,0,0,0|1,0,1]=4 147 B14R2.27073 CC1([C@H]2CC[C@@]1([C@@H](C2)OCF)C)C 34a_100000686805_100015361967 [0,2,0,0,0,0|0,0,2]=4 148 B14R2.27073 CC1([C@H]2CC[C@@]1([C@@H](C2)OCF)C)C 7a_100000686805_100015361967 [0,2,0,0,0,0|0,0,2]=4 149 B14R2.27073 CCNC1CC2CCC1(C2(C)C)C 2230a_100000716156_100000210202 [0,2,0,0,0,0|1,0,1]=4 150 B14R2.27073 CCNC1CC2CCC1(C2(C)C)C 34a_100000716156_100000210202 [0,2,0,0,0,0|1,0,1]=4 151 B14R2.27073 CCO[C@@H]1C[C@@H]2CC[C@]1(C2(C)C)C 34a_100000686805_100000210202 [0,2,0,0,0,0|0,0,2]=4 152 B14R2.27073 CCO[C@@H]1C[C@@H]2CC[C@]1(C2(C)C)C 7a_100000686805_100000210202 [0,2,0,0,0,0|0,0,2]=4 153 B14R2.18552 CC12CC[C@@H](C1(C)C)[C@@H](C2=O)S[13CH3] 62a_100015940049_200025704644 [0,2,0,0,0,0|0,0,0]=2 154 B14R2.18552 CC12CC[C@@H](C1(C)C)[C@@H](C2=O)S[13CH3] 62a_200025704644_100015940049 [0,2,0,0,0,0|0,0,0]=2 155 B14R2.18552 CN[C@@H]1C(=O)C2(CC[C@H]1C2(C)C)C 2230a_106832991635_100015940049 [0,2,0,0,0,0|0,0,0]=2 156 B14R2.18552 CN[C@@H]1C(=O)C2(CC[C@H]1C2(C)C)C 34a_100102657272_100015940049 [0,2,0,0,0,0|0,0,0]=2 157 B14R2.18552 CN[C@@H]1C(=O)C2(CC[C@H]1C2(C)C)C 7a_106832991635_100015940049 [0,2,0,0,0,0|0,0,0]=2 158 B14R2.18552 CO[C@@H]1C(=O)C2(CC[C@H]1C2(C)C)C 34a_100138415774_100015940049 [0,2,0,0,0,0|0,0,0]=2 159 B14R2.18552 CS[C@@H]1C(=O)C2(CC[C@H]1C2(C)C)C 62a_100015940049_200000210301 [0,2,0,0,0,0|0,0,0]=2 160 B14R2.18552 CS[C@@H]1C(=O)C2(CC[C@H]1C2(C)C)C 62a_200000210301_100015940049 [0,2,0,0,0,0|0,0,0]=2 161 B10R0.53 CCC(=O)CN(CC)C(C)C 269982a_100000223864_100000747405 [0,0,2,0,0,0|1,0,0]=3 162 B10R0.53 CCC(=O)NC(CC)C(C)C 11a_100000745074_100000210414 [0,0,2,0,0,0|1,0,0]=3 163 B10R0.53 CCC(=O)NC(CC)C(C)C 1626a_100000745074_100000210414 [0,0,2,0,0,0|1,0,0]=3 164 B10R0.53 CCC(=O)NC(CC)C(C)C 240690a_100000745074_100000210414 [0,0,2,0,0,0|1,0,0]=3 165 B10R0.53 CCC(=O)NC(CC)C(C)C 527a_100000745074_100000210414 [0,0,2,0,0,0|1,0,0]=3 166 B10R0.53 CCC(=O)N[C@@H](CC)[C@@H](C)O 11a_100161114882_100000210414 [0,0,2,0,0,0|2,0,0]=4 167 B10R0.53 CCC(=O)N[C@@H](CC)[C@@H](C)O 1626a_100161114882_100000210414 [0,0,2,0,0,0|2,0,0]=4 168 B10R0.53 CCC(=O)N[C@@H](CC)[C@@H](C)O 240690a_100161114882_100000210414 [0,0,2,0,0,0|2,0,0]=4 169 B10R0.53 CCC(=O)N[C@@H](CC)[C@@H](C)O 527a_100161114882_100000210414 [0,0,2,0,0,0|2,0,0]=4 170 B10R0.53 CCC(=O)N[C@@H](CO)C(C)C 240690a_100011830312_100000210414 [0,0,2,0,0,0|2,0,0]=4 171 B10R0.53 CCC(=O)N[C@@H](CO)C(C)C 527a_100011830312_100000210414 [0,0,2,0,0,0|2,0,0]=4 172 B10R0.53 CCC(=O)OC(NC)C(C)C 34a_100102657272_100016989192 [0,0,2,0,0,0|2,0,0]=4 173 B10R0.53 CCC(=O)OC(NC)C(C)C 7a_106832991635_100016989192 [0,0,2,0,0,0|2,0,0]=4 174 B10R0.53 CCC(=O)OC(OC)C(C)C 34a_100138415774_100016989192 [0,0,2,0,0,0|2,0,0]=4 175 B10R0.53 CCC(=O)OC(SC)C(C)C 62a_100016989192_200000210301 [0,0,2,0,0,0|2,0,0]=4 176 B10R0.53 CCC(=O)OC(SC)C(C)C 62a_200000210301_100016989192 [0,0,2,0,0,0|2,0,0]=4 177 B10R0.53 CCC(=O)OC(S[13CH3])C(C)C 62a_100016989192_200025704644 [0,0,2,0,0,0|2,0,0]=4 178 B10R0.53 CCC(=O)OC(S[13CH3])C(C)C 62a_200025704644_100016989192 [0,0,2,0,0,0|2,0,0]=4 179 B10R0.53 CCC(NC(=O)CO)C(C)C 240690a_100000745074_100000210174 [0,0,2,0,0,0|2,0,0]=4 180 B10R0.53 CCC(NC(=O)CO)C(C)C 527a_100000745074_100000210174 [0,0,2,0,0,0|2,0,0]=4 181 B10R0.53 CCC(NC(=O)NC)C(C)C 2708a_100000745074_106832991635 [0,0,2,0,0,0|2,0,0]=4 182 B10R0.53 CCC(NC(=O)NC)C(C)C 2708a_100102657272_100000745074 [0,0,2,0,0,0|2,0,0]=4 183 B10R0.53 