0 B11R1.166 CC(C)N1CCN(CC1=O)C 2230a_100000698735_200000210301 [0,0,0,0,0,0|2,0,2]=4 1 B11R1.166 CC(C)N1CCN(CC1=O)C 269982a_100000698735_200000210301 [0,0,0,0,0,0|2,0,2]=4 2 B11R1.166 CC(C)N1CCN(CC1=O)C 34a_100000698735_200000210301 [0,0,0,0,0,0|2,0,2]=4 3 B11R1.166 CC(C)N1CCN(CC1=O)[13CH3] 2230a_100000698735_200025704644 [0,0,0,0,0,0|2,0,2]=4 4 B11R1.166 CC(C)N1CCN(CC1=O)[13CH3] 269982a_100000698735_200025704644 [0,0,0,0,0,0|2,0,2]=4 5 B11R1.166 CC(C)N1CCN(CC1=O)[13CH3] 34a_100000698735_200025704644 [0,0,0,0,0,0|2,0,2]=4 6 B11R1.166 CC(C)N1CCN(CC1C)C 2230a_200011726126_200000210301 [0,0,0,0,0,0|3,0,0]=3 7 B11R1.166 CC(C)N1CCN(CC1C)C 269982a_200011726126_200000210301 [0,0,0,0,0,0|3,0,0]=3 8 B11R1.166 CC(C)N1CCN(CC1C)C 34a_200011726126_200000210301 [0,0,0,0,0,0|3,0,0]=3 9 B11R1.166 CC(C)N1CCN(CC1C)[13CH3] 2230a_200011726126_200025704644 [0,0,0,0,0,0|3,0,0]=3 10 B11R1.166 CC(C)N1CCN(CC1C)[13CH3] 269982a_200011726126_200025704644 [0,0,0,0,0,0|3,0,0]=3 11 B11R1.166 CC(C)N1CCN(CC1C)[13CH3] 34a_200011726126_200025704644 [0,0,0,0,0,0|3,0,0]=3 12 B11R1.166 CC(C)N1CCN(C[C@@H]1C)C 2230a_100012002466_100000210206 [0,0,0,0,0,0|3,0,0]=3 13 B11R1.166 CC(C)N1CCN(C[C@@H]1C)C 269982a_100012002466_100000210206 [0,0,0,0,0,0|3,0,0]=3 14 B10R1.13 C=C1CCC(CC1)N(C)C 270004a_100102631434_100010272673 [1,0,0,0,0,0|1,0,2]=4 15 B10R1.13 C=C1CCN(CC1)C(C)C 2230a_100000752442_100000210206 [1,0,0,0,0,0|1,0,2]=4 16 B10R1.13 C=C1CCN(CC1)C(C)C 269982a_100000752442_100000210206 [1,0,0,0,0,0|1,0,2]=4 17 B10R1.13 C=C1CCN(CC1)C(C)C 34a_100000752442_100000210206 [1,0,0,0,0,0|1,0,2]=4 18 B10R1.13 CC(=O)C1CCC(CC1)C 1458a_100000070787_200011216234 [1,0,0,0,0,0|1,0,1]=3 19 B10R1.13 CC(=O)C1CCC(CC1)O 1458a_100000743365_200000210301 [1,0,0,0,0,0|2,0,1]=4 20 B10R1.13 CC(=O)C1CCN(CC1)C 1458a_100000743488_200000210301 [1,0,0,0,0,0|2,0,1]=4 21 B10R1.13 CC(=O)N1CCC(CC1)C 240690a_100000188429_100015343762 [1,0,0,0,0,0|2,0,1]=4 22 B10R1.13 CC(=O)N1CCC(CC1)C 527a_100000188429_100103153847 [1,0,0,0,0,0|2,0,1]=4 23 B10R1.13 CC(=O)[C@H]1CC[C@@H](CC1)C 1458a_100009815934_200000210301 [1,0,0,0,0,0|1,0,1]=3 24 B10R1.13 CC(C)C1CCN(CC1)C 2230a_100000762885_200000210301 [1,0,0,0,0,0|1,0,0]=2 25 B10R1.13 CC(C)C1CCN(CC1)C 269982a_100000762885_200000210301 [1,0,0,0,0,0|1,0,0]=2 26 B10R1.13 CC(C)C1CCN(CC1)C 34a_100000762885_200000210301 [1,0,0,0,0,0|1,0,0]=2 27 B10R1.13 CC(C)C1CCN(CC1)[13CH3] 2230a_100000762885_200025704644 [1,0,0,0,0,0|1,0,0]=2 28 B10R1.13 CC(C)C1CCN(CC1)[13CH3] 269982a_100000762885_200025704644 [1,0,0,0,0,0|1,0,0]=2 29 B10R1.13 CC(C)C1CCN(CC1)[13CH3] 34a_100000762885_200025704644 [1,0,0,0,0,0|1,0,0]=2 30 B10R1.13 CC(C)N1CCC(CC1)F 2230a_100015193889_100000210206 [1,0,0,0,0,0|2,0,0]=3 31 B10R1.13 CC(C)N1CCC(CC1)F 269982a_100015193889_100000210206 [1,0,0,0,0,0|2,0,0]=3 32 B10R1.13 CC(C)N1CCC(CC1)F 34a_100015193889_100000210206 [1,0,0,0,0,0|2,0,0]=3 33 B10R1.13 CC(C)N1CCC(CC1)O 2230a_100025773856_100000210206 [1,0,0,0,0,0|2,0,0]=3 34 B10R1.13 CC(C)N1CCC(CC1)O 269982a_100025773856_100000210206 [1,0,0,0,0,0|2,0,0]=3 35 B10R1.13 CC(C)N1CCN(CC1)C 2230a_100000188432_100000210206 [1,0,0,0,0,0|2,0,0]=3 36 B10R1.13 CC(C)N1CCN(CC1)C 2230a_100000246833_200000210301 [1,0,0,0,0,0|2,0,0]=3 37 B10R1.13 CC(C)N1CCN(CC1)C 269982a_100000188432_100000210206 [1,0,0,0,0,0|2,0,0]=3 38 B10R1.13 CC(C)N1CCN(CC1)C 269982a_100000246833_200000210301 [1,0,0,0,0,0|2,0,0]=3 39 B10R1.13 CC(C)N1CCN(CC1)[13CH3] 2230a_100000246833_200025704644 [1,0,0,0,0,0|2,0,0]=3 40 B10R1.13 CC(C)N1CCN(CC1)[13CH3] 269982a_100000246833_200025704644 [1,0,0,0,0,0|2,0,0]=3 41 B10R1.13 CC(C)N1CCS(=O)CC1 2230a_100000752083_100000210206 [1,0,0,0,0,0|3,0,0]=4 42 B10R1.13 CC(C)N1CCS(=O)CC1 269982a_100000752083_100000210206 [1,0,0,0,0,0|3,0,0]=4 43 B10R1.13 CC(O)C1CCN(CC1)C 2230a_100011728446_200000210301 [1,0,0,0,0,0|2,0,0]=3 44 B10R1.13 CC(O)C1CCN(CC1)C 269982a_100011728446_200000210301 [1,0,0,0,0,0|2,0,0]=3 45 B10R1.13 CC(O)C1CCN(CC1)C 34a_100011728446_200000210301 [1,0,0,0,0,0|2,0,0]=3 46 B10R1.13 CC(O)C1CCN(CC1)[13CH3] 2230a_100011728446_200025704644 [1,0,0,0,0,0|2,0,0]=3 47 B10R1.13 CC(O)C1CCN(CC1)[13CH3] 269982a_100011728446_200025704644 [1,0,0,0,0,0|2,0,0]=3 48 B10R1.13 CC(O)C1CCN(CC1)[13CH3] 34a_100011728446_200025704644 [1,0,0,0,0,0|2,0,0]=3 49 B10R1.13 CC1=CCN(CC1)C(C)C 2230a_100000693516_100000210206 [1,0,0,0,0,0|1,0,2]=4 50 B10R1.13 CC1=CCN(CC1)C(C)C 269982a_100000693516_100000210206 [1,0,0,0,0,0|1,0,2]=4 51 B10R1.13 CC1=CCN(CC1)C(C)C 34a_100000693516_100000210206 [1,0,0,0,0,0|1,0,2]=4 52 B10R1.13 CC1CCC(CC1)N(C)C 269982a_100102631434_200011216234 [1,0,0,0,0,0|1,0,0]=2 53 B10R1.13 CC1CCC(CC1)N(C)C 270004a_100102631434_100000185489 [1,0,0,0,0,0|1,0,0]=2 54 B10R1.13 CC1CCN(CC1)C(C)C 2230a_100000188429_100000210206 [1,0,0,0,0,0|1,0,0]=2 55 B10R1.13 CC1CCN(CC1)C(C)C 269982a_100000188429_100000210206 [1,0,0,0,0,0|1,0,0]=2 56 B10R1.13 CC1CCN(CC1)C(C)C 34a_100000188429_100000210206 [1,0,0,0,0,0|1,0,0]=2 57 B10R1.13 CN(C)C1CCC(CC1)O 270004a_100102631434_100000764474 [1,0,0,0,0,0|2,0,0]=3 58 B10R1.13 CN(C)C1CCN(CC1)[13CH3] 2230a_100011226131_200025704644 [1,0,0,0,0,0|2,0,0]=3 59 B10R1.13 CN(C)C1CCN(CC1)[13CH3] 269982a_100011226131_200025704644 [1,0,0,0,0,0|2,0,0]=3 60 B10R1.13 CN(C)[C@H]1CC[C@H](CC1)O 2230a_100020636401_200000210301 [1,0,0,0,0,0|2,0,0]=3 61 B10R1.13 CN(C)[C@H]1CC[C@H](CC1)O 269982a_100020636401_200000210301 [1,0,0,0,0,0|2,0,0]=3 62 B10R1.13 CN([13CH3])[C@H]1CC[C@H](CC1)O 2230a_100020636401_200025704644 [1,0,0,0,0,0|2,0,0]=3 63 B10R1.13 CN([13CH3])[C@H]1CC[C@H](CC1)O 269982a_100020636401_200025704644 [1,0,0,0,0,0|2,0,0]=3 64 B10R1.13 CN1CCC(CC1)C(=O)[13CH3] 1458a_100000743488_200025704644 [1,0,0,0,0,0|2,0,1]=4 65 B10R1.13 CN1CCC(CC1)C(F)F 2230a_100000689141_200000210301 [1,0,0,0,0,0|3,0,0]=4 66 B10R1.13 CN1CCC(CC1)C(F)F 269982a_100000689141_200000210301 [1,0,0,0,0,0|3,0,0]=4 67 B10R1.13 CN1CCC(CC1)C(F)F 34a_100000689141_200000210301 [1,0,0,0,0,0|3,0,0]=4 68 B10R1.13 CN1CCC(CC1)N(C)C 2230a_100011226131_200000210301 [1,0,0,0,0,0|2,0,0]=3 69 B10R1.13 CN1CCC(CC1)N(C)C 2230a_100025768347_200000210301 [1,0,0,0,0,0|2,0,0]=3 70 B10R1.13 CN1CCC(CC1)N(C)C 269982a_100011226131_200000210301 [1,0,0,0,0,0|2,0,0]=3 71 B10R1.13 CN1CCC(CC1)N(C)C 269982a_100025768347_200000210301 [1,0,0,0,0,0|2,0,0]=3 72 B10R1.13 CN1CCC(CC1)N(C)C 269982a_100102631434_100011215917 [1,0,0,0,0,0|2,0,0]=3 73 B10R1.13 CN1CCC(CC1)N(C)C 270004a_100102631434_100000210137 [1,0,0,0,0,0|2,0,0]=3 74 B10R1.13 CN1CCC(CC1)N(C)[13CH3] 2230a_100025768347_200025704644 [1,0,0,0,0,0|2,0,0]=3 75 B10R1.13 CN1CCC(CC1)N(C)[13CH3] 269982a_100025768347_200025704644 [1,0,0,0,0,0|2,0,0]=3 76 B10R1.13 C[C@H]1CC[C@@H](CC1)C(=O)[13CH3] 1458a_100009815934_200025704644 [1,0,0,0,0,0|1,0,1]=3 77 B10R1.13 [13CH3]C(=O)C1CCC(CC1)O 1458a_100000743365_200025704644 [1,0,0,0,0,0|2,0,1]=4 78 B10R1.13 [13CH3]N1CCC(CC1)C(F)F 2230a_100000689141_200025704644 [1,0,0,0,0,0|3,0,0]=4 79 B10R1.13 [13CH3]N1CCC(CC1)C(F)F 269982a_100000689141_200025704644 [1,0,0,0,0,0|3,0,0]=4 80 B10R1.13 [13CH3]N1CCC(CC1)C(F)F 34a_100000689141_200025704644 [1,0,0,0,0,0|3,0,0]=4 81 B10R1.25 CC1CCC(C(C1)C)O[13CH3] 34a_100011539931_200025704644 [1,0,0,0,0,0|2,0,0]=3 82 B10R1.25 CC1CCC(C(C1)C)O[13CH3] 7a_100011539931_200025704644 [1,0,0,0,0,0|2,0,0]=3 83 B10R1.25 CCN1CCN(CC1C)C 2230a_100000753023_200000210301 [1,0,0,0,0,0|3,0,0]=4 84 B10R1.25 CCN1CCN(CC1C)C 269982a_100000753023_200000210301 [1,0,0,0,0,0|3,0,0]=4 85 B10R1.25 CCN1CCN(CC1C)[13CH3] 2230a_100000753023_200025704644 [1,0,0,0,0,0|3,0,0]=4 86 B10R1.25 CCN1CCN(CC1C)[13CH3] 269982a_100000753023_200025704644 [1,0,0,0,0,0|3,0,0]=4 87 B10R1.25 CCN1CCN(C[C@@H]1C)C 2230a_100012002466_100000210202 [1,0,0,0,0,0|3,0,0]=4 88 B10R1.25 CCN1CCN(C[C@@H]1C)C 269982a_100012002466_100000204670 [1,0,0,0,0,0|3,0,0]=4 89 B10R1.25 COC1CCC(CC1C)C 34a_100011539931_200000210301 [1,0,0,0,0,0|2,0,0]=3 90 B10R1.25 COC1CCC(CC1C)C 7a_100011539931_200000210301 [1,0,0,0,0,0|2,0,0]=3 91 B10R1.25 CO[C@@H]1CCN(C[C@H]1O)C 2230a_200015396376_200000210301 [1,0,0,0,0,0|2,0,0]=3 92 B10R1.25 CO[C@@H]1CCN(C[C@H]1O)C 269982a_200015396376_200000210301 [1,0,0,0,0,0|2,0,0]=3 93 B10R1.25 CO[C@@H]1CCN(C[C@H]1O)[13CH3] 2230a_200015396376_200025704644 [1,0,0,0,0,0|2,0,0]=3 94 B10R1.25 CO[C@@H]1CCN(C[C@H]1O)[13CH3] 269982a_200015396376_200025704644 [1,0,0,0,0,0|2,0,0]=3 95 B10R1.61 CC(=O)C1CCCCC1C 1458a_100011215568_200000210301 [1,0,0,0,0,0|2,0,1]=4 96 B10R1.61 CC(=O)C1CCCCC1O 1458a_100011803323_200000210301 [1,0,0,0,0,0|1,0,1]=3 97 B10R1.61 CC(C)C1CCCCN1C 2230a_100000757267_200000210301 [1,0,0,0,0,0|2,0,0]=3 98 B10R1.61 CC(C)C1CCCCN1C 269982a_100000757267_200000210301 [1,0,0,0,0,0|2,0,0]=3 99 B10R1.61 CC(C)C1CCCCN1C 34a_100000757267_200000210301 [1,0,0,0,0,0|2,0,0]=3 100 B10R1.61 CC(C)C1CCCCN1[13CH3] 2230a_100000757267_200025704644 [1,0,0,0,0,0|2,0,0]=3 101 B10R1.61 CC(C)C1CCCCN1[13CH3] 269982a_100000757267_200025704644 [1,0,0,0,0,0|2,0,0]=3 102 B10R1.61 CC(C)C1CCCCN1[13CH3] 34a_100000757267_200025704644 [1,0,0,0,0,0|2,0,0]=3 103 B10R1.61 CC(C)N1CCCCC1C 2230a_100000211376_100000210206 [1,0,0,0,0,0|2,0,0]=3 104 B10R1.61 CC(C)N1CCCCC1C 269982a_100000211376_100000210206 [1,0,0,0,0,0|2,0,0]=3 105 B10R1.61 CC(C)N1CCCCC1C 34a_100000211376_100000210206 [1,0,0,0,0,0|2,0,0]=3 106 B10R1.61 CC(C)N1CCOC[C@@H]1C 2230a_100009815349_100000210206 [1,0,0,0,0,0|3,0,0]=4 107 B10R1.61 CC(C)N1CCOC[C@@H]1C 269982a_100009815349_100000210206 [1,0,0,0,0,0|3,0,0]=4 108 B10R1.61 CC(C)N1CCOC[C@@H]1C 34a_100009815349_100000210206 [1,0,0,0,0,0|3,0,0]=4 109 B10R1.61 CC(C)[C@H]1COCCN1C 2230a_100025712635_200000210301 [1,0,0,0,0,0|3,0,0]=4 110 B10R1.61 CC(C)[C@H]1COCCN1C 269982a_100025712635_200000210301 [1,0,0,0,0,0|3,0,0]=4 111 B10R1.61 CC(C)[C@H]1COCCN1C 34a_100025712635_200000210301 [1,0,0,0,0,0|3,0,0]=4 112 B10R1.61 CC(C)[C@H]1COCCN1[13CH3] 2230a_100025712635_200025704644 [1,0,0,0,0,0|3,0,0]=4 113 B10R1.61 CC(C)[C@H]1COCCN1[13CH3] 269982a_100025712635_200025704644 [1,0,0,0,0,0|3,0,0]=4 114 B10R1.61 CC(C)[C@H]1COCCN1[13CH3] 34a_100025712635_200025704644 [1,0,0,0,0,0|3,0,0]=4 115 B10R1.61 CC1CCCCC1C(=O)[13CH3] 1458a_100011215568_200025704644 [1,0,0,0,0,0|2,0,1]=4 116 B10R1.61 CC1CCCCC1N(C)C 270004a_100102631434_100000210921 [1,0,0,0,0,0|2,0,0]=3 117 B10R1.61 CC1CNCCC1N(C)C 270004a_100102631434_100000703950 [1,0,0,0,0,0|3,0,0]=4 118 B10R1.61 CC1COCCC1N(C)C 270004a_100102631434_100000755695 [1,0,0,0,0,0|3,0,0]=4 119 B10R1.61 CN(C)C1CCCCC1=O 269982a_100102631434_100000204591 [1,0,0,0,0,0|1,0,2]=4 120 B10R1.61 CN(C)C1CCCCC1F 269982a_100102631434_100015423560 [1,0,0,0,0,0|2,0,0]=3 121 B10R1.61 CN(C)C1CCCCC1O 269982a_100102631434_100000038908 [1,0,0,0,0,0|1,0,0]=2 122 B10R1.61 CN(C)[C@@H]1CCCC[C@H]1O 269982a_100000708425_200000210301 [1,0,0,0,0,0|1,0,0]=2 123 B10R1.61 CN([13CH3])[C@@H]1CCCC[C@H]1O 269982a_100000708425_200025704644 [1,0,0,0,0,0|1,0,0]=2 124 B10R1.61 [13CH3]C(=O)C1CCCCC1O 1458a_100011803323_200025704644 [1,0,0,0,0,0|1,0,1]=3 125 B12R1.57 C=C(C)[C@@H]1CC[C@H](C[C@H]1OC)C 34a_100016197468_200000210301 [0,1,0,0,0,0|0,0,2]=3 126 B12R1.57 C=C(C)[C@@H]1CC[C@H](C[C@H]1OC)C 7a_100016197468_200000210301 [0,1,0,0,0,0|0,0,2]=3 127 B12R1.57 C=C(C)[C@@H]1CC[C@H](C[C@H]1O[13CH3])C 34a_100016197468_200025704644 [0,1,0,0,0,0|0,0,2]=3 128 B12R1.57 C=C(C)[C@@H]1CC[C@H](C[C@H]1O[13CH3])C 7a_100016197468_200025704644 [0,1,0,0,0,0|0,0,2]=3 129 B12R1.57 CC(C)[C@@H]1CC[C@H](C[C@H]1N[13CH3])C 2230a_100025773825_200025704644 [0,1,0,0,0,0|1,0,0]=2 130 B12R1.57 CC(C)[C@@H]1CC[C@H](C[C@H]1N[13CH3])C 34a_100025773825_200025704644 [0,1,0,0,0,0|1,0,0]=2 131 B12R1.57 CC(C)[C@H]1CC[C@@H](C[C@@H]1O[13CH3])C 34a_100000763588_200025704644 [0,1,0,0,0,0|0,0,0]=1 132 B12R1.57 CC(C)[C@H]1CC[C@@H](C[C@@H]1O[13CH3])C 7a_100000763588_200025704644 [0,1,0,0,0,0|0,0,0]=1 133 B12R1.57 CC(C)[C@H]1CC[C@@H](C[C@@H]1S[13CH3])C 62a_200009893639_200025704644 [0,1,0,0,0,0|0,1,0]=2 134 B12R1.57 CC(C)[C@H]1CC[C@@H](C[C@@H]1S[13CH3])C 62a_200025704644_200009893639 [0,1,0,0,0,0|0,1,0]=2 135 B12R1.57 CCC1CN(CCN1C(C)C)C 2230a_100011941019_100000210206 [0,1,0,0,0,0|3,0,0]=4 136 B12R1.57 CCC1CN(CCN1C(C)C)C 2230a_200011886666_200000210301 [0,1,0,0,0,0|3,0,0]=4 137 B12R1.57 CCC1CN(CCN1C(C)C)C 269982a_100011941019_100000210206 [0,1,0,0,0,0|3,0,0]=4 138 B12R1.57 CCC1CN(CCN1C(C)C)C 269982a_200011886666_200000210301 [0,1,0,0,0,0|3,0,0]=4 139 B12R1.57 CCC1CN(CCN1C(C)C)C 34a_200011886666_200000210301 [0,1,0,0,0,0|3,0,0]=4 140 B12R1.57 CCC1CN(CCN1C(C)C)[13CH3] 2230a_200011886666_200025704644 [0,1,0,0,0,0|3,0,0]=4 141 B12R1.57 CCC1CN(CCN1C(C)C)[13CH3] 269982a_200011886666_200025704644 [0,1,0,0,0,0|3,0,0]=4 142 B12R1.57 CCC1CN(CCN1C(C)C)[13CH3] 34a_200011886666_200025704644 [0,1,0,0,0,0|3,0,0]=4 143 B12R1.57 CNC1C[C@@H](CC[C@H]1C(C)C)C 269862a_106832991636_100009815803 [0,1,0,0,0,0|1,0,0]=2 144 B12R1.57 CN[C@@H]1C[C@@H](CC[C@H]1C(C)C)C 2230a_100025773825_200000210301 [0,1,0,0,0,0|1,0,0]=2 145 B12R1.57 CN[C@@H]1C[C@@H](CC[C@H]1C(C)C)C 34a_100025773825_200000210301 [0,1,0,0,0,0|1,0,0]=2 146 B12R1.57 CN[C@H]1C[C@H](CC[C@@H]1C(C)C)C 34a_100102657272_200009893639 [0,1,0,0,0,0|1,0,0]=2 147 B12R1.57 CO[C@H]1C[C@H](CC[C@@H]1C(C)C)C 34a_100000763588_200000210301 [0,1,0,0,0,0|0,0,0]=1 148 B12R1.57 CO[C@H]1C[C@H](CC[C@@H]1C(C)C)C 34a_100138415774_200009893639 [0,1,0,0,0,0|0,0,0]=1 149 B12R1.57 CO[C@H]1C[C@H](CC[C@@H]1C(C)C)C 7a_100000763588_200000210301 [0,1,0,0,0,0|0,0,0]=1 150 B12R1.57 CS[C@H]1C[C@H](CC[C@@H]1C(C)C)C 62a_200000210301_200009893639 [0,1,0,0,0,0|0,1,0]=2 151 B12R1.57 CS[C@H]1C[C@H](CC[C@@H]1C(C)C)C 62a_200009893639_200000210301 [0,1,0,0,0,0|0,1,0]=2 152 B12R1.126 C[C@H]1CN(CCN1C(C)(C)C)C 269982a_100012002466_100000210625 [0,1,0,0,0,0|3,0,0]=4 153 B12R1.452 CC(C)N1CCN(CC1C)CF 269982a_200011726126_100015361967 [0,1,0,0,0,0|3,0,0]=4 154 B12R1.452 CC(C)N1CCN(CC1C)CF 34a_200011726126_100015361967 [0,1,0,0,0,0|3,0,0]=4 155 B12R1.452 CCN1CCC(C(C1)C)N(C)C 270004a_100102631434_100000759811 [0,1,0,0,0,0|3,0,0]=4 156 B12R1.452 CCN1CCN(C(C1)C)C(C)C 2230a_200011726126_100000210202 [0,1,0,0,0,0|3,0,0]=4 157 B12R1.452 CCN1CCN(C(C1)C)C(C)C 269982a_200011726126_100000204670 [0,1,0,0,0,0|3,0,0]=4 158 B12R1.452 CCN1CCN(C(C1)C)C(C)C 34a_200011726126_100000210202 [0,1,0,0,0,0|3,0,0]=4 159 B12R1.1280 CC(C)N1CCC(CC1(C)C)O 2230a_100102422732_100000210206 [0,1,0,0,0,0|3,0,0]=4 160 B12R1.1280 CC(C)N1CCC(CC1(C)C)O 269982a_100102422732_100000210206 [0,1,0,0,0,0|3,0,0]=4 161 B12R1.1280 CC(C)N1CCN(CC1(C)C)C 2230a_200000695439_100000210206 [0,1,0,0,0,0|3,0,0]=4 162 B12R1.1280 CC(C)N1CCN(CC1(C)C)C 269982a_200000695439_100000210206 [0,1,0,0,0,0|3,0,0]=4 163 B12R1.1703 CC(CO)N1CCN(C[C@@H]1C)C 2230a_100012002466_100012180447 [0,1,0,0,0,0|3,0,0]=4 164 B12R1.1703 CCC(C)N1CCN(C[C@@H]1C)C 2230a_100012002466_100000758301 [0,1,0,0,0,0|3,0,0]=4 165 B12R1.1703 CCC(C)N1CCN(C[C@@H]1C)C 269982a_100012002466_100000758301 [0,1,0,0,0,0|3,0,0]=4 166 B12R1.1703 COC(C)N1CCN(C[C@@H]1C)C 269982a_100012002466_100009879195 [0,1,0,0,0,0|3,0,0]=4 167 B12R1.1703 C[C@H](CO)N1CCN(C[C@@H]1C)C 269982a_100012002466_100016084084 [0,1,0,0,0,0|3,0,0]=4 168 B10R0.3 C#CCC(C)OCCC(C)C 34a_100000685586_100000210312 [0,0,1,0,0,0|2,0,1]=4 169 B10R0.3 C#CCC(C)OCCC(C)C 7a_100000685586_100000210626 [0,0,1,0,0,0|2,0,1]=4 170 B10R0.3 C#CCN(C)CCCC(C)C 2230a_100000225692_100011214892 [0,0,1,0,0,0|2,0,1]=4 171 B10R0.3 C#CCN(C)CCCC(C)C 34a_100000225692_100011214892 [0,0,1,0,0,0|2,0,1]=4 172 B10R0.3 C=C(C)CCN[C@H](C)CCO 2230a_100000706166_100000730704 [0,0,1,0,0,0|1,0,2]=4 173 B10R0.3 C=C(C)CCN[C@H](C)CCO 34a_100000706166_100000730704 [0,0,1,0,0,0|1,0,2]=4 174 B10R0.3 C=C(C)CCOC(C)CCO 34a_100000764851_100009893172 [0,0,1,0,0,0|1,0,2]=4 175 B10R0.3 C=C(C)CCSC(C)CCO 62a_100000730704_100009893172 [0,0,1,0,0,0|1,0,2]=4 176 B10R0.3 C=C(C)CCSC(C)CCO 62a_100009893172_100000730704 [0,0,1,0,0,0|1,0,2]=4 177 B10R0.3 C=CCC(C)COCC(C)C 34a_100009832082_100000210624 [0,0,1,0,0,0|2,0,1]=4 178 B10R0.3 C=CCC(C)COCC(C)C 7a_100009832082_100000210760 [0,0,1,0,0,0|2,0,1]=4 179 B10R0.3 C=CCN(C)CCCC(C)C 2230a_100000225617_100011214892 [0,0,1,0,0,0|2,0,1]=4 180 B10R0.3 C=CCN(C)CCCC(C)C 269982a_100000225617_100011214892 [0,0,1,0,0,0|2,0,1]=4 181 B10R0.3 C=CC[C@@H](C)OCCC(C)C 34a_100000731007_100000210312 [0,0,1,0,0,0|2,0,1]=4 182 B10R0.3 C=CC[C@@H](C)OCCC(C)C 7a_100000731007_100000210626 [0,0,1,0,0,0|2,0,1]=4 183 B10R0.3 CC(=CCCN(C)CCO)C 2230a_100000210263_100011217483 [0,0,1,0,0,0|1,0,2]=4 184 B10R0.3 CC(=CCCN(C)CCO)C 269982a_100000210263_100011217483 [0,0,1,0,0,0|1,0,2]=4 185 B10R0.3 CC(=CCNC(C)CCO)C 34a_100000718196_100009893172 [0,0,1,0,0,0|1,0,2]=4 186 B10R0.3 CC(=CCN[C@H](C)CCO)C 2230a_100000706166_100000761012 [0,0,1,0,0,0|1,0,2]=4 187 B10R0.3 CC(=CCN[C@H](C)CCO)C 34a_100000706166_100000761012 [0,0,1,0,0,0|1,0,2]=4 188 B10R0.3 CC(=CCOC(C)CCO)C 34a_100000753907_100009893172 [0,0,1,0,0,0|1,0,2]=4 189 B10R0.3 CC(=CCSC(C)CCO)C 62a_100000761012_100009893172 [0,0,1,0,0,0|1,0,2]=4 190 B10R0.3 CC(=CCSC(C)CCO)C 62a_100009893172_100000761012 [0,0,1,0,0,0|1,0,2]=4 191 B10R0.3 CC(=O)CCCN(C)CCO 269982a_100000210263_100011215641 [0,0,1,0,0,0|2,0,1]=4 192 B10R0.3 CC(=O)CCOC(C)CCO 34a_100000759926_100009893172 [0,0,1,0,0,0|2,0,1]=4 193 B10R0.3 CC(=O)CCOC(C)CCO 7a_100000759926_100009893172 [0,0,1,0,0,0|2,0,1]=4 194 B10R0.3 CC(=O)CCSC(C)CCO 62a_100000053229_100009893172 [0,0,1,0,0,0|2,0,1]=4 195 B10R0.3 CC(=O)CCSC(C)CCO 62a_100009893172_100000053229 [0,0,1,0,0,0|2,0,1]=4 196 B10R0.3 CC(Br)CCOC(C)CCO 34a_100009893172_100009893172 [0,0,1,0,0,0|2,0,0]=3 197 B10R0.3 CC(C)CCCC(=O)CCF 1458a_100011216857_100011217306 [0,0,1,0,0,0|2,0,1]=4 198 B10R0.3 CC(C)CCCC(=O)CCO 1458a_100011216618_100011214892 [0,0,1,0,0,0|1,0,1]=3 199 B10R0.3 CC(C)CCCC(=O)CCO 1458a_100011216857_100000211926 [0,0,1,0,0,0|1,0,1]=3 200 B10R0.3 CC(C)CCCC(C)OCF 34a_200011218570_100015361967 [0,0,1,0,0,0|2,0,0]=3 201 B10R0.3 CC(C)CCCC(C)OCF 7a_200011218570_100015361967 [0,0,1,0,0,0|2,0,0]=3 202 B10R0.3 CC(C)CCCN(C)CC#N 2230a_100000748184_100011214892 [0,0,1,0,0,0|2,0,1]=4 203 B10R0.3 CC(C)CCCN(C)CCO 2230a_100000210263_100011214892 [0,0,1,0,0,0|1,0,0]=2 204 B10R0.3 CC(C)CCCN(C)CCO 269982a_100000210263_100011214892 [0,0,1,0,0,0|1,0,0]=2 205 B10R0.3 CC(C)CCNC(=O)CCO 240690a_100000210545_100011216618 [0,0,1,0,0,0|2,0,1]=4 206 B10R0.3 CC(C)CCN[C@@H](C)CC#N 2230a_100016994482_100000210312 [0,0,1,0,0,0|2,0,1]=4 207 B10R0.3 CC(C)CCN[C@H](C)CCO 2230a_100000706166_100000210312 [0,0,1,0,0,0|1,0,0]=2 208 B10R0.3 CC(C)CCN[C@H](C)CCO 269862a_100000706166_100000185833 [0,0,1,0,0,0|1,0,0]=2 209 B10R0.3 CC(C)CCN[C@H](C)CCO 34a_100000706166_100000210312 [0,0,1,0,0,0|1,0,0]=2 210 B10R0.3 CC(C)CCOC(C)CC#N 7a_100000210254_100009813641 [0,0,1,0,0,0|2,0,1]=4 211 B10R0.3 CC(C)CCOC(C)CCBr 34a_100012276601_100000210312 [0,0,1,0,0,0|2,0,0]=3 212 B10R0.3 CC(C)CCOC(C)CCO 34a_100000210254_100009893172 [0,0,1,0,0,0|1,0,0]=2 213 B10R0.3 CC(C)CCOC(C)CCO 7a_100000210254_100009893172 [0,0,1,0,0,0|1,0,0]=2 214 B10R0.3 CC(C)CCSC(C)CC#N 62a_100000210312_100009813641 [0,0,1,0,0,0|2,0,1]=4 215 B10R0.3 CC(C)CCSC(C)CC#N 62a_100009813641_100000210312 [0,0,1,0,0,0|2,0,1]=4 216 B10R0.3 CC(C)CCSC(C)CCO 62a_100000210312_100009893172 [0,0,1,0,0,0|1,0,0]=2 217 B10R0.3 CC(C)CCSC(C)CCO 62a_100009893172_100000210312 [0,0,1,0,0,0|1,0,0]=2 218 B10R0.3 CC(C)COCC(=O)CCO 1458a_100011223364_100000211926 [0,0,1,0,0,0|2,0,1]=4 219 B10R0.3 CC(C)COCC(C)CCN 34a_106354213184_100000210624 [0,0,1,0,0,0|2,0,0]=3 220 B10R0.3 CC(C)OCCC(=O)CCO 1458a_100011216618_100000211751 [0,0,1,0,0,0|2,0,1]=4 221 B10R0.3 CC(C)OCCN(C)CCO 2230a_100000210263_100000211751 [0,0,1,0,0,0|2,0,0]=3 222 B10R0.3 CC(C)OCCN(C)CCO 269982a_100000210263_100000211751 [0,0,1,0,0,0|2,0,0]=3 223 B10R0.3 CC(C)OCN[C@H](C)CCO 2230a_100000706166_100000709892 [0,0,1,0,0,0|2,0,0]=3 224 B10R0.3 CC(C)OCN[C@H](C)CCO 34a_100000706166_100000709892 [0,0,1,0,0,0|2,0,0]=3 225 B10R0.3 CC(C)OCOC(C)CCBr 34a_100012276601_100000709892 [0,0,1,0,0,0|3,0,0]=4 226 B10R0.3 CC(C)OCSC(C)CCO 62a_100000709892_100009893172 [0,0,1,0,0,0|2,0,0]=3 227 B10R0.3 CC(C)OCSC(C)CCO 62a_100009893172_100000709892 [0,0,1,0,0,0|2,0,0]=3 228 B10R0.3 CC(C)SCCC(=O)CCO 1458a_100011216618_100000730970 [0,0,1,0,0,0|2,0,1]=4 229 B10R0.3 CC(C)SCCN(C)CCO 2230a_100000210263_100000730970 [0,0,1,0,0,0|2,0,0]=3 230 B10R0.3 CC(C)SCCN(C)CCO 269982a_100000210263_100000730970 [0,0,1,0,0,0|2,0,0]=3 231 B10R0.3 CC(CCN)COC[C@@H](C)O 34a_106354213184_100009817552 [0,0,1,0,0,0|3,0,0]=4 232 B10R0.3 CC(CCO)OCCC(F)F 34a_100103093639_100009893172 [0,0,1,0,0,0|3,0,0]=4 233 B10R0.3 CC(CCO)OCC[C@@H](C)N 34a_100000706166_100009893172 [0,0,1,0,0,0|2,0,0]=3 234 B10R0.3 CC(CCO)SCCN(C)C 62a_100009893172_100000755713 [0,0,1,0,0,0|2,0,0]=3 235 B10R0.3 CC(O)CCCC(=O)CCO 1458a_100011216618_200000718107 [0,0,1,0,0,0|2,0,1]=4 236 B10R0.3 CC(O)CCCN(C)CCO 2230a_100000210263_200000718107 [0,0,1,0,0,0|2,0,0]=3 237 B10R0.3 CC(O)CCCN(C)CCO 269982a_100000210263_200000718107 [0,0,1,0,0,0|2,0,0]=3 238 B10R0.3 CC(O)CCNC(C)CCO 2230a_200000755665_100009893172 [0,0,1,0,0,0|2,0,0]=3 239 B10R0.3 CC(O)CCN[C@H](C)CCO 2230a_100000706166_100012276601 [0,0,1,0,0,0|2,0,0]=3 240 B10R0.3 CC(O)CCN[C@H](C)CCO 34a_100000706166_100012276601 [0,0,1,0,0,0|2,0,0]=3 241 B10R0.3 CC(O)CCOC(C)CCBr 34a_100012276601_100012276601 [0,0,1,0,0,0|3,0,0]=4 242 B10R0.3 CC(O)CCSC(C)CCO 62a_100009893172_100012276601 [0,0,1,0,0,0|2,0,0]=3 243 B10R0.3 CC(O)CCSC(C)CCO 62a_100012276601_100009893172 [0,0,1,0,0,0|2,0,0]=3 244 B10R0.3 CC(O)COCC(C)CCN 34a_106354213184_100011218427 [0,0,1,0,0,0|3,0,0]=4 245 B10R0.3 CCCC(=O)CCCC(C)C 1458a_100000211992_100011214892 [0,0,1,0,0,0|2,0,1]=4 246 B10R0.3 CCCC(=O)CCCC(C)C 1458a_100011216857_100000210303 [0,0,1,0,0,0|2,0,1]=4 247 B10R0.3 CCCC(C)CCOC(C)C 34a_100011217855_100000210206 [0,0,1,0,0,0|2,0,0]=3 248 B10R0.3 CCCC(C)CCOC(C)C 7a_100011217855_100000210206 [0,0,1,0,0,0|2,0,0]=3 249 B10R0.3 CCCC(C)CNCC(C)C 2230a_100000210953_100011216630 [0,0,1,0,0,0|2,0,0]=3 250 B10R0.3 CCCC(C)CNCC(C)C 270004a_100000210953_100000243154 [0,0,1,0,0,0|2,0,0]=3 251 B10R0.3 CCCC(C)CNCC(C)C 34a_100000210953_100011216630 [0,0,1,0,0,0|2,0,0]=3 252 B10R0.3 CCCC(C)CNCC(C)O 2230a_100000210904_100011216630 [0,0,1,0,0,0|3,0,0]=4 253 B10R0.3 CCCC(C)CNCC(C)O 270004a_100000210904_100000243154 [0,0,1,0,0,0|3,0,0]=4 254 B10R0.3 CCCC(C)CNCC(C)O 34a_100000210904_100011216630 [0,0,1,0,0,0|3,0,0]=4 255 B10R0.3 CCCC(C)COCC(C)Br 34a_100012180447_100011216630 [0,0,1,0,0,0|3,0,0]=4 256 B10R0.3 CCCC(C)COCC(C)C 34a_100000210257_100011216630 [0,0,1,0,0,0|2,0,0]=3 257 B10R0.3 CCCC(C)COCC(C)C 34a_100000688023_100000210624 [0,0,1,0,0,0|2,0,0]=3 258 B10R0.3 CCCC(C)COCC(C)C 7a_100000688023_100000210760 [0,0,1,0,0,0|2,0,0]=3 259 B10R0.3 CCCC(C)COCC(C)F 34a_100015925927_100011216630 [0,0,1,0,0,0|3,0,0]=4 260 B10R0.3 CCCC(C)COCC(C)O 34a_100000688023_100011218427 [0,0,1,0,0,0|3,0,0]=4 261 B10R0.3 CCCC(C)COCC(C)O 7a_100000688023_100011218427 [0,0,1,0,0,0|3,0,0]=4 262 B10R0.3 CCCC(C)COC[C@@H](C)Cl 34a_100016084084_100011216630 [0,0,1,0,0,0|3,0,0]=4 263 B10R0.3 CCCC(C)COC[C@@H](C)N 34a_100000737577_100011216630 [0,0,1,0,0,0|3,0,0]=4 264 B10R0.3 CCCC(C)COC[C@@H](C)O 34a_100000688023_100009817552 [0,0,1,0,0,0|3,0,0]=4 265 B10R0.3 CCCC(C)COC[C@@H](C)O 7a_100000688023_100009817552 [0,0,1,0,0,0|3,0,0]=4 266 B10R0.3 CCCC(C)CSCC(C)C 62a_100000210624_100011216630 [0,0,1,0,0,0|2,0,0]=3 267 B10R0.3 CCCC(C)CSCC(C)C 62a_100011216630_100000210760 [0,0,1,0,0,0|2,0,0]=3 268 B10R0.3 CCCC(C)CSCC(C)O 62a_100011216630_100011218427 [0,0,1,0,0,0|3,0,0]=4 269 B10R0.3 CCCC(C)CSCC(C)O 62a_100011218427_100011216630 [0,0,1,0,0,0|3,0,0]=4 270 B10R0.3 CCCC(C)CSC[C@@H](C)O 62a_100009817552_100011216630 [0,0,1,0,0,0|3,0,0]=4 271 B10R0.3 CCCC(C)CSC[C@@H](C)O 62a_100011216630_100009817552 [0,0,1,0,0,0|3,0,0]=4 272 B10R0.3 CCCC(C)NCCC(C)C 2230a_100000741246_100000210312 [0,0,1,0,0,0|2,0,0]=3 273 B10R0.3 CCCC(C)NCCC(C)C 269862a_100000741246_100000185833 [0,0,1,0,0,0|2,0,0]=3 274 B10R0.3 CCCC(C)NCCC(C)C 270004a_100000210545_100000211909 [0,0,1,0,0,0|2,0,0]=3 275 B10R0.3 CCCC(C)NCCC(C)O 2230a_100000741246_100012276601 [0,0,1,0,0,0|3,0,0]=4 276 B10R0.3 CCCC(C)NCCC(C)O 2230a_200000755665_100000766640 [0,0,1,0,0,0|3,0,0]=4 277 B10R0.3 CCCC(C)NCCC(C)O 270004a_200000755665_100000211909 [0,0,1,0,0,0|3,0,0]=4 278 B10R0.3 CCCC(C)NCCN(C)C 270004a_100000210585_100000211909 [0,0,1,0,0,0|3,0,0]=4 279 B10R0.3 CCCC(C)NCOC(C)C 2230a_100000741246_100000709892 [0,0,1,0,0,0|3,0,0]=4 280 B10R0.3 CCCC(C)OCCC(C)Br 34a_100009893172_100000766640 [0,0,1,0,0,0|3,0,0]=4 281 B10R0.3 CCCC(C)OCCC(C)C 34a_100000210254_100000766640 [0,0,1,0,0,0|2,0,0]=3 282 B10R0.3 CCCC(C)OCCC(C)C 34a_100000764384_100000210312 [0,0,1,0,0,0|2,0,0]=3 283 B10R0.3 CCCC(C)OCCC(C)C 7a_100000210254_100000766640 [0,0,1,0,0,0|2,0,0]=3 284 B10R0.3 CCCC(C)OCCC(C)C 7a_100000764384_100000210626 [0,0,1,0,0,0|2,0,0]=3 285 B10R0.3 CCCC(C)OCCC(C)O 34a_100000764384_100012276601 [0,0,1,0,0,0|3,0,0]=4 286 B10R0.3 CCCC(C)OCCC(C)O 7a_100000764384_100012276601 [0,0,1,0,0,0|3,0,0]=4 287 B10R0.3 CCCC(C)OCCN(C)C 7a_100000764384_100000755713 [0,0,1,0,0,0|3,0,0]=4 288 B10R0.3 CCCC(C)OCC[C@@H](C)N 34a_100000706166_100000766640 [0,0,1,0,0,0|3,0,0]=4 289 B10R0.3 CCCC(C)OCOC(C)C 34a_100000764384_100000709892 [0,0,1,0,0,0|3,0,0]=4 290 B10R0.3 CCCC(C)SCCC(C)C 62a_100000210312_100000766640 [0,0,1,0,0,0|2,0,0]=3 291 B10R0.3 CCCC(C)SCCC(C)C 62a_100000766640_100000210312 [0,0,1,0,0,0|2,0,0]=3 292 B10R0.3 CCCC(C)SCCC(C)O 62a_100000766640_100012276601 [0,0,1,0,0,0|3,0,0]=4 293 B10R0.3 CCCC(C)SCCC(C)O 62a_100012276601_100000766640 [0,0,1,0,0,0|3,0,0]=4 294 B10R0.3 CCCC(C)SCCN(C)C 62a_100000766640_100000755713 [0,0,1,0,0,0|3,0,0]=4 295 B10R0.3 CCCC(C)SCOC(C)C 62a_100000709892_100000766640 [0,0,1,0,0,0|3,0,0]=4 296 B10R0.3 CCCC(C)SCOC(C)C 62a_100000766640_100000709892 [0,0,1,0,0,0|3,0,0]=4 297 B10R0.3 CCCN(C)CCCC(C)C 2230a_100000747261_100011214892 [0,0,1,0,0,0|2,0,0]=3 298 B10R0.3 CCCN(C)CCCC(C)C 269982a_100000747261_100011214892 [0,0,1,0,0,0|2,0,0]=3 299 B10R0.3 CCCN(C)CCCC(C)O 2230a_100000747261_200000718107 [0,0,1,0,0,0|3,0,0]=4 300 B10R0.3 CCCN(C)CCCC(C)O 269982a_100000747261_200000718107 [0,0,1,0,0,0|3,0,0]=4 301 B10R0.3 CCCN(C)CCCN(C)C 269982a_100000225831_100000210303 [0,0,1,0,0,0|3,0,0]=4 302 B10R0.3 CCCN(C)CCCN(C)C 269982a_100000717312_200000210301 [0,0,1,0,0,0|3,0,0]=4 303 B10R0.3 CCCN(C)CCCN(C)C 269982a_100000747261_100000757444 [0,0,1,0,0,0|3,0,0]=4 304 B10R0.3 CCCN(C)CCOC(C)C 2230a_100000747261_100000211751 [0,0,1,0,0,0|3,0,0]=4 305 B10R0.3 CCCN(C)CCOC(C)C 269982a_100000747261_100000211751 [0,0,1,0,0,0|3,0,0]=4 306 B10R0.3 CCCN(C)CCSC(C)C 2230a_100000747261_100000730970 [0,0,1,0,0,0|3,0,0]=4 307 B10R0.3 CCCN(C)CCSC(C)C 269982a_100000747261_100000730970 [0,0,1,0,0,0|3,0,0]=4 308 B10R0.3 CCCN([13CH3])CCCN(C)C 269982a_100000717312_200025704644 [0,0,1,0,0,0|3,0,0]=4 309 B10R0.3 CCC[C@H](N)CCOC(C)C 34a_100015193777_100000210206 [0,0,1,0,0,0|3,0,0]=4 310 B10R0.3 CCC[C@H](N)COCC(C)C 34a_100000732646_100000210624 [0,0,1,0,0,0|3,0,0]=4 311 B10R0.3 CCNC(C)CCCC(C)C 2230a_100000210607_100000210202 [0,0,1,0,0,0|2,0,0]=3 312 B10R0.3 CCNC(C)CCCC(C)C 270004a_100015525214_100000753411 [0,0,1,0,0,0|2,0,0]=3 313 B10R0.3 CCNC(C)CCOC(C)C 270004a_100015525214_200011219172 [0,0,1,0,0,0|3,0,0]=4 314 B10R0.3 CCOC(C)CCCC(C)C 34a_200011218570_100000210202 [0,0,1,0,0,0|2,0,0]=3 315 B10R0.3 CCOC(C)CCCC(C)C 7a_200011218570_100000210202 [0,0,1,0,0,0|2,0,0]=3 316 B10R0.3 CN(C)CCCC(=O)CCO 1458a_100011216618_100000695564 [0,0,1,0,0,0|2,0,1]=4 317 B10R0.3 CN(C)CCCN(C)CCF 269982a_100000225831_100011217306 [0,0,1,0,0,0|3,0,0]=4 318 B10R0.3 CN(C)CCCN(C)CCO 269982a_100000210263_100000757444 [0,0,1,0,0,0|2,0,0]=3 319 B10R0.3 CN(C)CCCN(C)CCO 269982a_100000225831_100000211926 [0,0,1,0,0,0|2,0,0]=3 320 B10R0.3 COCC(C)NCCC(C)C 270004a_100000210545_100000749346 [0,0,1,0,0,0|3,0,0]=4 321 B10R0.3 COCC(C)OCCC(C)C 34a_100000210254_100000765312 [0,0,1,0,0,0|3,0,0]=4 322 B10R0.3 COCC(C)OCCC(C)C 7a_100000210254_100000765312 [0,0,1,0,0,0|3,0,0]=4 323 B10R0.3 COCC(C)SCCC(C)C 62a_100000210312_100000765312 [0,0,1,0,0,0|3,0,0]=4 324 B10R0.3 COCC(C)SCCC(C)C 62a_100000765312_100000210312 [0,0,1,0,0,0|3,0,0]=4 325 B10R0.3 COC[C@@H](C)NCCC(C)C 2230a_100000764878_100000210312 [0,0,1,0,0,0|3,0,0]=4 326 B10R0.3 COC[C@@H](C)NCCC(C)C 269862a_100000764878_100000185833 [0,0,1,0,0,0|3,0,0]=4 327 B10R0.3 COC[C@@H](C)OCCC(C)C 34a_100011934205_100000210312 [0,0,1,0,0,0|3,0,0]=4 328 B10R0.3 CSCC(C)NCCC(C)C 270004a_100000210545_100011216314 [0,0,1,0,0,0|3,0,0]=4 329 B10R0.13 CC(C)C(C)N(C)C[C@@H](C)O 2230a_100000228512_100009817552 [0,0,1,0,0,0|3,0,0]=4 330 B10R0.13 CC(C)C(C)N(C)C[C@@H](C)O 269982a_100000228512_100009817552 [0,0,1,0,0,0|3,0,0]=4 331 B10R0.13 CC(C)CC(=O)C(C)C(C)C 1458a_100000755409_100000210624 [0,0,1,0,0,0|0,0,2]=3 332 B10R0.13 CC(C)CC(=O)N(C)C(C)C 11a_200000211004_100000210554 [0,0,1,0,0,0|1,0,2]=4 333 B10R0.13 CC(C)CC(=O)N(C)C(C)C 1626a_200000211004_100000210554 [0,0,1,0,0,0|1,0,2]=4 334 B10R0.13 CC(C)CC(=O)N(C)C(C)C 240690a_200000211004_100000210554 [0,0,1,0,0,0|1,0,2]=4 335 B10R0.13 CC(C)CC(=O)N(C)C(C)C 527a_200000211004_100000210554 [0,0,1,0,0,0|1,0,2]=4 336 B10R0.13 CC(C)CC(=O)[C@H](C)N(C)C 1458a_100009822176_100000210624 [0,0,1,0,0,0|1,0,2]=4 337 B10R0.13 CC(C)CC(=O)[C@H](O)C(C)C 1458a_100000691806_100000210624 [0,0,1,0,0,0|1,0,2]=4 338 B10R0.13 CC(C)CC(C)C(=O)C(C)C 1458a_100000210198_100000731052 [0,0,1,0,0,0|2,0,1]=4 339 B10R0.13 CC(C)CC(C)N(C)C(C)C 2230a_100000745462_100000210206 [0,0,1,0,0,0|2,0,0]=3 340 B10R0.13 CC(C)CC(C)N(C)C(C)C 269982a_100000745462_100000210206 [0,0,1,0,0,0|2,0,0]=3 341 B10R0.13 CC(C)CC(C)N(C)C(C)C 269982a_200000211004_100000731052 [0,0,1,0,0,0|2,0,0]=3 342 B10R0.13 CC(C)CN(C)C(C)C(C)C 2230a_100000228512_100000210760 [0,0,1,0,0,0|2,0,0]=3 343 B10R0.13 CC(C)CN(C)C(C)C(C)C 269982a_100000228512_100000210624 [0,0,1,0,0,0|2,0,0]=3 344 B10R0.13 CC(C)CN(C)C(C)C(C)C 270004a_100000228512_100000210432 [0,0,1,0,0,0|2,0,0]=3 345 B10R0.13 CC(C)C[C@H](O)C(=O)C(C)C 1458a_100012027011_100000210206 [0,0,1,0,0,0|1,0,1]=3 346 B10R0.13 CC(C)C[C@H](O)C(=O)N(C)C 1626a_100102631434_100012027011 [0,0,1,0,0,0|2,0,1]=4 347 B10R0.13 CC(C)C[C@H](O)C(=O)N(C)C 240690a_100102631434_100012027011 [0,0,1,0,0,0|2,0,1]=4 348 B10R0.13 CC(C)N(C)C(C)CN(C)C 269982a_200000211004_100020606517 [0,0,1,0,0,0|3,0,0]=4 349 B10R0.13 CC(C)NC(=O)C(C)C(C)C 11a_100138425928_100000755409 [0,0,1,0,0,0|1,0,2]=4 350 B10R0.13 CC(C)NC(=O)C(C)C(C)C 1626a_100138425928_100000755409 [0,0,1,0,0,0|1,0,2]=4 351 B10R0.13 CC(C)NC(=O)C(C)C(C)C 240690a_100138425928_100000755409 [0,0,1,0,0,0|1,0,2]=4 352 B10R0.13 CC(C)NC(=O)C(C)C(C)C 527a_100138425928_100000755409 [0,0,1,0,0,0|1,0,2]=4 353 B10R0.13 CC(O)CC(=O)C(C)C(C)C 1458a_100000755409_100011218427 [0,0,1,0,0,0|1,0,2]=4 354 B10R0.13 CC(O)CN(C)C(C)C(C)C 2230a_100000228512_100011218427 [0,0,1,0,0,0|3,0,0]=4 355 B10R0.13 CC(O)CN(C)C(C)C(C)C 269982a_100000228512_100011218427 [0,0,1,0,0,0|3,0,0]=4 356 B10R0.17 CC(C)C(NCCF)C(C)C 2230a_100000690608_100011217306 [0,0,1,0,0,0|3,0,0]=4 357 B10R0.17 CC(C)C(NCCF)C(C)C 34a_100000690608_100011217306 [0,0,1,0,0,0|3,0,0]=4 358 B10R0.17 CC(C)C(NCCO)C(C)C 2230a_100000690608_100000211926 [0,0,1,0,0,0|3,0,0]=4 359 B10R0.17 CC(C)C(NCCO)C(C)C 34a_100000690608_100000211926 [0,0,1,0,0,0|3,0,0]=4 360 B10R0.17 CC(C)C(OCCF)C(C)C 34a_100011216681_100011217306 [0,0,1,0,0,0|3,0,0]=4 361 B10R0.17 CC(C)C(OCCF)C(C)C 7a_100011216681_100011217306 [0,0,1,0,0,0|3,0,0]=4 362 B10R0.17 CC(C)C(OCCO)C(C)C 34a_100011216681_100000211926 [0,0,1,0,0,0|3,0,0]=4 363 B10R0.17 CC(C)C(OCCO)C(C)C 7a_100011216681_100000211926 [0,0,1,0,0,0|3,0,0]=4 364 B10R0.17 CC(C)N(CCCF)C(C)C 2230a_100000086832_100011934791 [0,0,1,0,0,0|3,0,0]=4 365 B10R0.17 CC(C)N(CCCF)C(C)C 269982a_100000086832_100011934791 [0,0,1,0,0,0|3,0,0]=4 366 B10R0.17 CC(C)N(CCCF)C(C)C 34a_100000086832_100011934791 [0,0,1,0,0,0|3,0,0]=4 367 B10R0.17 CC(C)N(CCCO)C(C)C 2230a_100000086832_100000230001 [0,0,1,0,0,0|3,0,0]=4 368 B10R0.17 CC(C)N(CCCO)C(C)C 2230a_100000182298_100000210206 [0,0,1,0,0,0|3,0,0]=4 369 B10R0.17 CC(C)N(CCCO)C(C)C 269982a_100000086832_100011215043 [0,0,1,0,0,0|3,0,0]=4 370 B10R0.17 CC(C)N(CCCO)C(C)C 269982a_100000182298_100000210206 [0,0,1,0,0,0|3,0,0]=4 371 B10R0.17 CC(C)N(CCCO)C(C)C 34a_100000086832_100000230001 [0,0,1,0,0,0|3,0,0]=4 372 B10R0.17 CC(C)P(CCN[13CH3])C(C)C 2230a_107094795181_200025704644 [0,0,1,0,0,0|3,0,0]=4 373 B10R0.17 CC(C)P(CCN[13CH3])C(C)C 34a_107094795181_200025704644 [0,0,1,0,0,0|3,0,0]=4 374 B10R0.17 CCCCC(C(C)C)N(C)C 270004a_100102631434_200011215219 [0,0,1,0,0,0|2,0,0]=3 375 B10R0.17 CCCCN(C(=O)C)C(C)C 11a_100000207398_100015343762 [0,0,1,0,0,0|1,0,2]=4 376 B10R0.17 CCCCN(C(=O)C)C(C)C 1626a_100000207398_100015343762 [0,0,1,0,0,0|1,0,2]=4 377 B10R0.17 CCCCN(C(=O)C)C(C)C 240690a_100000207398_100015343762 [0,0,1,0,0,0|1,0,2]=4 378 B10R0.17 CCCCN(C(=O)C)C(C)C 527a_100000207398_100103153847 [0,0,1,0,0,0|1,0,2]=4 379 B10R0.17 CCCCN(C(C)C)C(C)C 2230a_100000086832_100000210211 [0,0,1,0,0,0|2,0,0]=3 380 B10R0.17 CCCCN(C(C)C)C(C)C 2230a_100000207398_100000210206 [0,0,1,0,0,0|2,0,0]=3 381 B10R0.17 CCCCN(C(C)C)C(C)C 269982a_100000086832_100000210211 [0,0,1,0,0,0|2,0,0]=3 382 B10R0.17 CCCCN(C(C)C)C(C)C 269982a_100000207398_100000210206 [0,0,1,0,0,0|2,0,0]=3 383 B10R0.17 CCCCN(C(C)C)C(C)C 34a_100000086832_100000210210 [0,0,1,0,0,0|2,0,0]=3 384 B10R0.17 CCCNC(C(C)C)C(C)C 2230a_100000690608_100000210303 [0,0,1,0,0,0|2,0,0]=3 385 B10R0.17 CCCNC(C(C)C)C(C)C 34a_100000690608_100000210303 [0,0,1,0,0,0|2,0,0]=3 386 B10R0.17 CCCN[C@@H](C(=O)O)C(C)C 269956a_100000745019_100000210207 [0,0,1,0,0,0|2,0,1]=4 387 B10R0.17 CCCOC(C(C)C)C(C)C 34a_100011216681_100000210303 [0,0,1,0,0,0|2,0,0]=3 388 B10R0.17 CCCOC(C(C)C)C(C)C 7a_100011216681_100000210303 [0,0,1,0,0,0|2,0,0]=3 389 B10R0.17 CCOCN(C(C)C)C(C)C 269982a_100000086832_100000739092 [0,0,1,0,0,0|3,0,0]=4 390 B10R0.17 CNCCP(C(C)C)C(C)C 2230a_107094795181_200000210301 [0,0,1,0,0,0|3,0,0]=4 391 B10R0.17 CNCCP(C(C)C)C(C)C 34a_107094795181_200000210301 [0,0,1,0,0,0|3,0,0]=4 392 B10R0.17 COCCN(C(C)C)C(C)C 2230a_100000086832_100011201679 [0,0,1,0,0,0|3,0,0]=4 393 B10R0.17 COCCN(C(C)C)C(C)C 2230a_200000223778_100000210206 [0,0,1,0,0,0|3,0,0]=4 394 B10R0.17 COCCN(C(C)C)C(C)C 269982a_100000086832_100000233755 [0,0,1,0,0,0|3,0,0]=4 395 B10R0.17 COCCN(C(C)C)C(C)C 269982a_200000223778_100000210206 [0,0,1,0,0,0|3,0,0]=4 396 B10R0.17 COCCN(C(C)C)C(C)C 34a_100000086832_100011201679 [0,0,1,0,0,0|3,0,0]=4 397 B10R0.17 COCNC(C(C)C)C(C)C 2230a_100000690608_100000766300 [0,0,1,0,0,0|3,0,0]=4 398 B10R0.17 CSCCN(C(C)C)C(C)C 2230a_100000086832_100000751147 [0,0,1,0,0,0|3,0,0]=4 399 B10R0.17 CSCCN(C(C)C)C(C)C 269982a_100000086832_100000212216 [0,0,1,0,0,0|3,0,0]=4 400 B10R0.17 CSCCN(C(C)C)C(C)C 34a_100000086832_100000212216 [0,0,1,0,0,0|3,0,0]=4 401 B10R0.17 CSCNC(C(C)C)C(C)C 2230a_100000690608_100011218213 [0,0,1,0,0,0|3,0,0]=4 402 B10R0.17 CSCNC(C(C)C)C(C)C 34a_100000690608_100011218213 [0,0,1,0,0,0|3,0,0]=4 403 B10R0.17 CSCOC(C(C)C)C(C)C 34a_100011216681_100011218213 [0,0,1,0,0,0|3,0,0]=4 404 B10R0.44 CC(C)CC(=O)C[C@@H](C)CO 1458a_100000210554_100000059175 [0,0,1,0,0,0|1,0,2]=4 405 B10R0.44 CC(C)CC(C)NC(C)CO 2230a_100000692259_100012180447 [0,0,1,0,0,0|3,0,0]=4 406 B10R0.44 CC(C)CC(C)N[C@H](C)CO 2230a_100000737577_100000731052 [0,0,1,0,0,0|3,0,0]=4 407 B10R0.44 CC(C)CC(C)OC(C)CF 34a_100016041109_100000731052 [0,0,1,0,0,0|3,0,0]=4 408 B10R0.44 CC(C)CC(C)OC(C)CF 7a_100016041109_100000731052 [0,0,1,0,0,0|3,0,0]=4 409 B10R0.44 CC(C)CC(C)OC(C)CN 34a_100000210904_100000731052 [0,0,1,0,0,0|3,0,0]=4 410 B10R0.44 CC(C)CC(C)OC(C)CO 34a_100000211805_100012180447 [0,0,1,0,0,0|3,0,0]=4 411 B10R0.44 CC(C)CC(C)OC(C)CO 7a_100000211805_100012180447 [0,0,1,0,0,0|3,0,0]=4 412 B10R0.44 CC(C)CC(C)SC(C)CO 62a_100012180447_100000731052 [0,0,1,0,0,0|3,0,0]=4 413 B10R0.44 CC(C)CC(C)S[C@H](C)CO 62a_100000731052_100016084084 [0,0,1,0,0,0|3,0,0]=4 414 B10R0.44 CC(C)CC(C)S[C@H](C)CO 62a_100016084084_100000731052 [0,0,1,0,0,0|3,0,0]=4 415 B10R0.44 CC(C)CN(C)C[C@@H](C)CO 2230a_100000747067_100000059175 [0,0,1,0,0,0|3,0,0]=4 416 B10R0.44 CC(C)CN(C)C[C@@H](C)CO 269982a_100000747067_100000059175 [0,0,1,0,0,0|3,0,0]=4 417 B10R0.44 CCC(C)CC(=O)CC(C)C 1458a_100000210554_100000748023 [0,0,1,0,0,0|0,0,2]=3 418 B10R0.44 CCC(C)CC(=O)CC(C)C 1458a_100000708755_100000210624 [0,0,1,0,0,0|0,0,2]=3 419 B10R0.44 CCC(C)CC(=O)CC(C)O 1458a_100000708755_100011218427 [0,0,1,0,0,0|1,0,2]=4 420 B10R0.44 CCC(C)CC(=O)CN(C)C 1458a_100000750896_100000748023 [0,0,1,0,0,0|1,0,2]=4 421 B10R0.44 CCC(C)CC(=O)C[C@@H](C)O 1458a_100011933948_100000748023 [0,0,1,0,0,0|1,0,2]=4 422 B10R0.44 CCC(C)CC(=O)C[S+](C)C 1458a_200159257847_100000748023 [0,0,1,0,0,0|1,0,2]=4 423 B10R0.44 CCC(C)CC(=O)NC(C)C 11a_100138425928_100000708755 [0,0,1,0,0,0|1,0,2]=4 424 B10R0.44 CCC(C)CC(=O)NC(C)C 1626a_100138425928_100000708755 [0,0,1,0,0,0|1,0,2]=4 425 B10R0.44 CCC(C)CC(=O)NC(C)C 240690a_100138425928_100000708755 [0,0,1,0,0,0|1,0,2]=4 426 B10R0.44 CCC(C)CC(=O)NC(C)C 527a_100138425928_100000708755 [0,0,1,0,0,0|1,0,2]=4 427 B10R0.44 CCC(C)CC(C)NC(C)C 2230a_100000763565_100000210206 [0,0,1,0,0,0|2,0,0]=3 428 B10R0.44 CCC(C)CN(C)CC(C)C 2230a_100000747067_100000748023 [0,0,1,0,0,0|2,0,0]=3 429 B10R0.44 CCC(C)CN(C)CC(C)C 2230a_100000753921_100000210760 [0,0,1,0,0,0|2,0,0]=3 430 B10R0.44 CCC(C)CN(C)CC(C)C 269982a_100000747067_100000748023 [0,0,1,0,0,0|2,0,0]=3 431 B10R0.44 CCC(C)CN(C)CC(C)C 269982a_100000753921_100000210624 [0,0,1,0,0,0|2,0,0]=3 432 B10R0.44 CCC(C)CN(C)CC(C)C 270004a_100000747067_100000243153 [0,0,1,0,0,0|2,0,0]=3 433 B10R0.44 CCC(C)CN(C)CC(C)C 270004a_100000753921_100000210432 [0,0,1,0,0,0|2,0,0]=3 434 B10R0.44 CCC(C)CN(C)CC(C)O 2230a_100000227577_100000748023 [0,0,1,0,0,0|3,0,0]=4 435 B10R0.44 CCC(C)CN(C)CC(C)O 2230a_100000753921_100011218427 [0,0,1,0,0,0|3,0,0]=4 436 B10R0.44 CCC(C)CN(C)CC(C)O 269982a_100000227577_100000748023 [0,0,1,0,0,0|3,0,0]=4 437 B10R0.44 CCC(C)CN(C)CC(C)O 269982a_100000753921_100011218427 [0,0,1,0,0,0|3,0,0]=4 438 B10R0.44 CCC(C)CN(C)CC(C)O 270004a_100000227577_100000243153 [0,0,1,0,0,0|3,0,0]=4 439 B10R0.44 CCC(C)CN(C)C[C@@H](C)O 2230a_100000753921_100009817552 [0,0,1,0,0,0|3,0,0]=4 440 B10R0.44 CCC(C)CN(C)C[C@@H](C)O 269982a_100000753921_100009817552 [0,0,1,0,0,0|3,0,0]=4 441 B10R0.44 CCC(C)NC(=O)CC(C)C 11a_100000209981_100000210554 [0,0,1,0,0,0|1,0,2]=4 442 B10R0.44 CCC(C)NC(=O)CC(C)C 1626a_100000209981_100000210554 [0,0,1,0,0,0|1,0,2]=4 443 B10R0.44 CCC(C)NC(=O)CC(C)C 240690a_100000209981_100000210554 [0,0,1,0,0,0|1,0,2]=4 444 B10R0.44 CCC(C)NC(=O)CC(C)C 527a_100000209981_100000210554 [0,0,1,0,0,0|1,0,2]=4 445 B10R0.44 CCC(C)NC(C)CC(C)C 2230a_100000209981_100000731052 [0,0,1,0,0,0|2,0,0]=3 446 B10R0.44 CCC(C)NC(C)CC(C)C 2230a_100000692259_100000758301 [0,0,1,0,0,0|2,0,0]=3 447 B10R0.44 CCC(C)OC(C)CC(C)C 34a_100000211805_100011215416 [0,0,1,0,0,0|2,0,0]=3 448 B10R0.44 CCC(C)OC(C)CC(C)C 7a_100000210228_100000731052 [0,0,1,0,0,0|2,0,0]=3 449 B10R0.44 CCC(C)OC(C)CC(C)C 7a_100000211805_100000758301 [0,0,1,0,0,0|2,0,0]=3 450 B10R0.44 CCC(C)SC(C)CC(C)C 62a_100000731052_100000758301 [0,0,1,0,0,0|2,0,0]=3 451 B10R0.44 CCC(C)SC(C)CC(C)C 62a_100000758301_100000731052 [0,0,1,0,0,0|2,0,0]=3 452 B10R0.44 CCC(C)SC(C)CN(C)C 62a_100000758301_100020606517 [0,0,1,0,0,0|3,0,0]=4 453 B10R0.44 CCC(C)SC(C)CN(C)C 62a_100020606517_100000758301 [0,0,1,0,0,0|3,0,0]=4 454 B10R0.44 CCC(O)CC(=O)CC(C)C 1458a_100000210554_100011218378 [0,0,1,0,0,0|1,0,2]=4 455 B10R0.44 CCC(O)CC(=O)CC(C)C 1458a_100011667805_100000210624 [0,0,1,0,0,0|1,0,2]=4 456 B10R0.44 CCC(O)CN(C)CC(C)C 2230a_100000747067_100011218378 [0,0,1,0,0,0|3,0,0]=4 457 B10R0.44 CCC(O)CN(C)CC(C)C 269982a_100000747067_100011218378 [0,0,1,0,0,0|3,0,0]=4 458 B10R0.44 CCN(C)CC(=O)CC(C)C 1458a_100116209913_100000210624 [0,0,1,0,0,0|1,0,2]=4 459 B10R0.44 CCN(C)CC(C)CN(C)C 2230a_100000225621_100015348159 [0,0,1,0,0,0|3,0,0]=4 460 B10R0.44 CCN(C)CC(C)CN(C)C 269982a_100000225621_100015348159 [0,0,1,0,0,0|3,0,0]=4 461 B10R0.44 CC[C@H](C)CC(=O)CC(C)C 1458a_100000210554_100009816398 [0,0,1,0,0,0|0,0,2]=3 462 B10R0.44 CC[C@H](C)CC(=O)CN(C)C 1458a_100000750896_100009816398 [0,0,1,0,0,0|1,0,2]=4 463 B10R0.44 CC[C@H](C)CC(=O)C[C@@H](C)O 1458a_100011933948_100009816398 [0,0,1,0,0,0|1,0,2]=4 464 B10R0.44 CC[C@H](C)CC(=O)C[S+](C)C 1458a_200159257847_100009816398 [0,0,1,0,0,0|1,0,2]=4 465 B10R0.44 CC[C@H](C)CN(C)CC(C)C 2230a_100000747067_100009816398 [0,0,1,0,0,0|2,0,0]=3 466 B10R0.44 CC[C@H](C)CN(C)CC(C)C 269982a_100000747067_100009816398 [0,0,1,0,0,0|2,0,0]=3 467 B10R0.44 CC[C@H](C)CN(C)CC(C)O 2230a_100000227577_100009816398 [0,0,1,0,0,0|3,0,0]=4 468 B10R0.44 CC[C@H](C)CN(C)CC(C)O 269982a_100000227577_100009816398 [0,0,1,0,0,0|3,0,0]=4 469 B10R0.44 COC(C)SC(C)CC(C)C 62a_100000731052_100009879195 [0,0,1,0,0,0|3,0,0]=4 470 B10R0.44 COC(C)SC(C)CC(C)C 62a_100009879195_100000731052 [0,0,1,0,0,0|3,0,0]=4 471 B10R0.84 C#CC(OCC(C)C)C(C)C 34a_100011217124_100000210624 [0,0,1,0,0,0|2,0,1]=4 472 B10R0.84 C#CC(OCC(C)C)C(C)C 7a_100011217124_100000210760 [0,0,1,0,0,0|2,0,1]=4 473 B10R0.84 C=C(C)CN[C@@H](CO)C(C)C 2230a_100011830312_100000748629 [0,0,1,0,0,0|1,0,2]=4 474 B10R0.84 C=C(C)CN[C@@H](CO)C(C)C 34a_100011830312_100000748629 [0,0,1,0,0,0|1,0,2]=4 475 B10R0.84 C=CC(OCC(C)C)C(C)C 34a_100000732651_100000210624 [0,0,1,0,0,0|2,0,1]=4 476 B10R0.84 C=CC(OCC(C)C)C(C)C 7a_100000732651_100000210760 [0,0,1,0,0,0|2,0,1]=4 477 B10R0.84 CC(=O)NCC(CO)C(C)C 240690a_100000692819_100015343762 [0,0,1,0,0,0|2,0,1]=4 478 B10R0.84 CC(=O)NCC(CO)C(C)C 527a_100000692819_100103153847 [0,0,1,0,0,0|2,0,1]=4 479 B10R0.84 CC(C)C(CN)OC[C@@H](C)O 34a_100000759067_100009817552 [0,0,1,0,0,0|3,0,0]=4 480 B10R0.84 CC(C)CN[C@@H](CO)C(C)C 2230a_100011830312_100000210760 [0,0,1,0,0,0|1,0,0]=2 481 B10R0.84 CC(C)CN[C@@H](CO)C(C)C 270004a_100011830312_100000210432 [0,0,1,0,0,0|1,0,0]=2 482 B10R0.84 CC(C)CN[C@@H](CO)C(C)C 34a_100011830312_100000210624 [0,0,1,0,0,0|1,0,0]=2 483 B10R0.84 CC(C)CN[C@H](CO)[C@@H](C)O 2230a_100015196842_100000210760 [0,0,1,0,0,0|2,0,0]=3 484 B10R0.84 CC(C)CN[C@H](CO)[C@@H](C)O 34a_100015196842_100000210624 [0,0,1,0,0,0|2,0,0]=3 485 B10R0.84 CC(C)COC(C#N)C(C)C 34a_100000748901_100000210624 [0,0,1,0,0,0|2,0,1]=4 486 B10R0.84 CC(C)COC(C#N)C(C)C 7a_100000748901_100000210760 [0,0,1,0,0,0|2,0,1]=4 487 B10R0.84 CC(C)COC(CN)C(C)C 34a_100000759067_100000210624 [0,0,1,0,0,0|2,0,0]=3 488 B10R0.84 CC(C)NCC(CO)C(C)C 34a_100000692819_100000210206 [0,0,1,0,0,0|1,0,0]=2 489 B10R0.84 CC(C)OCC(CN)C(C)C 34a_100000692819_100000210206 [0,0,1,0,0,0|2,0,0]=3 490 B10R0.84 CC(C)[C@H](CO)NCC(F)F 2230a_100011830312_100011934356 [0,0,1,0,0,0|3,0,0]=4 491 B10R0.84 CC(C)[C@H](CO)NCC(F)F 34a_100011830312_100011934356 [0,0,1,0,0,0|3,0,0]=4 492 B10R0.84 CC(C)[C@H](CO)NC[C@@H](C)O 2230a_100011830312_100009817552 [0,0,1,0,0,0|2,0,0]=3 493 B10R0.84 CC(C)[C@H](CO)NC[C@@H](C)O 34a_100011830312_100009817552 [0,0,1,0,0,0|2,0,0]=3 494 B10R0.84 CC(O)CN[C@@H](CO)C(C)C 2230a_100011830312_100011218427 [0,0,1,0,0,0|2,0,0]=3 495 B10R0.84 CC(O)CN[C@@H](CO)C(C)C 34a_100011830312_100011218427 [0,0,1,0,0,0|2,0,0]=3 496 B10R0.84 CC(O)CN[C@H](CO)[C@@H](C)O 2230a_100015196842_100011218427 [0,0,1,0,0,0|3,0,0]=4 497 B10R0.84 CC(O)CN[C@H](CO)[C@@H](C)O 34a_100015196842_100011218427 [0,0,1,0,0,0|3,0,0]=4 498 B10R0.84 CC(O)COC(CN)C(C)C 