CCC(NC(=O)NC)C(C)C 273464a_100000745074_100102657272 [0,0,2,0,0,0|2,0,0]=4 184 B10R0.53 CCC(NC(=O)NC)C(C)C 273464a_100102657272_100000745074 [0,0,2,0,0,0|2,0,0]=4 185 B10R0.53 CCC(NC(=O)NC)C(C)C 512a_100000745074_100102657272 [0,0,2,0,0,0|2,0,0]=4 186 B10R0.53 CCC(NC(=O)NC)C(C)C 512a_106832991638_100000745074 [0,0,2,0,0,0|2,0,0]=4 187 B10R0.53 CCN(CC(=O)NC)C(C)C 2230a_100000223864_100000183359 [0,0,2,0,0,0|2,0,0]=4 188 B10R0.53 CCN(CC(=O)NC)C(C)C 269982a_100000223864_100000183359 [0,0,2,0,0,0|2,0,0]=4 189 B10R0.53 CCN(CC(=O)OC)C(C)C 2230a_100000223864_100000747449 [0,0,2,0,0,0|2,0,0]=4 190 B10R0.53 CCN(CC(=O)OC)C(C)C 269982a_100000223864_100000747449 [0,0,2,0,0,0|2,0,0]=4 191 B10R0.57 C#CC(C)C(=O)CCC(C)C 1458a_100000181311_200000035995 [0,0,2,0,0,0|0,0,2]=4 192 B10R0.57 C/C=C(\C)/C(=O)CCC(C)C 1458a_100020587367_100000210312 [0,0,2,0,0,0|0,0,2]=4 193 B10R0.57 C=C(C)CCC(=O)C(C)CC 1458a_100011192722_100000730704 [0,0,2,0,0,0|0,0,2]=4 194 B10R0.57 C=C(C)CCC(=O)C(C)CC 1458a_200000688413_100000758301 [0,0,2,0,0,0|0,0,2]=4 195 B10R0.57 C=CC(C)C(=O)CCC(C)C 1458a_100011216780_100000210312 [0,0,2,0,0,0|0,0,2]=4 196 B10R0.57 CC(C)CCC(=O)C(C)C#N 1458a_100000181311_100000703298 [0,0,2,0,0,0|1,0,1]=4 197 B10R0.57 CC(C)CCC(=O)C(C)C#N 1458a_100000753662_100000210312 [0,0,2,0,0,0|1,0,1]=4 198 B10R0.57 CC(C)CCC(=O)C(O)CO 1458a_100011215603_100000210312 [0,0,2,0,0,0|2,0,0]=4 199 B10R0.57 CC(C)CNC(=O)C(C)N[13CH3] 2230a_100025753496_200025704644 [0,0,2,0,0,0|2,0,0]=4 200 B10R0.57 CC(C)CNC(=O)C(C)N[13CH3] 34a_100025753496_200025704644 [0,0,2,0,0,0|2,0,0]=4 201 B10R0.57 CC(C)CNC(=O)C(C)S[13CH3] 62a_100000230289_200025704644 [0,0,2,0,0,0|2,0,0]=4 202 B10R0.57 CC(C)CNC(=O)C(C)S[13CH3] 62a_200025704644_100000230289 [0,0,2,0,0,0|2,0,0]=4 203 B10R0.57 CCC(C)C(=O)C=CC(C)C 1458a_100016268746_100000758301 [0,0,2,0,0,0|0,0,2]=4 204 B10R0.57 CCC(C)C(=O)CC=C(C)C 1458a_100011192722_100000761012 [0,0,2,0,0,0|0,0,2]=4 205 B10R0.57 CCC(C)C(=O)CC=C(C)C 1458a_100011220947_100000758301 [0,0,2,0,0,0|0,0,2]=4 206 B10R0.57 CCC(C)C(=O)CCC(C)C 1458a_100000181311_100000758301 [0,0,2,0,0,0|0,0,0]=2 207 B10R0.57 CCC(C)C(=O)CCC(C)C 1458a_100011192722_100000210312 [0,0,2,0,0,0|0,0,0]=2 208 B10R0.57 CCC(C)C(=O)CCC(C)O 1458a_100011192722_100012276601 [0,0,2,0,0,0|1,0,0]=3 209 B10R0.57 CCC(C)C(=O)CC[S+](C)C 1458a_100009452791_100000758301 [0,0,2,0,0,0|1,0,0]=3 210 B10R0.57 CCC(C)C(=O)COC(C)C 1458a_100000745533_100000758301 [0,0,2,0,0,0|1,0,0]=3 211 B10R0.57 CCC(C)C(=O)CSC(C)C 1458a_100000241585_100000758301 [0,0,2,0,0,0|1,0,0]=3 212 B10R0.57 CCC(C)C(=O)NCC(C)C 11a_100000210953_100011192722 [0,0,2,0,0,0|1,0,0]=3 213 B10R0.57 CCC(C)C(=O)NCC(C)C 1626a_100000210953_100011192722 [0,0,2,0,0,0|1,0,0]=3 214 B10R0.57 CCC(C)C(=O)NCC(C)C 240690a_100000210953_100011192722 [0,0,2,0,0,0|1,0,0]=3 215 B10R0.57 CCC(C)C(=O)NCC(C)C 527a_100000210953_100011192722 [0,0,2,0,0,0|1,0,0]=3 216 B10R0.57 CCC(C)C(=O)NCC(C)O 11a_100000210904_100011192722 [0,0,2,0,0,0|2,0,0]=4 217 B10R0.57 CCC(C)C(=O)NCC(C)O 240690a_100000210904_100011192722 [0,0,2,0,0,0|2,0,0]=4 218 B10R0.57 CCC(C)C(=O)NCC(C)O 527a_100000210904_100011192722 [0,0,2,0,0,0|2,0,0]=4 219 B10R0.57 CCC(C)C(=O)NNC(C)C 22a_100000741168_100011192722 [0,0,2,0,0,0|2,0,0]=4 220 B10R0.57 CCC(C)N(C)CCC(C)C 2230a_100000741768_100000210312 [0,0,2,0,0,0|2,0,0]=4 221 B10R0.57 CCC(C)N(C)CCC(C)C 2230a_100000742789_100000758301 [0,0,2,0,0,0|2,0,0]=4 222 B10R0.57 CCC(C)N(C)CCC(C)C 