34a_100000759067_100011218427 [0,0,1,0,0,0|3,0,0]=4 499 B10R0.84 CCC(COC(C)C)C(C)C 34a_100011995916_100000210206 [0,0,1,0,0,0|2,0,0]=3 500 B10R0.84 CCC(COC(C)C)C(C)C 7a_100011995916_100000210206 [0,0,1,0,0,0|2,0,0]=3 501 B10R0.84 CCC(NCC(C)C)C(C)C 270004a_100000210953_100000210600 [0,0,1,0,0,0|2,0,0]=3 502 B10R0.84 CCC(NCC(C)C)C(C)C 270004a_100000745074_100000210432 [0,0,1,0,0,0|2,0,0]=3 503 B10R0.84 CCC(NCC(C)O)C(C)C 270004a_100000210904_100000210600 [0,0,1,0,0,0|3,0,0]=4 504 B10R0.84 CCC(OCC(C)C)C(C)C 34a_100011218073_100000210624 [0,0,1,0,0,0|2,0,0]=3 505 B10R0.84 CCC(OCC(C)C)C(C)C 7a_100011218073_100000210760 [0,0,1,0,0,0|2,0,0]=3 506 B10R0.84 CCC(OCC(C)O)C(C)C 34a_100011218073_100011218427 [0,0,1,0,0,0|3,0,0]=4 507 B10R0.84 CCC(OCC(C)O)C(C)C 7a_100011218073_100011218427 [0,0,1,0,0,0|3,0,0]=4 508 B10R0.84 CCC(OC[C@@H](C)O)C(C)C 34a_100011218073_100009817552 [0,0,1,0,0,0|3,0,0]=4 509 B10R0.84 CCC(OC[C@@H](C)O)C(C)C 7a_100011218073_100009817552 [0,0,1,0,0,0|3,0,0]=4 510 B10R0.84 CCN(CCC(C)C)C(C)C 2230a_100000207693_100000210206 [0,0,1,0,0,0|2,0,0]=3 511 B10R0.84 CCN(CCC(C)C)C(C)C 2230a_100000223864_100000210312 [0,0,1,0,0,0|2,0,0]=3 512 B10R0.84 CCN(CCC(C)C)C(C)C 269982a_100000207693_100000210206 [0,0,1,0,0,0|2,0,0]=3 513 B10R0.84 CCN(CCC(C)C)C(C)C 269982a_100000223864_100000210312 [0,0,1,0,0,0|2,0,0]=3 514 B10R0.84 CCN(CCC(C)O)C(C)C 2230a_100000223864_100012276601 [0,0,1,0,0,0|3,0,0]=4 515 B10R0.84 CCN(CCC(C)O)C(C)C 269982a_100000223864_100012276601 [0,0,1,0,0,0|3,0,0]=4 516 B10R0.84 CCN(CCN(C)C)C(C)C 269982a_100000223864_100000755713 [0,0,1,0,0,0|3,0,0]=4 517 B10R0.84 CCN(CCN(C)C)C(C)C 269982a_100000225870_100000210206 [0,0,1,0,0,0|3,0,0]=4 518 B10R0.84 CCN(COC(C)C)C(C)C 2230a_100000223864_100000709892 [0,0,1,0,0,0|3,0,0]=4 519 B10R0.84 CCN(COC(C)C)C(C)C 269982a_100000223864_100000709892 [0,0,1,0,0,0|3,0,0]=4 520 B10R0.84 CC[C@H](NCC(C)C)[C@@H](C)O 2230a_100161114882_100000210760 [0,0,1,0,0,0|3,0,0]=4 521 B10R0.84 CC[C@H](NCC(C)C)[C@@H](C)O 34a_100161114882_100000210624 [0,0,1,0,0,0|3,0,0]=4 522 B10R0.84 C[C@@H](O)CN[C@H](CO)[C@@H](C)O 2230a_100015196842_100009817552 [0,0,1,0,0,0|3,0,0]=4 523 B10R0.84 C[C@@H](O)CN[C@H](CO)[C@@H](C)O 34a_100015196842_100009817552 [0,0,1,0,0,0|3,0,0]=4 524 B10R0.101 CCC(C(C)C)N(C)CCO 270004a_100000210263_100000210600 [0,0,1,0,0,0|3,0,0]=4 525 B10R0.101 CCCC(=O)C(CC)N(C)C 1458a_100000689100_100000210303 [0,0,1,0,0,0|1,0,2]=4 526 B10R0.101 CCCC(=O)N(CC)C(C)C 11a_100000223864_100000211992 [0,0,1,0,0,0|1,0,2]=4 527 B10R0.101 CCCC(=O)N(CC)C(C)C 1626a_100000223864_100000211992 [0,0,1,0,0,0|1,0,2]=4 528 B10R0.101 CCCC(=O)N(CC)C(C)C 240690a_100000223864_100000211992 [0,0,1,0,0,0|1,0,2]=4 529 B10R0.101 CCCC(=O)N(CC)C(C)C 527a_100000223864_100000211992 [0,0,1,0,0,0|1,0,2]=4 530 B10R0.101 CCCC(C)C(OC)C(C)C 34a_200011290769_200000210301 [0,0,1,0,0,0|2,0,0]=3 531 B10R0.101 CCCC(C)C(OC)C(C)C 7a_200011290769_200000210301 [0,0,1,0,0,0|2,0,0]=3 532 B10R0.101 CCCC(C)C(O[13CH3])C(C)C 34a_200011290769_200025704644 [0,0,1,0,0,0|2,0,0]=3 533 B10R0.101 CCCC(C)C(O[13CH3])C(C)C 7a_200011290769_200025704644 [0,0,1,0,0,0|2,0,0]=3 534 B10R0.101 CCCC(C)N(CC)C(C)C 2230a_100000223864_100000766640 [0,0,1,0,0,0|2,0,0]=3 535 B10R0.101 CCCC(C)N(CC)C(C)C 269982a_100000223864_100000766640 [0,0,1,0,0,0|2,0,0]=3 536 B10R0.101 CCCC(C)N(CC)C(C)C 270004a_100000223864_100000211909 [0,0,1,0,0,0|2,0,0]=3 537 B10R0.101 CCCN(C)C(CC)C(C)C 270004a_100000747261_100000210600 [0,0,1,0,0,0|2,0,0]=3 538 B10R0.101 CCN(C(C)C)C(C)CCO 2230a_100000223864_100009893172 [0,0,1,0,0,0|3,0,0]=4 539 B10R0.101 CCN(C(C)C)C(C)CCO 2230a_100011935059_100000210206 [0,0,1,0,0,0|3,0,0]=4 540 B10R0.101 CCN(C(C)C)C(C)CCO 269982a_100000223864_100009893172 [0,0,1,0,0,0|3,0,0]=4 541 B10R0.101 CCN(C(C)C)C(C)CCO 269982a_100011935059_100000210206 [0,0,1,0,0,0|3,0,0]=4 542 B10R0.101 CCN(C(C)C)C(C)COC 2230a_100000223864_100000765312 [0,0,1,0,0,0|3,0,0]=4 543 B10R0.101 CCN(C(C)C)C(C)COC 269982a_100000223864_100000765312 [0,0,1,0,0,0|3,0,0]=4 544 B10R0.101 CCN(C(C)C)C(C)COC 270004a_100000223864_100000749346 [0,0,1,0,0,0|3,0,0]=4 545 B10R0.101 CCN(C(C)C)C(C)CSC 270004a_100000223864_100011216314 [0,0,1,0,0,0|3,0,0]=4 546 B12R2.1017 CC(C)N1C[C@@H]2C[C@H]1CN2C 2230a_100025763010_100000210206 [0,0,0,1,0,0|3,0,0]=4 547 B12R2.1017 CC(C)N1C[C@@H]2C[C@H]1CN2C 269982a_100025763010_100000210206 [0,0,0,1,0,0|3,0,0]=4 548 B12R2.1317 C[C@H]1CN(CCN1C2CC2)C 269982a_100012002466_100000211595 [0,0,0,1,0,0|3,0,0]=4 549 B12R1.233 CC(C)CN1CCN(C[C@@H]1C)C 2230a_100012002466_100000210760 [0,0,0,0,0,1|3,0,0]=4 550 B12R1.233 CC(C)CN1CCN(C[C@@H]1C)C 269982a_100012002466_100000210624 [0,0,0,0,0,1|3,0,0]=4 551 B12R1.233 CC1CCC(C(C1)C)OC(C)C 34a_100011539931_100000210206 [0,0,0,0,0,1|1,0,0]=2 552 B12R1.233 CC1CCC(C(C1)C)OC(C)C 7a_100011539931_100000210206 [0,0,0,0,0,1|1,0,0]=2 553 B12R1.878 CC(C)N1CCCN(CC1C)C 269982a_100011935175_100000210206 [0,0,0,0,0,1|3,0,0]=4 554 B9R0.1 CC(Br)CCOC(C)CO 34a_100009893172_100012180447 [1,0,1,0,0,0|2,0,0]=4 555 B9R0.1 CC(Br)COC[C@@H](C)CO 34a_100012180447_100000059175 [1,0,1,0,0,0|2,0,0]=4 556 B9R0.1 CC(C)CCCC(=O)CO 1458a_100000210174_100011214892 [1,0,1,0,0,0|1,0,1]=4 557 B9R0.1 CC(C)CCCC(C)N[13CH3] 2230a_100000210607_200025704644 [1,0,1,0,0,0|1,0,0]=3 558 B9R0.1 CC(C)CCCC(C)O[13CH3] 34a_200011218570_200025704644 [1,0,1,0,0,0|1,0,0]=3 559 B9R0.1 CC(C)CCCC(C)O[13CH3] 7a_200011218570_200025704644 [1,0,1,0,0,0|1,0,0]=3 560 B9R0.1 CC(C)CCN[C@H](C)CF 269862a_100102880703_100000185833 [1,0,1,0,0,0|2,0,0]=4 561 B9R0.1 CC(C)CCN[C@H](C)CO 2230a_100000737577_100000210312 [1,0,1,0,0,0|1,0,0]=3 562 B9R0.1 CC(C)CCN[C@H](C)CO 269862a_100000737577_100000185833 [1,0,1,0,0,0|1,0,0]=3 563 B9R0.1 CC(C)CCOC(C)CF 34a_100016041109_100000210312 [1,0,1,0,0,0|2,0,0]=4 564 B9R0.1 CC(C)CCOC(C)CF 7a_100016041109_100000210626 [1,0,1,0,0,0|2,0,0]=4 565 B9R0.1 CC(C)CCOC(C)CN 34a_100000210904_100000210312 [1,0,1,0,0,0|2,0,0]=4 566 B9R0.1 CC(C)CCOC(C)CO 34a_100000210254_100012180447 [1,0,1,0,0,0|1,0,0]=3 567 B9R0.1 CC(C)CCOC(C)CO 7a_100000210254_100012180447 [1,0,1,0,0,0|1,0,0]=3 568 B9R0.1 CC(C)CCSC(C)CO 62a_100012180447_100000210312 [1,0,1,0,0,0|1,0,0]=3 569 B9R0.1 CC(C)CCS[C@H](C)CO 62a_100000210312_100016084084 [1,0,1,0,0,0|1,0,0]=3 570 B9R0.1 CC(C)CCS[C@H](C)CO 62a_100016084084_100000210312 [1,0,1,0,0,0|1,0,0]=3 571 B9R0.1 CC(C)CNCC(C)CO 34a_100000744482_100000210624 [1,0,1,0,0,0|1,0,0]=3 572 B9R0.1 CC(C)CNCC(O)CO 2230a_100000210953_100011219619 [1,0,1,0,0,0|2,0,0]=4 573 B9R0.1 CC(C)CNCC(O)CO 34a_100000210953_100011219619 [1,0,1,0,0,0|2,0,0]=4 574 B9R0.1 CC(C)CNC[C@@H](C)CO 2230a_100000210953_100000059175 [1,0,1,0,0,0|1,0,0]=3 575 B9R0.1 CC(C)CNC[C@@H](C)CO 34a_100000210953_100000059175 [1,0,1,0,0,0|1,0,0]=3 576 B9R0.1 CC(C)CNC[C@@H](F)CO 270004a_100015665980_100000210432 [1,0,1,0,0,0|2,0,0]=4 577 B9R0.1 CC(C)CNC[C@@H](F)CO 34a_100015665980_100000210624 [1,0,1,0,0,0|2,0,0]=4 578 B9R0.1 CC(C)CNC[C@@H](O)CO 2230a_100000210953_100009815848 [1,0,1,0,0,0|2,0,0]=4 579 B9R0.1 CC(C)CNC[C@@H](O)CO 34a_100000210953_100009815848 [1,0,1,0,0,0|2,0,0]=4 580 B9R0.1 CC(C)CNC[C@H](O)CO 2230a_100020644852_100000210760 [1,0,1,0,0,0|2,0,0]=4 581 B9R0.1 CC(C)COCC(C)CN 34a_100000744482_100000210624 [1,0,1,0,0,0|2,0,0]=4 582 B9R0.1 CC(C)COCC(O)CO 34a_100000210257_100011219619 [1,0,1,0,0,0|2,0,0]=4 583 B9R0.1 CC(C)COC[C@@H](C)CO 34a_100000210257_100000059175 [1,0,1,0,0,0|1,0,0]=3 584 B9R0.1 CC(C)COC[C@@H](O)CO 34a_100000210257_100009815848 [1,0,1,0,0,0|2,0,0]=4 585 B9R0.1 CC(C)CSCC(O)CO 62a_100000210624_100011219619 [1,0,1,0,0,0|2,0,0]=4 586 B9R0.1 CC(C)CSCC(O)CO 62a_100011219619_100000210760 [1,0,1,0,0,0|2,0,0]=4 587 B9R0.1 CC(C)CSC[C@@H](C)CO 62a_100000059175_100000210760 [1,0,1,0,0,0|1,0,0]=3 588 B9R0.1 CC(C)CSC[C@@H](C)CO 62a_100000210624_100000059175 [1,0,1,0,0,0|1,0,0]=3 589 B9R0.1 CC(C)CSC[C@@H](O)CO 62a_100000210624_100009815848 [1,0,1,0,0,0|2,0,0]=4 590 B9R0.1 CC(C)CSC[C@@H](O)CO 62a_100009815848_100000210760 [1,0,1,0,0,0|2,0,0]=4 591 B9R0.1 CC(C)OCN[C@H](C)CO 2230a_100000737577_100000709892 [1,0,1,0,0,0|2,0,0]=4 592 B9R0.1 CC(C)OCSC(C)CO 62a_100012180447_100000709892 [1,0,1,0,0,0|2,0,0]=4 593 B9R0.1 CC(C)OCS[C@H](C)CO 62a_100000709892_100016084084 [1,0,1,0,0,0|2,0,0]=4 594 B9R0.1 CC(C)OCS[C@H](C)CO 62a_100016084084_100000709892 [1,0,1,0,0,0|2,0,0]=4 595 B9R0.1 CC(CO)CCNC(C)C 2230a_106354213184_100000210206 [1,0,1,0,0,0|1,0,0]=3 596 B9R0.1 CC(CO)CCNC(C)C 34a_106354213184_100000210206 [1,0,1,0,0,0|1,0,0]=3 597 B9R0.1 CC(CO)CNC[C@@H](C)O 34a_100000744482_100009817552 [1,0,1,0,0,0|2,0,0]=4 598 B9R0.1 CC(CO)OCC[C@@H](C)N 34a_100000706166_100012180447 [1,0,1,0,0,0|2,0,0]=4 599 B9R0.1 CC(CO)SCCN(C)C 62a_100012180447_100000755713 [1,0,1,0,0,0|2,0,0]=4 600 B9R0.1 CC(F)COC[C@@H](C)CO 34a_100015925927_100000059175 [1,0,1,0,0,0|2,0,0]=4 601 B9R0.1 CC(O)CCNC(C)CO 2230a_200000755665_100012180447 [1,0,1,0,0,0|2,0,0]=4 602 B9R0.1 CC(O)CCN[C@H](C)CO 2230a_100000737577_100012276601 [1,0,1,0,0,0|2,0,0]=4 603 B9R0.1 CC(O)CCSC(C)CO 62a_100012180447_100012276601 [1,0,1,0,0,0|2,0,0]=4 604 B9R0.1 CC(O)CCS[C@H](C)CO 62a_100012276601_100016084084 [1,0,1,0,0,0|2,0,0]=4 605 B9R0.1 CC(O)CCS[C@H](C)CO 62a_100016084084_100012276601 [1,0,1,0,0,0|2,0,0]=4 606 B9R0.1 CC(O)CNCC(C)CO 34a_100000744482_100011218427 [1,0,1,0,0,0|2,0,0]=4 607 B9R0.1 CC(O)CNC[C@@H](C)CO 2230a_100000210904_100000059175 [1,0,1,0,0,0|2,0,0]=4 608 B9R0.1 CC(O)CNC[C@@H](C)CO 34a_100000210904_100000059175 [1,0,1,0,0,0|2,0,0]=4 609 B9R0.1 CC(O)CSC[C@@H](C)CO 62a_100000059175_100011218427 [1,0,1,0,0,0|2,0,0]=4 610 B9R0.1 CC(O)CSC[C@@H](C)CO 62a_100011218427_100000059175 [1,0,1,0,0,0|2,0,0]=4 611 B9R0.1 CCC(=O)CCCC(C)C 1458a_100000210414_100011214892 [1,0,1,0,0,0|1,0,1]=4 612 B9R0.1 CCC(=O)CCCC(C)C 1458a_100011216857_100000210202 [1,0,1,0,0,0|1,0,1]=4 613 B9R0.1 CCC(C)CCNC(C)C 2230a_100020591266_100000210206 [1,0,1,0,0,0|1,0,0]=3 614 B9R0.1 CCC(C)CCOC(C)C 7a_100011215188_100000210206 [1,0,1,0,0,0|1,0,0]=3 615 B9R0.1 CCC(C)CNCC(C)C 2230a_100000210953_100000748023 [1,0,1,0,0,0|1,0,0]=3 616 B9R0.1 CCC(C)CNCC(C)C 2230a_100020588543_100000210760 [1,0,1,0,0,0|1,0,0]=3 617 B9R0.1 CCC(C)CNCC(C)C 270004a_100000210953_100000243153 [1,0,1,0,0,0|1,0,0]=3 618 B9R0.1 CCC(C)CNCC(C)C 270004a_100020588543_100000210432 [1,0,1,0,0,0|1,0,0]=3 619 B9R0.1 CCC(C)CNCC(C)C 34a_100000210953_100000748023 [1,0,1,0,0,0|1,0,0]=3 620 B9R0.1 CCC(C)CNCC(C)O 2230a_100000210904_100000748023 [1,0,1,0,0,0|2,0,0]=4 621 B9R0.1 CCC(C)CNCC(C)O 2230a_100020588543_100011218427 [1,0,1,0,0,0|2,0,0]=4 622 B9R0.1 CCC(C)CNCC(C)O 270004a_100000210904_100000243153 [1,0,1,0,0,0|2,0,0]=4 623 B9R0.1 CCC(C)CNCC(C)O 34a_100000210904_100000748023 [1,0,1,0,0,0|2,0,0]=4 624 B9R0.1 CCC(C)CNC[C@@H](C)O 2230a_100020588543_100009817552 [1,0,1,0,0,0|2,0,0]=4 625 B9R0.1 CCC(C)COCC(C)Br 34a_100012180447_100000748023 [1,0,1,0,0,0|2,0,0]=4 626 B9R0.1 CCC(C)COCC(C)C 34a_100000210257_100000748023 [1,0,1,0,0,0|1,0,0]=3 627 B9R0.1 CCC(C)COCC(C)F 34a_100015925927_100000748023 [1,0,1,0,0,0|2,0,0]=4 628 B9R0.1 CCC(C)COC[C@@H](C)Cl 34a_100016084084_100000748023 [1,0,1,0,0,0|2,0,0]=4 629 B9R0.1 CCC(C)COC[C@@H](C)N 34a_100000737577_100000748023 [1,0,1,0,0,0|2,0,0]=4 630 B9R0.1 CCC(C)CSCC(C)C 62a_100000210624_100000748023 [1,0,1,0,0,0|1,0,0]=3 631 B9R0.1 CCC(C)CSCC(C)C 62a_100000748023_100000210760 [1,0,1,0,0,0|1,0,0]=3 632 B9R0.1 CCC(C)CSCC(C)O 62a_100000748023_100011218427 [1,0,1,0,0,0|2,0,0]=4 633 B9R0.1 CCC(C)CSCC(C)O 62a_100011218427_100000748023 [1,0,1,0,0,0|2,0,0]=4 634 B9R0.1 CCC(C)CSC[C@@H](C)O 62a_100000748023_100009817552 [1,0,1,0,0,0|2,0,0]=4 635 B9R0.1 CCC(C)CSC[C@@H](C)O 62a_100009817552_100000748023 [1,0,1,0,0,0|2,0,0]=4 636 B9R0.1 CCC(C)NCCC(C)C 2230a_100000209981_100000210312 [1,0,1,0,0,0|1,0,0]=3 637 B9R0.1 CCC(C)NCCC(C)C 269862a_100000209981_100000185833 [1,0,1,0,0,0|1,0,0]=3 638 B9R0.1 CCC(C)NCCC(C)O 2230a_100000209981_100012276601 [1,0,1,0,0,0|2,0,0]=4 639 B9R0.1 CCC(C)NCCC(C)O 2230a_200000755665_100000758301 [1,0,1,0,0,0|2,0,0]=4 640 B9R0.1 CCC(C)NCOC(C)C 2230a_100000209981_100000709892 [1,0,1,0,0,0|2,0,0]=4 641 B9R0.1 CCC(C)OCCC(C)Br 34a_100009893172_100011215416 [1,0,1,0,0,0|2,0,0]=4 642 B9R0.1 CCC(C)OCCC(C)C 34a_100000210254_100011215416 [1,0,1,0,0,0|1,0,0]=3 643 B9R0.1 CCC(C)OCCC(C)C 7a_100000210228_100000210626 [1,0,1,0,0,0|1,0,0]=3 644 B9R0.1 CCC(C)OCCC(C)C 7a_100000210254_100000758301 [1,0,1,0,0,0|1,0,0]=3 645 B9R0.1 CCC(C)OCCC(C)O 7a_100000210228_100012276601 [1,0,1,0,0,0|2,0,0]=4 646 B9R0.1 CCC(C)OCCN(C)C 7a_100000210228_100000755713 [1,0,1,0,0,0|2,0,0]=4 647 B9R0.1 CCC(C)OCC[C@@H](C)N 34a_100000706166_100011215416 [1,0,1,0,0,0|2,0,0]=4 648 B9R0.1 CCC(C)SCCC(C)C 62a_100000210312_100000758301 [1,0,1,0,0,0|1,0,0]=3 649 B9R0.1 CCC(C)SCCC(C)C 62a_100000758301_100000210312 [1,0,1,0,0,0|1,0,0]=3 650 B9R0.1 CCC(C)SCCC(C)O 62a_100000758301_100012276601 [1,0,1,0,0,0|2,0,0]=4 651 B9R0.1 CCC(C)SCCC(C)O 62a_100012276601_100000758301 [1,0,1,0,0,0|2,0,0]=4 652 B9R0.1 CCC(C)SCCN(C)C 62a_100000758301_100000755713 [1,0,1,0,0,0|2,0,0]=4 653 B9R0.1 CCC(C)SCOC(C)C 62a_100000709892_100000758301 [1,0,1,0,0,0|2,0,0]=4 654 B9R0.1 CCC(C)SCOC(C)C 62a_100000758301_100000709892 [1,0,1,0,0,0|2,0,0]=4 655 B9R0.1 CCC(O)CNCC(C)C 2230a_100000210953_100011218378 [1,0,1,0,0,0|2,0,0]=4 656 B9R0.1 CCC(O)CNCC(C)C 2230a_100011218483_100000210760 [1,0,1,0,0,0|2,0,0]=4 657 B9R0.1 CCC(O)CNCC(C)C 270004a_100011218483_100000210432 [1,0,1,0,0,0|2,0,0]=4 658 B9R0.1 CCC(O)CNCC(C)C 34a_100000210953_100011218378 [1,0,1,0,0,0|2,0,0]=4 659 B9R0.1 CCC(O)COCC(C)C 34a_100000210257_100011218378 [1,0,1,0,0,0|2,0,0]=4 660 B9R0.1 CCC(O)CSCC(C)C 62a_100000210624_100011218378 [1,0,1,0,0,0|2,0,0]=4 661 B9R0.1 CCC(O)CSCC(C)C 62a_100011218378_100000210760 [1,0,1,0,0,0|2,0,0]=4 662 B9R0.1 CCN(C)CCCC(C)C 2230a_100000225621_100011214892 [1,0,1,0,0,0|1,0,0]=3 663 B9R0.1 CCN(C)CCCC(C)C 269982a_100000225621_100011214892 [1,0,1,0,0,0|1,0,0]=3 664 B9R0.1 CCN(C)CCCC(C)O 2230a_100000225621_200000718107 [1,0,1,0,0,0|2,0,0]=4 665 B9R0.1 CCN(C)CCCC(C)O 269982a_100000225621_200000718107 [1,0,1,0,0,0|2,0,0]=4 666 B9R0.1 CCN(C)CCCN(C)C 2230a_100102631434_100015186262 [1,0,1,0,0,0|2,0,0]=4 667 B9R0.1 CCN(C)CCCN(C)C 269982a_100000225621_100000757444 [1,0,1,0,0,0|2,0,0]=4 668 B9R0.1 CCN(C)CCCN(C)C 269982a_100000225831_100000204670 [1,0,1,0,0,0|2,0,0]=4 669 B9R0.1 CCN(C)CCCN(C)C 269982a_100000225837_200000210301 [1,0,1,0,0,0|2,0,0]=4 670 B9R0.1 CCN(C)CCCN(C)C 269982a_100102631434_100015186262 [1,0,1,0,0,0|2,0,0]=4 671 B9R0.1 CCN(C)CCOC(C)C 2230a_100000225621_100000211751 [1,0,1,0,0,0|2,0,0]=4 672 B9R0.1 CCN(C)CCOC(C)C 269982a_100000225621_100000211751 [1,0,1,0,0,0|2,0,0]=4 673 B9R0.1 CCN(C)CCSC(C)C 2230a_100000225621_100000730970 [1,0,1,0,0,0|2,0,0]=4 674 B9R0.1 CCN(C)CCSC(C)C 269982a_100000225621_100000730970 [1,0,1,0,0,0|2,0,0]=4 675 B9R0.1 CCN([13CH3])CCCN(C)C 269982a_100000225837_200025704644 [1,0,1,0,0,0|2,0,0]=4 676 B9R0.1 CC[C@H](C)CNCC(C)C 2230a_100000210953_100009816398 [1,0,1,0,0,0|1,0,0]=3 677 B9R0.1 CC[C@H](C)CNCC(C)C 34a_100000210953_100009816398 [1,0,1,0,0,0|1,0,0]=3 678 B9R0.1 CC[C@H](C)CNCC(C)O 2230a_100000210904_100009816398 [1,0,1,0,0,0|2,0,0]=4 679 B9R0.1 CC[C@H](C)CNCC(C)O 34a_100000210904_100009816398 [1,0,1,0,0,0|2,0,0]=4 680 B9R0.1 CC[C@H](C)COCC(C)Br 34a_100012180447_100009816398 [1,0,1,0,0,0|2,0,0]=4 681 B9R0.1 CC[C@H](C)COCC(C)C 34a_100000210257_100009816398 [1,0,1,0,0,0|1,0,0]=3 682 B9R0.1 CC[C@H](C)COCC(C)C 7a_100009816381_100000210760 [1,0,1,0,0,0|1,0,0]=3 683 B9R0.1 CC[C@H](C)COCC(C)F 34a_100015925927_100009816398 [1,0,1,0,0,0|2,0,0]=4 684 B9R0.1 CC[C@H](C)COCC(C)O 7a_100009816381_100011218427 [1,0,1,0,0,0|2,0,0]=4 685 B9R0.1 CC[C@H](C)COC[C@@H](C)Cl 34a_100016084084_100009816398 [1,0,1,0,0,0|2,0,0]=4 686 B9R0.1 CC[C@H](C)COC[C@@H](C)N 34a_100000737577_100009816398 [1,0,1,0,0,0|2,0,0]=4 687 B9R0.1 CC[C@H](C)COC[C@@H](C)O 7a_100009816381_100009817552 [1,0,1,0,0,0|2,0,0]=4 688 B9R0.1 CC[C@H](C)CSCC(C)C 62a_100000210624_100009816398 [1,0,1,0,0,0|1,0,0]=3 689 B9R0.1 CC[C@H](C)CSCC(C)C 62a_100009816398_100000210760 [1,0,1,0,0,0|1,0,0]=3 690 B9R0.1 CC[C@H](C)CSCC(C)O 62a_100009816398_100011218427 [1,0,1,0,0,0|2,0,0]=4 691 B9R0.1 CC[C@H](C)CSCC(C)O 62a_100011218427_100009816398 [1,0,1,0,0,0|2,0,0]=4 692 B9R0.1 CC[C@H](C)CSC[C@@H](C)O 62a_100009816398_100009817552 [1,0,1,0,0,0|2,0,0]=4 693 B9R0.1 CC[C@H](C)CSC[C@@H](C)O 62a_100009817552_100009816398 [1,0,1,0,0,0|2,0,0]=4 694 B9R0.1 CNC(C)CCCC(C)C 2230a_100000210607_200000210301 [1,0,1,0,0,0|1,0,0]=3 695 B9R0.1 CNC(C)CCCC(C)C 270004a_106832991635_100000753411 [1,0,1,0,0,0|1,0,0]=3 696 B9R0.1 CNC(C)CCOC(C)C 270004a_106832991635_200011219172 [1,0,1,0,0,0|2,0,0]=4 697 B9R0.1 COC(C)CCCC(C)C 34a_200011218570_200000210301 [1,0,1,0,0,0|1,0,0]=3 698 B9R0.1 COC(C)CCCC(C)C 7a_200011218570_200000210301 [1,0,1,0,0,0|1,0,0]=3 699 B9R0.1 COC(C)CCOC(C)C 7a_100000764861_100000210206 [1,0,1,0,0,0|2,0,0]=4 700 B9R0.1 COC(C)COCC(C)C 34a_100000690652_100000210624 [1,0,1,0,0,0|2,0,0]=4 701 B9R0.1 COC(C)SCCC(C)C 62a_100000210312_100009879195 [1,0,1,0,0,0|2,0,0]=4 702 B9R0.1 COC(C)SCCC(C)C 62a_100009879195_100000210312 [1,0,1,0,0,0|2,0,0]=4 703 B9R0.1 CO[C@H](C)CNCC(C)C 2230a_100020591295_100000210760 [1,0,1,0,0,0|2,0,0]=4 704 B9R0.1 CO[C@H](C)CNCC(C)C 270004a_100020591295_100000210432 [1,0,1,0,0,0|2,0,0]=4 705 B9R0.1 C[C@@H](CO)COC[C@@H](C)Cl 34a_100016084084_100000059175 [1,0,1,0,0,0|2,0,0]=4 706 B9R0.1 C[C@@H](CO)COC[C@@H](C)N 34a_100000737577_100000059175 [1,0,1,0,0,0|2,0,0]=4 707 B9R0.1 C[C@@H](CO)CSC[C@@H](C)O 62a_100000059175_100009817552 [1,0,1,0,0,0|2,0,0]=4 708 B9R0.1 C[C@@H](CO)CSC[C@@H](C)O 62a_100009817552_100000059175 [1,0,1,0,0,0|2,0,0]=4 709 B9R0.1 C[C@H](CO)SCCN(C)C 62a_100016084084_100000755713 [1,0,1,0,0,0|2,0,0]=4 710 B9R0.2 CC(=O)CCCCCCO 1458a_100000070787_100000766143 [1,0,1,0,0,0|1,0,1]=4 711 B9R0.2 CC(=O)CCCCCCO 1458a_100011996774_200000210301 [1,0,1,0,0,0|1,0,1]=4 712 B9R0.2 CC(Br)CCOCCCO 34a_100009893172_100000230001 [1,0,1,0,0,0|2,0,0]=4 713 B9R0.2 CC(Br)COCCCCO 34a_100012180447_100011216708 [1,0,1,0,0,0|2,0,0]=4 714 B9R0.2 CC(C)CCCCCN[13CH3] 2230a_100011290863_200025704644 [1,0,1,0,0,0|2,0,0]=4 715 B9R0.2 CC(C)CCCCCN[13CH3] 34a_100011290863_200025704644 [1,0,1,0,0,0|2,0,0]=4 716 B9R0.2 CC(C)CCCCCO[13CH3] 34a_100011995859_200025704644 [1,0,1,0,0,0|2,0,0]=4 717 B9R0.2 CC(C)CCCCCO[13CH3] 7a_100011995859_200025704644 [1,0,1,0,0,0|2,0,0]=4 718 B9R0.2 CC(C)CCCCCS[13CH3] 62a_100000210682_200025704644 [1,0,1,0,0,0|2,0,0]=4 719 B9R0.2 CC(C)CCCCCS[13CH3] 62a_200025704644_100000210682 [1,0,1,0,0,0|2,0,0]=4 720 B9R0.2 CC(C)CCCCOCF 34a_100011214890_100015361967 [1,0,1,0,0,0|2,0,0]=4 721 B9R0.2 CC(C)CCCCOCF 7a_100011214890_100015361967 [1,0,1,0,0,0|2,0,0]=4 722 B9R0.2 CC(C)CCCCSCF 62a_100011216152_100015361967 [1,0,1,0,0,0|2,0,0]=4 723 B9R0.2 CC(C)CCCCSCF 62a_100015361967_100011216152 [1,0,1,0,0,0|2,0,0]=4 724 B9R0.2 CC(C)CCCNCCF 2230a_200000737386_100011217306 [1,0,1,0,0,0|2,0,0]=4 725 B9R0.2 CC(C)CCCNCCF 34a_100000724931_100011214892 [1,0,1,0,0,0|2,0,0]=4 726 B9R0.2 CC(C)CCCNCCF 34a_200000737386_100011217306 [1,0,1,0,0,0|2,0,0]=4 727 B9R0.2 CC(C)CCCNCCO 2230a_100016997473_100011214892 [1,0,1,0,0,0|1,0,0]=3 728 B9R0.2 CC(C)CCCNCCO 2230a_200000737386_100000211926 [1,0,1,0,0,0|1,0,0]=3 729 B9R0.2 CC(C)CCCNCCO 34a_100016990907_100011214892 [1,0,1,0,0,0|1,0,0]=3 730 B9R0.2 CC(C)CCCNCCO 34a_200000737386_100000211926 [1,0,1,0,0,0|1,0,0]=3 731 B9R0.2 CC(C)CCCOCCBr 34a_100000211926_100011214892 [1,0,1,0,0,0|2,0,0]=4 732 B9R0.2 CC(C)CCCOCCF 34a_100000210774_100011217306 [1,0,1,0,0,0|2,0,0]=4 733 B9R0.2 CC(C)CCCOCCF 7a_100000210774_100011217306 [1,0,1,0,0,0|2,0,0]=4 734 B9R0.2 CC(C)CCCOCCN 34a_100000210304_100011214892 [1,0,1,0,0,0|2,0,0]=4 735 B9R0.2 CC(C)CCCOCCO 34a_100000210774_100000211926 [1,0,1,0,0,0|1,0,0]=3 736 B9R0.2 CC(C)CCCOCCO 7a_100000210774_100000211926 [1,0,1,0,0,0|1,0,0]=3 737 B9R0.2 CC(C)CCCSCCF 62a_100011214892_100011217306 [1,0,1,0,0,0|2,0,0]=4 738 B9R0.2 CC(C)CCCSCCF 62a_100011217306_100011214892 [1,0,1,0,0,0|2,0,0]=4 739 B9R0.2 CC(C)CCCSCCO 62a_100000211926_100011214892 [1,0,1,0,0,0|1,0,0]=3 740 B9R0.2 CC(C)CCCSCCO 62a_100011214892_100000211926 [1,0,1,0,0,0|1,0,0]=3 741 B9R0.2 CC(C)CCNCCCF 2230a_100015189416_100000210312 [1,0,1,0,0,0|2,0,0]=4 742 B9R0.2 CC(C)CCNCCCF 269862a_100015189416_100000185833 [1,0,1,0,0,0|2,0,0]=4 743 B9R0.2 CC(C)CCNCCCF 34a_100015189416_100000210312 [1,0,1,0,0,0|2,0,0]=4 744 B9R0.2 CC(C)CCNCCCO 269862a_100000182051_100000185833 [1,0,1,0,0,0|1,0,0]=3 745 B9R0.2 CC(C)CCOCCCBr 34a_100011217188_100000210312 [1,0,1,0,0,0|2,0,0]=4 746 B9R0.2 CC(C)CCOCCCCl 34a_100000230001_100000210312 [1,0,1,0,0,0|2,0,0]=4 747 B9R0.2 CC(C)CCOCCCF 34a_100000210254_100011934791 [1,0,1,0,0,0|2,0,0]=4 748 B9R0.2 CC(C)CCOCCCF 34a_100000759539_100000210312 [1,0,1,0,0,0|2,0,0]=4 749 B9R0.2 CC(C)CCOCCCF 7a_100000210254_100011934791 [1,0,1,0,0,0|2,0,0]=4 750 B9R0.2 CC(C)CCOCCCN 34a_100000182051_100000210312 [1,0,1,0,0,0|2,0,0]=4 751 B9R0.2 CC(C)CCOCCCO 34a_100000210254_100000230001 [1,0,1,0,0,0|1,0,0]=3 752 B9R0.2 CC(C)CCOCCCO 7a_100000210254_100011215043 [1,0,1,0,0,0|1,0,0]=3 753 B9R0.2 CC(C)CCSCCCF 62a_100000210312_100011934791 [1,0,1,0,0,0|2,0,0]=4 754 B9R0.2 CC(C)CCSCCCF 62a_100011934791_100000210312 [1,0,1,0,0,0|2,0,0]=4 755 B9R0.2 CC(C)CCSCCCO 62a_100000210312_100011215043 [1,0,1,0,0,0|1,0,0]=3 756 B9R0.2 CC(C)CCSCCCO 62a_100011215043_100000210312 [1,0,1,0,0,0|1,0,0]=3 757 B9R0.2 CC(C)CNCCCCF 2230a_100000210953_100000729493 [1,0,1,0,0,0|2,0,0]=4 758 B9R0.2 CC(C)CNCCCCF 34a_100000210953_100000729493 [1,0,1,0,0,0|2,0,0]=4 759 B9R0.2 CC(C)CNCCCCO 2230a_100000210953_100000210776 [1,0,1,0,0,0|1,0,0]=3 760 B9R0.2 CC(C)CNCCCCO 