269982a_100000741768_100000210312 [0,0,2,0,0,0|2,0,0]=4 223 B10R0.57 CCC(C)N(C)CCC(C)C 269982a_100000742789_100000758301 [0,0,2,0,0,0|2,0,0]=4 224 B10R0.57 CCC(O)C(=O)CCC(C)C 1458a_100011196387_100000210312 [0,0,2,0,0,0|1,0,0]=3 225 B10R0.57 CCC(O)C(=O)CCC(C)O 1458a_100011196387_100012276601 [0,0,2,0,0,0|2,0,0]=4 226 B10R0.57 CCC(O)C(=O)NCC(C)C 240690a_100000210953_100011196387 [0,0,2,0,0,0|2,0,0]=4 227 B10R0.57 CCN(C)C(=O)CCC(C)C 11a_100000225621_100000181311 [0,0,2,0,0,0|1,0,0]=3 228 B10R0.57 CCN(C)C(=O)CCC(C)C 1626a_100000225621_100000181311 [0,0,2,0,0,0|1,0,0]=3 229 B10R0.57 CCN(C)C(=O)CCC(C)C 240690a_100000225621_100000181311 [0,0,2,0,0,0|1,0,0]=3 230 B10R0.57 CCN(C)C(=O)CCC(C)C 527a_100000225621_100000181311 [0,0,2,0,0,0|1,0,0]=3 231 B10R0.57 CCN(C)C(=O)CCC(C)O 1626a_100000225621_100000718519 [0,0,2,0,0,0|2,0,0]=4 232 B10R0.57 CCN(C)C(=O)CCN(C)C 11a_100000225621_100000689311 [0,0,2,0,0,0|2,0,0]=4 233 B10R0.57 CCN(C)C(=O)CCN(C)C 240690a_100000225621_100000689311 [0,0,2,0,0,0|2,0,0]=4 234 B10R0.57 CCN(C)C(=O)CCN(C)C 527a_100000225621_100000689311 [0,0,2,0,0,0|2,0,0]=4 235 B10R0.57 CCN(C)C(=O)CC[S+](C)C 11a_100000225621_100009452791 [0,0,2,0,0,0|2,0,0]=4 236 B10R0.57 CCN(C)C(=O)CC[S+](C)C 1626a_100000225621_100009452791 [0,0,2,0,0,0|2,0,0]=4 237 B10R0.57 CCN(C)C(=O)CC[S+](C)C 240690a_100000225621_100009452791 [0,0,2,0,0,0|2,0,0]=4 238 B10R0.57 CCN(C)C(=O)CNC(C)C 2230a_100138425928_100000738999 [0,0,2,0,0,0|2,0,0]=4 239 B10R0.57 CCN(C)C(=O)CNC(C)C 34a_100138425928_100000738999 [0,0,2,0,0,0|2,0,0]=4 240 B10R0.57 CCN(C)C(=O)COC(C)C 11a_100000225621_100000745533 [0,0,2,0,0,0|2,0,0]=4 241 B10R0.57 CCN(C)C(=O)COC(C)C 1626a_100000225621_100000745533 [0,0,2,0,0,0|2,0,0]=4 242 B10R0.57 CCN(C)C(=O)COC(C)C 240690a_100000225621_100000745533 [0,0,2,0,0,0|2,0,0]=4 243 B10R0.57 CCN(C)C(=O)COC(C)C 34a_100000212225_100000738999 [0,0,2,0,0,0|2,0,0]=4 244 B10R0.57 CCN(C)C(=O)COC(C)C 527a_100000225621_100000745533 [0,0,2,0,0,0|2,0,0]=4 245 B10R0.57 CCN(C)C(=O)CSC(C)C 11a_100000225621_100000241585 [0,0,2,0,0,0|2,0,0]=4 246 B10R0.57 CCN(C)C(=O)CSC(C)C 1626a_100000225621_100000241585 [0,0,2,0,0,0|2,0,0]=4 247 B10R0.57 CCN(C)C(=O)CSC(C)C 240690a_100000225621_100000241585 [0,0,2,0,0,0|2,0,0]=4 248 B10R0.57 CCN(C)C(=O)CSC(C)C 527a_100000225621_100000241585 [0,0,2,0,0,0|2,0,0]=4 249 B10R0.57 CCN(C)C(=O)CSC(C)C 62a_100000210206_100000738999 [0,0,2,0,0,0|2,0,0]=4 250 B10R0.57 CCN(C)C(=O)CSC(C)C 62a_100000738999_100000210206 [0,0,2,0,0,0|2,0,0]=4 251 B10R0.57 CCN(C)C(=O)NCC(C)C 2708a_100000210953_100000225621 [0,0,2,0,0,0|2,0,0]=4 252 B10R0.57 CCN(C)C(=O)NCC(C)C 273464a_100000210953_100000225621 [0,0,2,0,0,0|2,0,0]=4 253 B10R0.57 CNC(C)C(=O)NCC(C)C 2230a_100025753496_200000210301 [0,0,2,0,0,0|2,0,0]=4 254 B10R0.57 CNC(C)C(=O)NCC(C)C 2230a_106832991635_100000230289 [0,0,2,0,0,0|2,0,0]=4 255 B10R0.57 CNC(C)C(=O)NCC(C)C 34a_100025753496_200000210301 [0,0,2,0,0,0|2,0,0]=4 256 B10R0.57 CNC(C)C(=O)NCC(C)C 34a_100102657272_100000230289 [0,0,2,0,0,0|2,0,0]=4 257 B10R0.57 CNC(C)C(=O)NCC(C)C 7a_106832991635_100000230289 [0,0,2,0,0,0|2,0,0]=4 258 B10R0.57 COC(C)C(=O)CCC(C)C 1458a_100000743197_100000210312 [0,0,2,0,0,0|1,0,0]=3 259 B10R0.57 COC(C)C(=O)CCC(C)O 1458a_100000743197_100012276601 [0,0,2,0,0,0|2,0,0]=4 260 B10R0.57 COC(C)C(=O)NCC(C)C 11a_100000210953_100000743197 [0,0,2,0,0,0|2,0,0]=4 261 B10R0.57 COC(C)C(=O)NCC(C)C 1626a_100000210953_100000743197 [0,0,2,0,0,0|2,0,0]=4 262 B10R0.57 