2230a_100000750430_100000210760 [1,0,1,0,0,0|1,0,0]=3 761 B9R0.2 CC(C)CNCCCCO 270004a_100000750430_100000210432 [1,0,1,0,0,0|1,0,0]=3 762 B9R0.2 CC(C)CNCCCCO 34a_100000210953_100011216708 [1,0,1,0,0,0|1,0,0]=3 763 B9R0.2 CC(C)CNCCCCO 34a_100000750430_100000210624 [1,0,1,0,0,0|1,0,0]=3 764 B9R0.2 CC(C)COCCCCBr 34a_100011216708_100000210624 [1,0,1,0,0,0|2,0,0]=4 765 B9R0.2 CC(C)COCCCCCl 34a_100000210776_100000210624 [1,0,1,0,0,0|2,0,0]=4 766 B9R0.2 CC(C)COCCCCCl 7a_100000210776_100000210760 [1,0,1,0,0,0|2,0,0]=4 767 B9R0.2 CC(C)COCCCCF 34a_100000210257_100000729493 [1,0,1,0,0,0|2,0,0]=4 768 B9R0.2 CC(C)COCCCCF 34a_100011995726_100000210624 [1,0,1,0,0,0|2,0,0]=4 769 B9R0.2 CC(C)COCCCCF 7a_100011995726_100000210760 [1,0,1,0,0,0|2,0,0]=4 770 B9R0.2 CC(C)COCCCCI 34a_200012148704_100000210624 [1,0,1,0,0,0|2,0,0]=4 771 B9R0.2 CC(C)COCCCCN 34a_100000750430_100000210624 [1,0,1,0,0,0|2,0,0]=4 772 B9R0.2 CC(C)COCCCCO 34a_100000210257_100011216708 [1,0,1,0,0,0|1,0,0]=3 773 B9R0.2 CC(C)CSCCCCF 62a_100000210624_100000729493 [1,0,1,0,0,0|2,0,0]=4 774 B9R0.2 CC(C)CSCCCCF 62a_100000729493_100000210760 [1,0,1,0,0,0|2,0,0]=4 775 B9R0.2 CC(C)CSCCCCO 62a_100000210624_100000210776 [1,0,1,0,0,0|1,0,0]=3 776 B9R0.2 CC(C)CSCCCCO 62a_100000210776_100000210760 [1,0,1,0,0,0|1,0,0]=3 777 B9R0.2 CC(C)NCCCCCF 2230a_100138425928_100000729378 [1,0,1,0,0,0|2,0,0]=4 778 B9R0.2 CC(C)NCCCCCF 34a_100138425928_100000729378 [1,0,1,0,0,0|2,0,0]=4 779 B9R0.2 CC(C)NCCCCCO 2230a_100000762737_100000210206 [1,0,1,0,0,0|1,0,0]=3 780 B9R0.2 CC(C)NCCCCCO 2230a_100138425928_100000746330 [1,0,1,0,0,0|1,0,0]=3 781 B9R0.2 CC(C)NCCCCCO 34a_100000762737_100000210206 [1,0,1,0,0,0|1,0,0]=3 782 B9R0.2 CC(C)NCCCCCO 34a_100138425928_100000746330 [1,0,1,0,0,0|1,0,0]=3 783 B9R0.2 CC(C)NCCOCCO 2230a_100000211614_100000210206 [1,0,1,0,0,0|2,0,0]=4 784 B9R0.2 CC(C)NCCOCCO 2230a_100138425928_100011215305 [1,0,1,0,0,0|2,0,0]=4 785 B9R0.2 CC(C)NCCOCCO 34a_100000211614_100000210206 [1,0,1,0,0,0|2,0,0]=4 786 B9R0.2 CC(C)NCCOCCO 34a_100000224655_100000211926 [1,0,1,0,0,0|2,0,0]=4 787 B9R0.2 CC(C)NCCOCCO 34a_100138425928_100000692535 [1,0,1,0,0,0|2,0,0]=4 788 B9R0.2 CC(C)NCCSCCO 2230a_100011219999_100000210206 [1,0,1,0,0,0|2,0,0]=4 789 B9R0.2 CC(C)OCCCCCBr 34a_100000746331_100000210206 [1,0,1,0,0,0|2,0,0]=4 790 B9R0.2 CC(C)OCCCCCBr 7a_100000746331_100000210206 [1,0,1,0,0,0|2,0,0]=4 791 B9R0.2 CC(C)OCCCCCCl 34a_100000746330_100000210206 [1,0,1,0,0,0|2,0,0]=4 792 B9R0.2 CC(C)OCCCCCCl 7a_100000746330_100000210206 [1,0,1,0,0,0|2,0,0]=4 793 B9R0.2 CC(C)OCCCCCF 34a_100000212225_100000729378 [1,0,1,0,0,0|2,0,0]=4 794 B9R0.2 CC(C)OCCCCCI 34a_200012148887_100000210206 [1,0,1,0,0,0|2,0,0]=4 795 B9R0.2 CC(C)OCCCCCI 7a_200012148887_100000210206 [1,0,1,0,0,0|2,0,0]=4 796 B9R0.2 CC(C)OCCCCCN 34a_100000762737_100000210206 [1,0,1,0,0,0|2,0,0]=4 797 B9R0.2 CC(C)OCCCCCO 34a_100000212225_100000746330 [1,0,1,0,0,0|1,0,0]=3 798 B9R0.2 CC(C)OCCNCCO 2230a_100000701111_100000211926 [1,0,1,0,0,0|2,0,0]=4 799 B9R0.2 CC(C)OCCNCCO 2230a_100016997473_100000211751 [1,0,1,0,0,0|2,0,0]=4 800 B9R0.2 CC(C)OCCNCCO 34a_100000701111_100000211926 [1,0,1,0,0,0|2,0,0]=4 801 B9R0.2 CC(C)OCCNCCO 34a_100016990907_100000211751 [1,0,1,0,0,0|2,0,0]=4 802 B9R0.2 CC(C)OCCOCCO 34a_100000211219_100000211926 [1,0,1,0,0,0|2,0,0]=4 803 B9R0.2 CC(C)OCCOCCO 34a_100000212225_100000692535 [1,0,1,0,0,0|2,0,0]=4 804 B9R0.2 CC(C)OCCOCCO 7a_100000211219_100000211926 [1,0,1,0,0,0|2,0,0]=4 805 B9R0.2 CC(C)OCCSCCO 62a_100000211751_100000211926 [1,0,1,0,0,0|2,0,0]=4 806 B9R0.2 CC(C)OCCSCCO 62a_100000211926_100000211751 [1,0,1,0,0,0|2,0,0]=4 807 B9R0.2 CC(C)OCSCCCO 62a_100000709892_100011215043 [1,0,1,0,0,0|2,0,0]=4 808 B9R0.2 CC(C)OCSCCCO 62a_100011215043_100000709892 [1,0,1,0,0,0|2,0,0]=4 809 B9R0.2 CC(C)SCCCCCF 62a_100000210206_100000729378 [1,0,1,0,0,0|2,0,0]=4 810 B9R0.2 CC(C)SCCCCCF 62a_100000729378_100000210206 [1,0,1,0,0,0|2,0,0]=4 811 B9R0.2 CC(C)SCCCCCO 62a_100000210206_100000746330 [1,0,1,0,0,0|1,0,0]=3 812 B9R0.2 CC(C)SCCCCCO 62a_100000746330_100000210206 [1,0,1,0,0,0|1,0,0]=3 813 B9R0.2 CC(C)SCCNCCO 2230a_100000731138_100000211926 [1,0,1,0,0,0|2,0,0]=4 814 B9R0.2 CC(C)SCCNCCO 2230a_100016997473_100000730970 [1,0,1,0,0,0|2,0,0]=4 815 B9R0.2 CC(C)SCCNCCO 34a_100000731138_100000211926 [1,0,1,0,0,0|2,0,0]=4 816 B9R0.2 CC(C)SCCNCCO 34a_100016990907_100000730970 [1,0,1,0,0,0|2,0,0]=4 817 B9R0.2 CC(C)SCCOCCO 34a_200011212901_100000211926 [1,0,1,0,0,0|2,0,0]=4 818 B9R0.2 CC(C)SCCOCCO 62a_100000210206_100011215305 [1,0,1,0,0,0|2,0,0]=4 819 B9R0.2 CC(C)SCCOCCO 62a_100011215305_100000210206 [1,0,1,0,0,0|2,0,0]=4 820 B9R0.2 CC(C)SCCOCCO 7a_200011212901_100000211926 [1,0,1,0,0,0|2,0,0]=4 821 B9R0.2 CC(C)SCCSCCO 62a_100000211926_100000730970 [1,0,1,0,0,0|2,0,0]=4 822 B9R0.2 CC(C)SCCSCCO 62a_100000730970_100000211926 [1,0,1,0,0,0|2,0,0]=4 823 B9R0.2 CC(F)COCCCCO 34a_100015925927_100011216708 [1,0,1,0,0,0|2,0,0]=4 824 B9R0.2 CC(O)CCCNCCO 2230a_100016997473_200000718107 [1,0,1,0,0,0|2,0,0]=4 825 B9R0.2 CC(O)CCCNCCO 34a_100016990907_200000718107 [1,0,1,0,0,0|2,0,0]=4 826 B9R0.2 CC(O)CCCSCCO 62a_100000211926_200000718107 [1,0,1,0,0,0|2,0,0]=4 827 B9R0.2 CC(O)CCCSCCO 62a_200000718107_100000211926 [1,0,1,0,0,0|2,0,0]=4 828 B9R0.2 CC(O)CCNCCCO 2230a_200000755665_100000230001 [1,0,1,0,0,0|2,0,0]=4 829 B9R0.2 CC(O)CCSCCCO 62a_100011215043_100012276601 [1,0,1,0,0,0|2,0,0]=4 830 B9R0.2 CC(O)CCSCCCO 62a_100012276601_100011215043 [1,0,1,0,0,0|2,0,0]=4 831 B9R0.2 CC(O)CNCCCCO 2230a_100000210904_100000210776 [1,0,1,0,0,0|2,0,0]=4 832 B9R0.2 CC(O)CNCCCCO 2230a_100000750430_100011218427 [1,0,1,0,0,0|2,0,0]=4 833 B9R0.2 CC(O)CNCCCCO 34a_100000210904_100011216708 [1,0,1,0,0,0|2,0,0]=4 834 B9R0.2 CC(O)CNCCCCO 34a_100000750430_100011218427 [1,0,1,0,0,0|2,0,0]=4 835 B9R0.2 CC(O)CSCCCCO 62a_100000210776_100011218427 [1,0,1,0,0,0|2,0,0]=4 836 B9R0.2 CC(O)CSCCCCO 62a_100011218427_100000210776 [1,0,1,0,0,0|2,0,0]=4 837 B9R0.2 CCCCCCCN(C)C 2230a_100000228206_200000210301 [1,0,1,0,0,0|2,0,0]=4 838 B9R0.2 CCCCCCCN(C)C 2230a_100102631434_100000210681 [1,0,1,0,0,0|2,0,0]=4 839 B9R0.2 CCCCCCCN(C)C 269982a_100000228206_200000210301 [1,0,1,0,0,0|2,0,0]=4 840 B9R0.2 CCCCCCCN(C)C 269982a_100102631434_100000210681 [1,0,1,0,0,0|2,0,0]=4 841 B9R0.2 CCCCCCCN(C)[13CH3] 2230a_100000228206_200025704644 [1,0,1,0,0,0|2,0,0]=4 842 B9R0.2 CCCCCCCN(C)[13CH3] 269982a_100000228206_200025704644 [1,0,1,0,0,0|2,0,0]=4 843 B9R0.2 CCCCCCNC(C)C 2230a_100000210581_100000210206 [1,0,1,0,0,0|2,0,0]=4 844 B9R0.2 CCCCCCNC(C)C 2230a_100138425928_100000210314 [1,0,1,0,0,0|2,0,0]=4 845 B9R0.2 CCCCCCNC(C)C 34a_100138425928_100000210314 [1,0,1,0,0,0|2,0,0]=4 846 B9R0.2 CCCCCCOC(C)C 34a_100000210259_100000210206 [1,0,1,0,0,0|2,0,0]=4 847 B9R0.2 CCCCCCOC(C)C 34a_100000212225_100000210314 [1,0,1,0,0,0|2,0,0]=4 848 B9R0.2 CCCCCCOC(C)C 7a_100000210259_100000210206 [1,0,1,0,0,0|2,0,0]=4 849 B9R0.2 CCCCCCSC(C)C 62a_100000210206_100000210757 [1,0,1,0,0,0|2,0,0]=4 850 B9R0.2 CCCCCCSC(C)C 62a_100000210314_100000210206 [1,0,1,0,0,0|2,0,0]=4 851 B9R0.2 CCCCCNCC(C)C 2230a_100000209983_100000210760 [1,0,1,0,0,0|2,0,0]=4 852 B9R0.2 CCCCCNCC(C)C 2230a_100000210953_100000210326 [1,0,1,0,0,0|2,0,0]=4 853 B9R0.2 CCCCCNCC(C)C 270004a_100000209983_100000210432 [1,0,1,0,0,0|2,0,0]=4 854 B9R0.2 CCCCCNCC(C)C 34a_100000210953_100000718602 [1,0,1,0,0,0|2,0,0]=4 855 B9R0.2 CCCCCOCC(C)C 34a_100000210253_100000210624 [1,0,1,0,0,0|2,0,0]=4 856 B9R0.2 CCCCCOCC(C)C 34a_100000210257_100000718602 [1,0,1,0,0,0|2,0,0]=4 857 B9R0.2 CCCCCOCC(C)C 7a_100000210253_100000210760 [1,0,1,0,0,0|2,0,0]=4 858 B9R0.2 CCCCCSCC(C)C 62a_100000210326_100000210760 [1,0,1,0,0,0|2,0,0]=4 859 B9R0.2 CCCCCSCC(C)C 62a_100000210624_100000210326 [1,0,1,0,0,0|2,0,0]=4 860 B9R0.2 CCCCNCCC(C)C 2230a_100000102301_100000210312 [1,0,1,0,0,0|2,0,0]=4 861 B9R0.2 CCCCNCCC(C)C 269862a_100000102301_100000185833 [1,0,1,0,0,0|2,0,0]=4 862 B9R0.2 CCCCNCCC(C)C 7a_106832991798_100000210626 [1,0,1,0,0,0|2,0,0]=4 863 B9R0.2 CCCCOCCC(C)C 34a_100000210227_100000210312 [1,0,1,0,0,0|2,0,0]=4 864 B9R0.2 CCCCOCCC(C)C 34a_100000210254_100000210210 [1,0,1,0,0,0|2,0,0]=4 865 B9R0.2 CCCCOCCC(C)C 7a_100000210227_100000210626 [1,0,1,0,0,0|2,0,0]=4 866 B9R0.2 CCCCOCCC(C)C 7a_100000210254_100000210211 [1,0,1,0,0,0|2,0,0]=4 867 B9R0.2 CCCCSCCC(C)C 62a_100000210211_100000210312 [1,0,1,0,0,0|2,0,0]=4 868 B9R0.2 CCCCSCCC(C)C 62a_100000210312_100000210210 [1,0,1,0,0,0|2,0,0]=4 869 B9R0.2 CCCNCCCC(C)C 2230a_200000737386_100000210303 [1,0,1,0,0,0|2,0,0]=4 870 B9R0.2 CCCNCCCC(C)C 34a_200000737386_100000210303 [1,0,1,0,0,0|2,0,0]=4 871 B9R0.2 CCCOCCCC(C)C 34a_100000210258_100011214892 [1,0,1,0,0,0|2,0,0]=4 872 B9R0.2 CCCOCCCC(C)C 34a_100000210774_100000210303 [1,0,1,0,0,0|2,0,0]=4 873 B9R0.2 CCCOCCCC(C)C 7a_100000210774_100000210303 [1,0,1,0,0,0|2,0,0]=4 874 B9R0.2 CCCSCCCC(C)C 62a_100000210303_100011214892 [1,0,1,0,0,0|2,0,0]=4 875 B9R0.2 CCCSCCCC(C)C 62a_100011214892_100000210303 [1,0,1,0,0,0|2,0,0]=4 876 B9R0.2 CCNCCCCC(C)C 2230a_100015525214_100011216152 [1,0,1,0,0,0|2,0,0]=4 877 B9R0.2 CCOCCCCC(C)C 34a_100011214890_100000210202 [1,0,1,0,0,0|2,0,0]=4 878 B9R0.2 CCOCCCCC(C)C 34a_100121572206_100011216152 [1,0,1,0,0,0|2,0,0]=4 879 B9R0.2 CCOCCCCC(C)C 7a_100011214890_100000210202 [1,0,1,0,0,0|2,0,0]=4 880 B9R0.2 CCSCCCCC(C)C 62a_100000210202_100011216152 [1,0,1,0,0,0|2,0,0]=4 881 B9R0.2 CCSCCCCC(C)C 62a_100011216152_100000210202 [1,0,1,0,0,0|2,0,0]=4 882 B9R0.2 CN(C)CCCCCCF 2230a_100102631434_100015922095 [1,0,1,0,0,0|2,0,0]=4 883 B9R0.2 CN(C)CCCCCCF 269982a_100102631434_100015922095 [1,0,1,0,0,0|2,0,0]=4 884 B9R0.2 CN(C)CCCCCCO 2230a_100102631434_100000766143 [1,0,1,0,0,0|1,0,0]=3 885 B9R0.2 CN(C)CCCCCCO 269982a_100102631434_100000766143 [1,0,1,0,0,0|1,0,0]=3 886 B9R0.2 CN(C)CCCSCCO 62a_100000211926_100000757444 [1,0,1,0,0,0|2,0,0]=4 887 B9R0.2 CN(C)CCSCCCO 62a_100011215043_100000755713 [1,0,1,0,0,0|2,0,0]=4 888 B9R0.2 CNCCCCCC(C)C 2230a_100011290863_200000210301 [1,0,1,0,0,0|2,0,0]=4 889 B9R0.2 CNCCCCCC(C)C 2230a_106832991635_100000210682 [1,0,1,0,0,0|2,0,0]=4 890 B9R0.2 CNCCCCCC(C)C 34a_100011290863_200000210301 [1,0,1,0,0,0|2,0,0]=4 891 B9R0.2 CNCCCCCC(C)C 34a_100102657272_100000210682 [1,0,1,0,0,0|2,0,0]=4 892 B9R0.2 CNCCCCCC(C)C 7a_106832991635_100000210682 [1,0,1,0,0,0|2,0,0]=4 893 B9R0.2 COCCCCCC(C)C 34a_100011995859_200000210301 [1,0,1,0,0,0|2,0,0]=4 894 B9R0.2 COCCCCCC(C)C 34a_100138415774_100000210682 [1,0,1,0,0,0|2,0,0]=4 895 B9R0.2 COCCCCCC(C)C 7a_100011995859_200000210301 [1,0,1,0,0,0|2,0,0]=4 896 B9R0.2 CSCCCCCC(C)C 62a_100000210682_200000210301 [1,0,1,0,0,0|2,0,0]=4 897 B9R0.2 CSCCCCCC(C)C 62a_200000210301_100000210682 [1,0,1,0,0,0|2,0,0]=4 898 B9R0.2 C[C@@H](Cl)COCCCCO 34a_100016084084_100011216708 [1,0,1,0,0,0|2,0,0]=4 899 B9R0.2 C[C@@H](N)CCOCCCO 34a_100000706166_100000230001 [1,0,1,0,0,0|2,0,0]=4 