COC(C)C(=O)NCC(C)C 240690a_100000210953_100000743197 [0,0,2,0,0,0|2,0,0]=4 263 B10R0.57 COC(C)C(=O)NCC(C)C 34a_100138415774_100000230289 [0,0,2,0,0,0|2,0,0]=4 264 B10R0.57 COC(C)C(=O)NCC(C)C 527a_100000210953_100000743197 [0,0,2,0,0,0|2,0,0]=4 265 B10R0.57 CSC(C)C(=O)CCC(C)C 1458a_100000149566_100000210312 [0,0,2,0,0,0|1,0,0]=3 266 B10R0.57 CSC(C)C(=O)CCC(C)O 1458a_100000149566_100012276601 [0,0,2,0,0,0|2,0,0]=4 267 B10R0.57 CSC(C)C(=O)NCC(C)C 11a_100000210953_100000149566 [0,0,2,0,0,0|2,0,0]=4 268 B10R0.57 CSC(C)C(=O)NCC(C)C 1626a_100000210953_100000149566 [0,0,2,0,0,0|2,0,0]=4 269 B10R0.57 CSC(C)C(=O)NCC(C)C 240690a_100000210953_100000149566 [0,0,2,0,0,0|2,0,0]=4 270 B10R0.57 CSC(C)C(=O)NCC(C)C 527a_100000210953_100000149566 [0,0,2,0,0,0|2,0,0]=4 271 B10R0.57 CSC(C)C(=O)NCC(C)C 62a_100000230289_200000210301 [0,0,2,0,0,0|2,0,0]=4 272 B10R0.57 CSC(C)C(=O)NCC(C)C 62a_200000210301_100000230289 [0,0,2,0,0,0|2,0,0]=4 273 B10R0.88 C=CCC(OCCC)C(C)C 34a_200011216146_100000210303 [0,0,2,0,0,0|2,0,0]=4 274 B10R0.88 C=CCC(OCCC)C(C)C 7a_200011216146_100000210303 [0,0,2,0,0,0|2,0,0]=4 275 B10R0.88 C=CCN(CCCC)C(C)C 2230a_100000207398_100000210623 [0,0,2,0,0,0|2,0,0]=4 276 B10R0.88 C=CCN(CCCC)C(C)C 2230a_100000742772_100000210211 [0,0,2,0,0,0|2,0,0]=4 277 B10R0.88 C=CCN(CCCC)C(C)C 269982a_100000207398_100000210623 [0,0,2,0,0,0|2,0,0]=4 278 B10R0.88 C=CCN(CCCC)C(C)C 269982a_100000742772_100000210211 [0,0,2,0,0,0|2,0,0]=4 279 B10R0.88 CC(C)N(CC=O)CCCO 2230a_100000182298_200015260668 [0,0,2,0,0,0|2,0,0]=4 280 B10R0.88 CC(C)N(CC=O)CCCO 269982a_100000182298_200015260668 [0,0,2,0,0,0|2,0,0]=4 281 B10R0.88 CCCCN(CC=O)C(C)C 2230a_100000207398_200015260668 [0,0,2,0,0,0|1,0,0]=3 282 B10R0.88 CCCCN(CC=O)C(C)C 269982a_100000207398_200015260668 [0,0,2,0,0,0|1,0,0]=3 283 B10R0.88 COCCN(CC=O)C(C)C 2230a_200000223778_200015260668 [0,0,2,0,0,0|2,0,0]=4 284 B10R0.88 COCCN(CC=O)C(C)C 269982a_200000223778_200015260668 [0,0,2,0,0,0|2,0,0]=4 285 B10R0.93 CC(C)C(=O)CC(=O)C(C)C 1458a_100000210198_100000753385 [0,0,2,0,0,0|1,0,1]=4 286 B10R0.93 CC(C)C(=O)CC(C)N(C)C 1458a_100011311895_100000210206 [0,0,2,0,0,0|1,0,0]=3 287 B10R0.93 CC(C)C(=O)CN(C)C(C)C 1458a_100000743827_100000210206 [0,0,2,0,0,0|1,0,0]=3 288 B10R0.93 CC(C)C(=O)CN(C)C(C)C 269982a_200000211004_100000753385 [0,0,2,0,0,0|1,0,0]=3 289 B10R0.93 CC(C)C(=O)NC(C)C(C)C 11a_100000211541_100000210198 [0,0,2,0,0,0|1,0,0]=3 290 B10R0.93 CC(C)C(=O)NC(C)C(C)C 1626a_100000211541_100000210198 [0,0,2,0,0,0|1,0,0]=3 291 B10R0.93 CC(C)C(=O)NC(C)C(C)C 240690a_100000211541_100000210198 [0,0,2,0,0,0|1,0,0]=3 292 B10R0.93 CC(C)C(=O)NC(C)C(C)C 527a_100000211541_100000210198 [0,0,2,0,0,0|1,0,0]=3 293 B10R0.93 CC(C)C(C)NC(=O)N(C)C 2708a_100000211541_100102631434 [0,0,2,0,0,0|2,0,0]=4 294 B10R0.93 CC(C)C(C)NC(=O)[C@@H](C)O 240690a_100000211541_100000717761 [0,0,2,0,0,0|2,0,0]=4 295 B10R0.93 CC(C)C(C)NC(=O)[C@H](C)O 1626a_100000211541_217856618621 [0,0,2,0,0,0|2,0,0]=4 296 B10R0.93 CC(C)C(C)NC(=O)[C@H](C)O 240690a_100000211541_217856618621 [0,0,2,0,0,0|2,0,0]=4 297 B10R0.93 CC(C)N(C)CC(=O)N(C)C 11a_100102631434_100000743827 [0,0,2,0,0,0|2,0,0]=4 298 B10R0.93 CC(C)N(C)CC(=O)N(C)C 1626a_100102631434_100000743827 [0,0,2,0,0,0|2,0,0]=4 299 B10R0.93 CC(C)N(C)CC(=O)N(C)C 2230a_100000185065_100000210206 [0,0,2,0,0,0|2,0,0]=4 300 B10R0.93 CC(C)N(C)CC(=O)N(C)C 240690a_100102631434_100000743827 [0,0,2,0,0,0|2,0,0]=4 301 B10R0.93 CC(C)N(C)CC(=O)N(C)C 269982a_200000211004_100000185267 [0,0,2,0,0,0|2,0,0]=4 302 B10R0.93 CC(C)N(C)CC(=O)N(C)C 527a_100102631434_100000743827 [0,0,2,0,0,0|2,0,0]=4 303 B10R0.93 CC(CC(=O)N(C)C)N(C)C 1626a_100102631434_100011311895 [0,0,2,0,0,0|2,0,0]=4 304 B10R0.93 CC(CC(=O)N(C)C)N(C)C 240690a_100102631434_100011311895 [0,0,2,0,0,0|2,0,0]=4 305 B10R0.93 CC(F)C(=O)NC(C)C(C)C 11a_100000211541_100000062450 [0,0,2,0,0,0|2,0,0]=4 306 B10R0.93 CC(F)C(=O)NC(C)C(C)C 1626a_100000211541_100000062450 [0,0,2,0,0,0|2,0,0]=4 307 B10R0.93 CC(F)C(=O)NC(C)C(C)C 240690a_100000211541_100000062450 [0,0,2,0,0,0|2,0,0]=4 308 B10R0.93 CC(F)C(=O)NC(C)C(C)C 527a_100000211541_100000062450 [0,0,2,0,0,0|2,0,0]=4 309 B10R0.98 C=C(C)C(C)NCCC(C)C 269862a_100000210545_100011216138 [0,0,2,0,0,0|2,0,0]=4 310 B10R0.98 CC(=O)C(C)COCC(C)C 34a_100000032740_100000210624 [0,0,2,0,0,0|1,0,0]=3 311 B10R0.98 CC(=O)C(C)COCC(C)C 7a_100000032740_100000210760 [0,0,2,0,0,0|1,0,0]=3 312 B10R0.98 CC(=O)C(C)COCC(C)O 34a_100000032740_100011218427 [0,0,2,0,0,0|2,0,0]=4 313 B10R0.98 CC(=O)C(C)COCC(C)O 7a_100000032740_100011218427 [0,0,2,0,0,0|2,0,0]=4 314 B10R0.98 CC(=O)C(C)COC[C@@H](C)O 34a_100000032740_100009817552 [0,0,2,0,0,0|2,0,0]=4 315 B10R0.98 CC(=O)C(C)COC[C@@H](C)O 7a_100000032740_100009817552 [0,0,2,0,0,0|2,0,0]=4 316 B10R0.98 CC(=O)C(C)NCCC(C)O 2230a_200000755665_100009814033 [0,0,2,0,0,0|2,0,0]=4 317 B10R0.98 CC(=O)C(C)OCCC(C)C 34a_100000212229_100000210312 [0,0,2,0,0,0|1,0,0]=3 318 B10R0.98 CC(=O)C(C)OCCC(C)C 7a_100000210254_100000179758 [0,0,2,0,0,0|1,0,0]=3 319 B10R0.98 CC(=O)C(C)OCCC(C)O 34a_100000212229_100012276601 [0,0,2,0,0,0|2,0,0]=4 320 B10R0.98 CC(=O)C(C)OCOC(C)C 34a_100000212229_100000709892 [0,0,2,0,0,0|2,0,0]=4 321 B10R0.98 CC(=O)C(C)SCCC(C)C 62a_100000210312_100009814033 [0,0,2,0,0,0|1,0,0]=3 322 B10R0.98 CC(=O)C(C)SCCC(C)C 62a_100009814033_100000210312 [0,0,2,0,0,0|1,0,0]=3 323 B10R0.98 CC(=O)C(C)SCCC(C)O 62a_100009814033_100012276601 [0,0,2,0,0,0|2,0,0]=4 324 B10R0.98 CC(=O)C(C)SCCC(C)O 62a_100012276601_100009814033 [0,0,2,0,0,0|2,0,0]=4 325 B10R0.98 CC(=O)C(C)SCCN(C)C 62a_100009814033_100000755713 [0,0,2,0,0,0|2,0,0]=4 326 B10R0.98 CC(=O)C(C)SCOC(C)C 62a_100000709892_100009814033 [0,0,2,0,0,0|2,0,0]=4 327 B10R0.98 CC(=O)C(C)SCOC(C)C 62a_100009814033_100000709892 [0,0,2,0,0,0|2,0,0]=4 328 B10R0.98 CC(=O)N(C)CCCN(C)C 240690a_100000225831_100015343762 [0,0,2,0,0,0|2,0,0]=4 329 B10R0.98 CC(C)CCCC(C)N(C)C 270004a_100102631434_100000753411 [0,0,2,0,0,0|2,0,0]=4 330 B10R0.98 CC(C)CCN[C@@H](C)C(=O)O 269956a_100000743915_100000210312 [0,0,2,0,0,0|2,0,0]=4 331 B10R0.98 CC(C)CCN[C@H](C)C(=O)N 2230a_100000119354_100000210312 [0,0,2,0,0,0|2,0,0]=4 332 B10R0.98 CC(C)CCN[C@H](C)C(=O)N 34a_100000119354_100000210312 [0,0,2,0,0,0|2,0,0]=4 333 B10R0.98 CC(C)CCOC(C)C(=O)N 34a_100000210254_100000702099 [0,0,2,0,0,0|2,0,0]=4 334 B10R0.98 CC(C)CCOC(C)C(=O)N 7a_100000210254_100000702099 [0,0,2,0,0,0|2,0,0]=4 335 B10R0.98 CC(C)CCO[C@@H](C)C(=O)[O-] 7a_217856618621_100000210626 [0,0,2,0,0,0|2,0,0]=4 336 B10R0.98 CC(C)CCO[C@H](C)C(=O)N 34a_100000731257_100000210312 [0,0,2,0,0,0|2,0,0]=4 337 B10R0.98 CC(C)CCO[C@H](C)C(=O)N 7a_100000731257_100000210626 [0,0,2,0,0,0|2,0,0]=4 338 B10R0.98 CC(C)CCSC(C)C(=O)N 62a_100000210312_100000702099 [0,0,2,0,0,0|2,0,0]=4 339 B10R0.98 CC(C)CCSC(C)C(=O)N 62a_100000702099_100000210312 [0,0,2,0,0,0|2,0,0]=4 340 B10R0.98 CC(C)CNCC(C)C(=O)O 269956a_100000749485_100000210760 [0,0,2,0,0,0|2,0,0]=4 341 B10R0.36 CCCC(=O)C(C)(C)N(C)C 1458a_100000688961_100000210303 [0,0,2,0,0,0|1,0,0]=3 342 B10R0.36 CCNC(=O)C(C)(C)N(C)C 240690a_100015525214_100000688961 [0,0,2,0,0,0|2,0,0]=4 343 B10R0.36 CCNC(=O)C(C)(C)N(C)C 527a_100015525214_100000688961 [0,0,2,0,0,0|2,0,0]=4 344 B10R0.36 CCOC(=O)C(C)(C)N(C)C 2230a_100102631434_100011216345 [0,0,2,0,0,0|2,0,0]=4 345 B10R0.36 CCOC(=O)C(C)(C)N(C)C 269982a_100102631434_100048669870 [0,0,2,0,0,0|2,0,0]=4 346 B10R0.36 CN(C)C(C)(C)C(=O)CCF 1458a_100000688961_100011217306 [0,0,2,0,0,0|2,0,0]=4 347 B10R0.36 CN(C)C(C)(C)C(=O)CCO 1458a_100000688961_100000211926 [0,0,2,0,0,0|2,0,0]=4 348 B10R0.68 CCN(CC=O)C(C)(C)CO 269982a_100000747347_200015260668 [0,0,2,0,0,0|2,0,0]=4 349 B10R0.75 C=CCCCCN(C)C(C)C 2230a_100012000471_100000210206 [0,0,2,0,0,0|2,0,0]=4 350 B10R0.75 C=CCCCCN(C)C(C)C 269982a_100012000471_100000210206 [0,0,2,0,0,0|2,0,0]=4 351 B10R0.75 C=CCCCCN(C)C(C)C 269982a_200000211004_100011215482 [0,0,2,0,0,0|2,0,0]=4 352 B10R0.75 C=CCCCNC(C)C(C)C 2230a_100000211541_100011713584 [0,0,2,0,0,0|2,0,0]=4 353 B10R0.75 C=CCCCOC(C)C(C)C 7a_100000748068_100000757094 [0,0,2,0,0,0|2,0,0]=4 354 B10R0.75 CC(C)C(C)NCCCC=O 2230a_100000211541_200011292268 [0,0,2,0,0,0|1,0,0]=3 355 B10R0.75 CC(C)C(C)OCCCC=O 7a_100000748068_200011292268 [0,0,2,0,0,0|1,0,0]=3 356 B10R0.75 CC(C)C(N)CCOCC=O 34a_100161115045_200009817547 [0,0,2,0,0,0|2,0,0]=4 357 B10R0.75 CC(C)N(C)CCCCC=O 269982a_200000211004_100000139335 [0,0,2,0,0,0|1,0,0]=3 358 B10R0.81 C#CCCC(=O)C(C)C(C)C 1458a_100000755409_100000753159 [0,0,2,0,0,0|0,0,2]=4 359 B10R0.81 C/C=C/CC(=O)C(C)C(C)C 1458a_100000755409_100102629194 [0,0,2,0,0,0|0,0,2]=4 360 B10R0.81 C=CCCC(=O)C(C)C(C)C 1458a_100000755409_100000754431 [0,0,2,0,0,0|0,0,2]=4 361 B10R0.81 CC#CCC(=O)C(C)C(C)C 1458a_100000755409_100000748600 [0,0,2,0,0,0|0,0,2]=4 362 B10R0.81 CC(C)C(C)C(=O)CCC#N 1458a_100000755409_100011215226 [0,0,2,0,0,0|1,0,1]=4 363 B10R0.81 CC(C)C(C)C(=O)CCCF 1458a_100000755409_100011934791 [0,0,2,0,0,0|1,0,0]=3 364 B10R0.81 CC(C)C(C)C(=O)CCCO 1458a_100000755409_100011215043 [0,0,2,0,0,0|1,0,0]=3 365 B10R0.81 CC(C)C(C)C(=O)NCCF 11a_100000724931_100000755409 [0,0,2,0,0,0|2,0,0]=4 366 B10R0.81 CC(C)C(C)C(=O)NCCF 1626a_100000724931_100000755409 [0,0,2,0,0,0|2,0,0]=4 367 B10R0.81 CC(C)C(C)C(=O)NCCF 240690a_100000724931_100000755409 [0,0,2,0,0,0|2,0,0]=4 368 B10R0.81 CC(C)C(C)C(=O)NCCF 527a_100000724931_100000755409 [0,0,2,0,0,0|2,0,0]=4 369 B10R0.81 CC(C)C(C)C(=O)NCCO 240690a_100000210304_100000755409 [0,0,2,0,0,0|2,0,0]=4 370 B10R0.81 CC(C)C(C)C(=O)NCCO 527a_100000210304_100000755409 [0,0,2,0,0,0|2,0,0]=4 371 B10R0.81 CC(C)[C@@H](O)C(=O)CCCF 1458a_100000691806_100011934791 [0,0,2,0,0,0|2,0,0]=4 372 B10R0.81 CC(C)[C@@H](O)C(=O)CCCO 1458a_100000691806_100011215043 [0,0,2,0,0,0|2,0,0]=4 373 B10R0.81 CC=CCC(=O)C(C)C(C)C 1458a_100000755409_100000070051 [0,0,2,0,0,0|0,0,2]=4 374 B10R0.81 CCCCC(=O)C(C)C(=O)C 1458a_100000210183_100000179758 [0,0,2,0,0,0|1,0,1]=4 375 B10R0.81 CCCCC(=O)C(C)C(C)C 1458a_100000755409_100000210211 [0,0,2,0,0,0|0,0,0]=2 376 B10R0.81 CCCCC(=O)N(C)C(C)C 11a_200000211004_100000210183 [0,0,2,0,0,0|1,0,0]=3 377 B10R0.81 CCCCC(=O)N(C)C(C)C 1626a_200000211004_100000210183 [0,0,2,0,0,0|1,0,0]=3 378 B10R0.81 CCCCC(=O)N(C)C(C)C 240690a_200000211004_100000210183 [0,0,2,0,0,0|1,0,0]=3 379 B10R0.81 CCCCC(=O)N(C)C(C)C 527a_200000211004_100000210183 [0,0,2,0,0,0|1,0,0]=3 380 B10R0.81 CCCCC(=O)[C@H](C)N(C)C 1458a_100009822176_100000210211 [0,0,2,0,0,0|1,0,0]=3 381 B10R0.81 CCCCC(=O)[C@H](O)C(C)C 1458a_100000691806_100000210211 [0,0,2,0,0,0|1,0,0]=3 382 B10R0.81 CCCCN(C)C(C)C(C)C 2230a_100000228512_100000210211 [0,0,2,0,0,0|2,0,0]=4 383 B10R0.81 CCCCN(C)C(C)C(C)C 269982a_100000228512_100000210211 [0,0,2,0,0,0|2,0,0]=4 384 B10R0.81 CCCNC(=O)C(C)C(C)C 11a_100020643023_100000755409 [0,0,2,0,0,0|1,0,0]=3 385 B10R0.81 CCCNC(=O)C(C)C(C)C 1626a_100020643023_100000755409 [0,0,2,0,0,0|1,0,0]=3 386 B10R0.81 CCCNC(=O)C(C)C(C)C 240690a_100020643023_100000755409 [0,0,2,0,0,0|1,0,0]=3 387 B10R0.81 CCCNC(=O)C(C)C(C)C 527a_100020643023_100000755409 [0,0,2,0,0,0|1,0,0]=3 388 B10R0.81 CCCNC(=O)C(C)N(C)C 2230a_100102631434_100000230305 [0,0,2,0,0,0|2,0,0]=4 389 B10R0.81 CCCNC(=O)C(C)N(C)C 269982a_100102631434_100000230305 [0,0,2,0,0,0|2,0,0]=4 390 B10R0.81 CCCNC(=O)N(C)C(C)C 2708a_100020643023_200000211004 [0,0,2,0,0,0|2,0,0]=4 391 B10R0.81 CCCNC(=O)N(C)C(C)C 273464a_100020643023_200000211004 [0,0,2,0,0,0|2,0,0]=4 392 B10R0.81 CCCNC(=O)[C@H](C)N(C)C 240690a_100020643023_100009822176 [0,0,2,0,0,0|2,0,0]=4 393 B10R0.81 CCCNC(=O)[C@H](C)N(C)C 527a_100020643023_100009822176 [0,0,2,0,0,0|2,0,0]=4 394 B10R0.81 CCCNC(=O)[C@H](O)C(C)C 240690a_100020643023_100000691806 [0,0,2,0,0,0|2,0,0]=4 395 B10R0.81 CCCOC(=O)C(C)N(C)C 2230a_100102631434_100000760410 [0,0,2,0,0,0|2,0,0]=4 396 B10R0.81 CCCOC(=O)C(C)N(C)C 269982a_100102631434_100000760410 [0,0,2,0,0,0|2,0,0]=4 397 B10R0.81 CCNCC(=O)N(C)C(C)C 2230a_100015525214_100000230190 [0,0,2,0,0,0|2,0,0]=4 398 B10R0.81 CCNNC(=O)C(C)C(C)C 22a_100000756455_100000755409 [0,0,2,0,0,0|2,0,0]=4 399 B10R0.81 CCOCC(=O)N(C)C(C)C 11a_200000211004_100000211967 [0,0,2,0,0,0|2,0,0]=4 400 B10R0.81 CCOCC(=O)N(C)C(C)C 1626a_200000211004_100000211967 [0,0,2,0,0,0|2,0,0]=4 401 B10R0.81 CCOCC(=O)N(C)C(C)C 240690a_200000211004_100000211967 [0,0,2,0,0,0|2,0,0]=4 402 B10R0.81 CCOCC(=O)N(C)C(C)C 34a_100121572206_100000230190 [0,0,2,0,0,0|2,0,0]=4 403 B10R0.81 CCOCC(=O)N(C)C(C)C 527a_200000211004_100000211967 [0,0,2,0,0,0|2,0,0]=4 404 B10R0.81 CCSCC(=O)N(C)C(C)C 11a_200000211004_100000230394 [0,0,2,0,0,0|2,0,0]=4 405 B10R0.81 CCSCC(=O)N(C)C(C)C 1626a_200000211004_100000230394 [0,0,2,0,0,0|2,0,0]=4 406 B10R0.81 CCSCC(=O)N(C)C(C)C 240690a_200000211004_100000230394 [0,0,2,0,0,0|2,0,0]=4 407 B10R0.81 CCSCC(=O)N(C)C(C)C 527a_200000211004_100000230394 [0,0,2,0,0,0|2,0,0]=4 408 B10R0.81 CCSCC(=O)N(C)C(C)C 62a_100000210202_100000230190 [0,0,2,0,0,0|2,0,0]=4 409 B10R0.81 CCSCC(=O)N(C)C(C)C 62a_100000230190_100000210202 [0,0,2,0,0,0|2,0,0]=4 410 B10R0.81 COCCC(=O)C(C)C(C)C 1458a_100000755409_100000233755 [0,0,2,0,0,0|1,0,0]=3 411 B10R0.81 COCCC(=O)N(C)C(C)C 11a_200000211004_100000749529 [0,0,2,0,0,0|2,0,0]=4 412 B10R0.81 COCCC(=O)N(C)C(C)C 1626a_200000211004_100000749529 [0,0,2,0,0,0|2,0,0]=4 413 B10R0.81 COCCC(=O)N(C)C(C)C 240690a_200000211004_100000749529 [0,0,2,0,0,0|2,0,0]=4 414 B10R0.81 COCCC(=O)N(C)C(C)C 527a_200000211004_100000749529 [0,0,2,0,0,0|2,0,0]=4 415 B10R0.81 COCCC(=O)[C@H](C)N(C)C 1458a_100009822176_100000233755 [0,0,2,0,0,0|2,0,0]=4 416 B10R0.81 COCCC(=O)[C@H](O)C(C)C 1458a_100000691806_100000233755 [0,0,2,0,0,0|2,0,0]=4 417 B10R0.81 CSCCC(=O)C(C)C(C)C 1458a_100000755409_100000751147 [0,0,2,0,0,0|1,0,0]=3 418 B10R0.81 CSCCC(=O)N(C)C(C)C 11a_200000211004_100000174002 [0,0,2,0,0,0|2,0,0]=4 419 B10R0.81 CSCCC(=O)N(C)C(C)C 1626a_200000211004_100000174002 [0,0,2,0,0,0|2,0,0]=4 420 B10R0.81 CSCCC(=O)N(C)C(C)C 240690a_200000211004_100000174002 [0,0,2,0,0,0|2,0,0]=4 421 B10R0.81 CSCCC(=O)N(C)C(C)C 527a_200000211004_100000174002 [0,0,2,0,0,0|2,0,0]=4 422 B10R0.81 CSCCC(=O)[C@H](C)N(C)C 1458a_100009822176_100000751147 [0,0,2,0,0,0|2,0,0]=4 423 B10R0.81 CSCCC(=O)[C@H](O)C(C)C 1458a_100000691806_100000751147 [0,0,2,0,0,0|2,0,0]=4 424 B10R0.81 C[C@@H](C(=O)CCCF)N(C)C 1458a_100009822176_100011934791 [0,0,2,0,0,0|2,0,0]=4 425 B10R0.81 C[C@@H](C(=O)CCCO)N(C)C 1458a_100009822176_100011215043 [0,0,2,0,0,0|2,0,0]=4 426 B10R0.104 COCC(C)(C)N(C)C(=O)C 11a_100000734271_100015343762 [0,0,2,0,0,0|2,0,0]=4 427 B10R0.104 COCC(C)(C)N(C)C(=O)C 1626a_100000734271_100015343762 [0,0,2,0,0,0|2,0,0]=4 428 B10R0.104 COCC(C)(C)N(C)C(=O)C 240690a_100000734271_100015343762 [0,0,2,0,0,0|2,0,0]=4 429 B10R0.104 COCC(C)(C)N(C)C(=O)C 527a_100000734271_100103153847 [0,0,2,0,0,0|2,0,0]=4 430 B10R0.133 CCCCC(C)(OC)C(C)C 7a_200011215085_200000210301 [0,0,2,0,0,0|2,0,0]=4 431 B10R0.133 CCCCC(C)(O[13CH3])C(C)C 7a_200011215085_200025704644 [0,0,2,0,0,0|2,0,0]=4 432 B10R0.149 C=C(C)C(C)(OCC)C(C)C 7a_200012178551_100000210202 [0,0,2,0,0,0|2,0,0]=4 433 B10R0.149 CCNC(C)(C(=O)N)C(C)C 2230a_100000729261_100000210202 [0,0,2,0,0,0|2,0,0]=4 434 B10R0.149 CCNC(C)(C(=O)N)C(C)C 34a_100000729261_100000210202 [0,0,2,0,0,0|2,0,0]=4 435 B12R2.291 CN1CCN(CC1=O)C2CC2 269982a_100000187256_100000211595 [0,0,1,1,0,0|2,0,0]=4 436 B10R1.194 CN1CCC(C1=O)N(C)C 2230a_100102631434_100000755940 [0,0,1,0,1,0|2,0,0]=4 437 B10R1.194 CN1CCC(C1=O)N(C)C 269982a_100102631434_100000755940 [0,0,1,0,1,0|2,0,0]=4 438 B12R1.19 CC(C)CN1CCN(C(=O)C1)C 2230a_100000187256_100000210760 [0,0,1,0,0,1|2,0,0]=4 439 B12R1.19 CC(C)CN1CCN(C(=O)C1)C 269982a_100000187256_100000210624 [0,0,1,0,0,1|2,0,0]=4 440 B12R1.19 CC(C)CN1CCN(C(=O)C1)C 270004a_100000187256_100000210432 [0,0,1,0,0,1|2,0,0]=4 441 B12R1.19 CC(C)NC1CCN(C(=O)C1)C 2230a_100000126938_100000210206 [0,0,1,0,0,1|1,0,0]=3 442 B12R1.19 CC(C)NC1CCN(C(=O)C1)C 34a_100000126938_100000210206 [0,0,1,0,0,1|1,0,0]=3 443 B12R1.19 CC(C)OC1CCC(C(C1)C)C 34a_100011215933_100000210206 [0,0,1,0,0,1|1,0,1]=4 444 B12R1.19 CC(C)OC1CCC(C(C1)C)C 7a_100011215933_100000210206 [0,0,1,0,0,1|1,0,1]=4 445 B12R1.892 CC(C)N1CCC(=O)N(CC1)C 2230a_100020591582_100000210206 [0,0,1,0,0,1|2,0,0]=4 446 B12R1.892 CC(C)N1CCC(=O)N(CC1)C 269982a_100020591582_100000210206 [0,0,1,0,0,1|2,0,0]=4 447 B12R1.892 CC(C)N1CCC(=O)N(CC1)C 34a_100020591582_100000210206 [0,0,1,0,0,1|2,0,0]=4 448 B12R1.1021 CC(C)N1CCCN(C(=O)C1)C 2230a_100000709885_100000210206 [0,0,1,0,0,1|2,0,0]=4 449 B12R1.1021 CC(C)N1CCCN(C(=O)C1)C 269982a_100000709885_100000210206 [0,0,1,0,0,1|2,0,0]=4 450 B12R1.1021 CC(C)N1CCCN(C(=O)C1)C 34a_100000709885_100000210206 [0,0,1,0,0,1|2,0,0]=4 451 B12R1.115 CC1(CC(CCN1CC=O)O)C 2230a_100102422732_200015260668 [0,0,1,0,0,1|2,0,0]=4 452 B12R1.115 CC1(CC(CCN1CC=O)O)C 269982a_100102422732_200015260668 [0,0,1,0,0,1|2,0,0]=4 453 B12R1.115 CN1CCN(C(C1)(C)C)CC=O 2230a_200000695439_200015260668 [0,0,1,0,0,1|2,0,0]=4 454 B12R1.115 CN1CCN(C(C1)(C)C)CC=O 269982a_200000695439_200015260668 [0,0,1,0,0,1|2,0,0]=4 455 B12R1.545 CC1(CN(CCC1O)CC=O)C 2230a_100000709803_200015260668 [0,0,1,0,0,1|2,0,0]=4 456 B12R1.545 CC1(CN(CCC1O)CC=O)C 269982a_100000709803_200015260668 [0,0,1,0,0,1|2,0,0]=4 457 B12R1.545 CC1(CN(CCC1O)CC=O)C 34a_100000709803_200009817547 [0,0,1,0,0,1|2,0,0]=4