900 B9R0.2 C[C@@H](N)COCCCCO 34a_100000737577_100011216708 [1,0,1,0,0,0|2,0,0]=4 901 B9R0.2 C[C@@H](O)CNCCCCO 2230a_100000750430_100009817552 [1,0,1,0,0,0|2,0,0]=4 902 B9R0.2 C[C@@H](O)CNCCCCO 34a_100000750430_100009817552 [1,0,1,0,0,0|2,0,0]=4 903 B9R0.2 C[C@@H](O)CSCCCCO 62a_100000210776_100009817552 [1,0,1,0,0,0|2,0,0]=4 904 B9R0.2 C[C@@H](O)CSCCCCO 62a_100009817552_100000210776 [1,0,1,0,0,0|2,0,0]=4 905 B9R0.2 [13CH3]C(=O)CCCCCCO 1458a_100011996774_200025704644 [1,0,1,0,0,0|1,0,1]=4 906 B9R0.5 CC(CCO)NCCCF 2230a_100015189416_100009893172 [1,0,1,0,0,0|2,0,0]=4 907 B9R0.5 CC(CCO)NCCCF 34a_100015189416_100009893172 [1,0,1,0,0,0|2,0,0]=4 908 B9R0.5 CC(CCO)OCCCBr 34a_100011217188_100009893172 [1,0,1,0,0,0|2,0,0]=4 909 B9R0.5 CC(CCO)OCCCCl 34a_100000230001_100009893172 [1,0,1,0,0,0|2,0,0]=4 910 B9R0.5 CC(CCO)OCCCF 34a_100000759539_100009893172 [1,0,1,0,0,0|2,0,0]=4 911 B9R0.5 CC(CCO)OCCCN 34a_100000182051_100009893172 [1,0,1,0,0,0|2,0,0]=4 912 B9R0.5 CC(CCO)SCCCF 62a_100009893172_100011934791 [1,0,1,0,0,0|2,0,0]=4 913 B9R0.5 CC(CCO)SCCCF 62a_100011934791_100009893172 [1,0,1,0,0,0|2,0,0]=4 914 B9R0.5 CC(CCO)SCCCO 62a_100009893172_100011215043 [1,0,1,0,0,0|2,0,0]=4 915 B9R0.5 CC(CCO)SCCCO 62a_100011215043_100009893172 [1,0,1,0,0,0|2,0,0]=4 916 B9R0.5 CCCC(C)CCCOC 34a_100011713154_200000210301 [1,0,1,0,0,0|2,0,0]=4 917 B9R0.5 CCCC(C)CCCOC 7a_100011713154_200000210301 [1,0,1,0,0,0|2,0,0]=4 918 B9R0.5 CCCC(C)CCCO[13CH3] 34a_100011713154_200025704644 [1,0,1,0,0,0|2,0,0]=4 919 B9R0.5 CCCC(C)CCCO[13CH3] 7a_100011713154_200025704644 [1,0,1,0,0,0|2,0,0]=4 920 B9R0.5 CCCC(C)CCOCC 34a_100011217855_100000210202 [1,0,1,0,0,0|2,0,0]=4 921 B9R0.5 CCCC(C)CCOCC 7a_100011217855_100000210202 [1,0,1,0,0,0|2,0,0]=4 922 B9R0.5 CCCCCC(=O)CCO 1458a_100000212188_100000211926 [1,0,1,0,0,0|1,0,1]=4 923 B9R0.5 CCCCCC(=O)CCO 1458a_100011216618_100000210326 [1,0,1,0,0,0|1,0,1]=4 924 B9R0.5 CCCCCC(C)NCC 2230a_100000211957_100000210202 [1,0,1,0,0,0|2,0,0]=4 925 B9R0.5 CCCCCC(C)NCC 2230a_100015525214_200011218191 [1,0,1,0,0,0|2,0,0]=4 926 B9R0.5 CCCCCC(C)NCC 270004a_100015525214_100000211708 [1,0,1,0,0,0|2,0,0]=4 927 B9R0.5 CCCCCC(C)OCC 34a_100011215632_100000210202 [1,0,1,0,0,0|2,0,0]=4 928 B9R0.5 CCCCCC(C)OCC 34a_100121572206_200011218191 [1,0,1,0,0,0|2,0,0]=4 929 B9R0.5 CCCCCC(C)OCC 7a_100011215632_100000210202 [1,0,1,0,0,0|2,0,0]=4 930 B9R0.5 CCCCCC(C)OCF 34a_100011215632_100015361967 [1,0,1,0,0,0|2,0,0]=4 931 B9R0.5 CCCCCC(C)OCF 7a_100011215632_100015361967 [1,0,1,0,0,0|2,0,0]=4 932 B9R0.5 CCCCCC(C)SCC 62a_100000210202_200011218191 [1,0,1,0,0,0|2,0,0]=4 933 B9R0.5 CCCCCC(C)SCC 62a_200011218191_100000210202 [1,0,1,0,0,0|2,0,0]=4 934 B9R0.5 CCCCCC(C)SCF 62a_100015361967_200011218191 [1,0,1,0,0,0|2,0,0]=4 935 B9R0.5 CCCCCC(C)SCF 62a_200011218191_100015361967 [1,0,1,0,0,0|2,0,0]=4 936 B9R0.5 CCCCCN(C)CCC 2230a_100000223495_100000210303 [1,0,1,0,0,0|2,0,0]=4 937 B9R0.5 CCCCCN(C)CCC 2230a_100000747261_100000210326 [1,0,1,0,0,0|2,0,0]=4 938 B9R0.5 CCCCCN(C)CCC 2230a_200000226819_200000210301 [1,0,1,0,0,0|2,0,0]=4 939 B9R0.5 CCCCCN(C)CCC 269982a_100000223495_100000210303 [1,0,1,0,0,0|2,0,0]=4 940 B9R0.5 CCCCCN(C)CCC 269982a_100000747261_100000210215 [1,0,1,0,0,0|2,0,0]=4 941 B9R0.5 CCCCCN(C)CCC 269982a_200000226819_200000210301 [1,0,1,0,0,0|2,0,0]=4 942 B9R0.5 CCCCCN(C)CCF 2230a_100000223495_100011217306 [1,0,1,0,0,0|2,0,0]=4 943 B9R0.5 CCCCCN(C)CCF 269982a_100000223495_100011217306 [1,0,1,0,0,0|2,0,0]=4 944 B9R0.5 CCCCCN(C)CCO 2230a_100000210263_100000210326 [1,0,1,0,0,0|1,0,0]=3 945 B9R0.5 CCCCCN(C)CCO 2230a_100000223495_100000211926 [1,0,1,0,0,0|1,0,0]=3 946 B9R0.5 CCCCCN(C)CCO 2230a_100000224656_200000210301 [1,0,1,0,0,0|1,0,0]=3 947 B9R0.5 CCCCCN(C)CCO 269982a_100000210263_100000210215 [1,0,1,0,0,0|1,0,0]=3 948 B9R0.5 CCCCCN(C)CCO 269982a_100000223495_100000211926 [1,0,1,0,0,0|1,0,0]=3 949 B9R0.5 CCCCCN(C)CCO 269982a_100000224656_200000210301 [1,0,1,0,0,0|1,0,0]=3 950 B9R0.5 CCCCCN([13CH3])CCC 2230a_200000226819_200025704644 [1,0,1,0,0,0|2,0,0]=4 951 B9R0.5 CCCCCN([13CH3])CCC 269982a_200000226819_200025704644 [1,0,1,0,0,0|2,0,0]=4 952 B9R0.5 CCCCCN([13CH3])CCO 2230a_100000224656_200025704644 [1,0,1,0,0,0|1,0,0]=3 953 B9R0.5 CCCCCN([13CH3])CCO 269982a_100000224656_200025704644 [1,0,1,0,0,0|1,0,0]=3 954 B9R0.5 CCCCNC(C)CCC 2230a_100000102301_100000766640 [1,0,1,0,0,0|2,0,0]=4 955 B9R0.5 CCCCNC(C)CCC 2230a_100000741246_100000210211 [1,0,1,0,0,0|2,0,0]=4 956 B9R0.5 CCCCNC(C)CCC 270004a_100000102301_100000211909 [1,0,1,0,0,0|2,0,0]=4 957 B9R0.5 CCCCNC(C)CCC 7a_106832991798_100000766640 [1,0,1,0,0,0|2,0,0]=4 958 B9R0.5 CCCCNC(C)CCO 2230a_100000102301_100009893172 [1,0,1,0,0,0|1,0,0]=3 959 B9R0.5 CCCCNC(C)CCO 7a_106832991798_100009893172 [1,0,1,0,0,0|1,0,0]=3 960 B9R0.5 CCCCN[C@H](C)CCO 2230a_100000706166_100000210211 [1,0,1,0,0,0|1,0,0]=3 961 B9R0.5 CCCCN[C@H](C)CCO 34a_100000706166_100000210210 [1,0,1,0,0,0|1,0,0]=3 962 B9R0.5 CCCCOC(C)CCBr 34a_100012276601_100000210210 [1,0,1,0,0,0|2,0,0]=4 963 B9R0.5 CCCCOC(C)CCC 34a_100000210227_100000766640 [1,0,1,0,0,0|2,0,0]=4 964 B9R0.5 CCCCOC(C)CCC 34a_100000764384_100000210210 [1,0,1,0,0,0|2,0,0]=4 965 B9R0.5 CCCCOC(C)CCC 7a_100000210227_100000766640 [1,0,1,0,0,0|2,0,0]=4 966 B9R0.5 CCCCOC(C)CCC 7a_100000764384_100000210211 [1,0,1,0,0,0|2,0,0]=4 967 B9R0.5 CCCCOC(C)CCO 34a_100000210227_100009893172 [1,0,1,0,0,0|1,0,0]=3 968 B9R0.5 CCCCOC(C)CCO 7a_100000210227_100009893172 [1,0,1,0,0,0|1,0,0]=3 969 B9R0.5 CCCCSC(C)CCC 62a_100000210211_100000766640 [1,0,1,0,0,0|2,0,0]=4 970 B9R0.5 CCCCSC(C)CCC 62a_100000766640_100000210210 [1,0,1,0,0,0|2,0,0]=4 971 B9R0.5 CCCCSC(C)CCO 62a_100000210211_100009893172 [1,0,1,0,0,0|1,0,0]=3 972 B9R0.5 CCCCSC(C)CCO 62a_100009893172_100000210210 [1,0,1,0,0,0|1,0,0]=3 973 B9R0.5 CCCNCC(C)CCC 270004a_100020643023_100000243154 [1,0,1,0,0,0|2,0,0]=4 974 B9R0.5 CCCOCC(C)CCC 34a_100000210258_100011216630 [1,0,1,0,0,0|2,0,0]=4 975 B9R0.5 CCCOCC(C)CCC 34a_100000688023_100000210303 [1,0,1,0,0,0|2,0,0]=4 976 B9R0.5 CCCOCC(C)CCC 7a_100000688023_100000210303 [1,0,1,0,0,0|2,0,0]=4 977 B9R0.5 CCCOCC(C)CCN 34a_106354213184_100000210303 [1,0,1,0,0,0|2,0,0]=4 978 B9R0.5 CCCSCC(C)CCC 62a_100000210303_100011216630 [1,0,1,0,0,0|2,0,0]=4 979 B9R0.5 CCCSCC(C)CCC 62a_100011216630_100000210303 [1,0,1,0,0,0|2,0,0]=4 980 B9R0.5 CCOCCN(C)CCO 2230a_100000210263_100011215890 [1,0,1,0,0,0|2,0,0]=4 981 B9R0.5 CCOCCN(C)CCO 269982a_100000210263_100011215890 [1,0,1,0,0,0|2,0,0]=4 982 B9R0.5 CCOCSC(C)CCO 62a_100000739092_100009893172 [1,0,1,0,0,0|2,0,0]=4 983 B9R0.5 CCOCSC(C)CCO 62a_100009893172_100000739092 [1,0,1,0,0,0|2,0,0]=4 984 B9R0.5 CCSCCN(C)CCO 2230a_100000210263_100000757381 [1,0,1,0,0,0|2,0,0]=4 985 B9R0.5 CCSCCN(C)CCO 269982a_100000210263_100000757381 [1,0,1,0,0,0|2,0,0]=4 986 B9R0.5 CN(CCO)CCCCF 2230a_100000210263_100000729493 [1,0,1,0,0,0|2,0,0]=4 987 B9R0.5 CN(CCO)CCCCF 269982a_100000210263_100000729493 [1,0,1,0,0,0|2,0,0]=4 988 B9R0.5 CN(CCO)CCCCO 2230a_100000210263_100000210776 [1,0,1,0,0,0|2,0,0]=4 989 B9R0.5 CN(CCO)CCCCO 2230a_100000717598_100000211926 [1,0,1,0,0,0|2,0,0]=4 990 B9R0.5 CN(CCO)CCCCO 269982a_100000210263_100000210776 [1,0,1,0,0,0|2,0,0]=4 991 B9R0.5 CN(CCO)CCCCO 269982a_100000717598_100000211926 [1,0,1,0,0,0|2,0,0]=4 992 B9R0.5 COCCCN(C)CCO 2230a_100000210263_100000740836 [1,0,1,0,0,0|2,0,0]=4 993 B9R0.5 COCCCN(C)CCO 2230a_100000224831_100000211926 [1,0,1,0,0,0|2,0,0]=4 994 B9R0.5 COCCCN(C)CCO 269982a_100000210263_100000740836 [1,0,1,0,0,0|2,0,0]=4 995 B9R0.5 COCCCN(C)CCO 269982a_100000224831_100000211926 [1,0,1,0,0,0|2,0,0]=4 996 B9R0.5 COCCNC(C)CCO 2230a_100000209980_100009893172 [1,0,1,0,0,0|2,0,0]=4 997 B9R0.5 COCCN[C@H](C)CCO 2230a_100000706166_100011201679 [1,0,1,0,0,0|2,0,0]=4 998 B9R0.5 COCCN[C@H](C)CCO 34a_100000706166_100011201679 [1,0,1,0,0,0|2,0,0]=4 999 B9R0.5 COCCOC(C)CCO 34a_100000210237_100009893172 [1,0,1,0,0,0|2,0,0]=4 1000 B9R0.5 COCCSC(C)CCO 62a_100000233755_100009893172 [1,0,1,0,0,0|2,0,0]=4 1001 B9R0.5 COCCSC(C)CCO 62a_100009893172_100000233755 [1,0,1,0,0,0|2,0,0]=4 1002 B9R0.5 CSCCNC(C)CCO 2230a_100020590264_100009893172 [1,0,1,0,0,0|2,0,0]=4 1003 B9R0.5 CSCCN[C@H](C)CCO 2230a_100000706166_100000751147 [1,0,1,0,0,0|2,0,0]=4 1004 B9R0.5 CSCCN[C@H](C)CCO 34a_100000706166_100000212216 [1,0,1,0,0,0|2,0,0]=4 1005 B9R0.5 CSCCOC(C)CCO 34a_100000230434_100009893172 [1,0,1,0,0,0|2,0,0]=4 1006 B9R0.5 CSCCOC(C)CCO 7a_100000230434_100009893172 [1,0,1,0,0,0|2,0,0]=4 1007 B9R0.5 CSCCSC(C)CCO 62a_100000212216_100009893172 [1,0,1,0,0,0|2,0,0]=4 1008 B9R0.5 CSCCSC(C)CCO 62a_100009893172_100000751147 [1,0,1,0,0,0|2,0,0]=4 1009 B9R0.5 C[C@H](CCO)NCCCF 2230a_100000706166_100011934791 [1,0,1,0,0,0|2,0,0]=4 1010 B9R0.5 C[C@H](CCO)NCCCF 34a_100000706166_100011934791 [1,0,1,0,0,0|2,0,0]=4 1011 B9R0.5 C[C@H](CCO)NCCCO 2230a_100000706166_100000230001 [1,0,1,0,0,0|2,0,0]=4 1012 B9R0.5 C[C@H](CCO)NCCCO 34a_100000706166_100000230001 [1,0,1,0,0,0|2,0,0]=4 1013 B9R0.6 CCCC(=O)C(C)C(C)C 1458a_100000755409_100000210303 [1,0,1,0,0,0|0,0,2]=4 1014 B9R0.6 CCCC(C)C(C)N(C)C 270004a_100102631434_100011216282 [1,0,1,0,0,0|2,0,0]=4 1015 B9R0.6 CCCC(C)N(C)C(C)C 269982a_200000211004_100000766640 [1,0,1,0,0,0|2,0,0]=4 1016 B9R0.6 CCCC(C)N(C)C(C)C 270004a_200000211004_100000211909 [1,0,1,0,0,0|2,0,0]=4 1017 B9R0.6 CCCN(C)C(C)C(C)C 2230a_100000228512_100000210303 [1,0,1,0,0,0|2,0,0]=4 1018 B9R0.6 CCCN(C)C(C)C(C)C 2230a_200015185082_200000210301 [1,0,1,0,0,0|2,0,0]=4 1019 B9R0.6 CCCN(C)C(C)C(C)C 269982a_100000228512_100000210303 [1,0,1,0,0,0|2,0,0]=4 1020 B9R0.6 CCCN(C)C(C)C(C)C 269982a_200015185082_200000210301 [1,0,1,0,0,0|2,0,0]=4 1021 B9R0.6 CCCN([13CH3])C(C)C(C)C 2230a_200015185082_200025704644 [1,0,1,0,0,0|2,0,0]=4 1022 B9R0.6 CCCN([13CH3])C(C)C(C)C 269982a_200015185082_200025704644 [1,0,1,0,0,0|2,0,0]=4 1023 B9R0.6 CCC[C@H](O)C(=O)C(C)C 1458a_100009822183_100000210206 [1,0,1,0,0,0|1,0,1]=4 1024 B9R0.7 CC(=O)C(C)CCC(C)C 1458a_100000070787_100011261404 [1,0,1,0,0,0|1,0,1]=4 1025 B9R0.7 CC(C)C(C)NC[C@@H](C)O 2230a_100000211541_100009817552 [1,0,1,0,0,0|2,0,0]=4 1026 B9R0.7 CC(C)C(C)OC[C@@H](C)O 7a_100000748068_100009817552 [1,0,1,0,0,0|2,0,0]=4 1027 B9R0.7 CC(C)CCC(=O)C(C)C 1458a_100000181311_100000210206 [1,0,1,0,0,0|0,0,2]=4 1028 B9R0.7 CC(C)CCC(=O)C(C)C 1458a_100000210198_100000210312 [1,0,1,0,0,0|0,0,2]=4 1029 B9R0.7 CC(C)CCC(C)N(C)C 2230a_100102631434_100011261404 [1,0,1,0,0,0|1,0,0]=3 1030 B9R0.7 CC(C)CCC(C)N(C)C 269982a_100102631434_100011261404 [1,0,1,0,0,0|1,0,0]=3 1031 B9R0.7 CC(C)CCC(C)N(C)C 270004a_100102631434_100000210476 [1,0,1,0,0,0|1,0,0]=3 1032 B9R0.7 CC(C)CCN(C)C(C)C 2230a_100000742789_100000210206 [1,0,1,0,0,0|1,0,0]=3 1033 B9R0.7 CC(C)CCN(C)C(C)C 269982a_100000742789_100000210206 [1,0,1,0,0,0|1,0,0]=3 1034 B9R0.7 CC(C)CCN(C)C(C)C 269982a_200000211004_100000210312 [1,0,1,0,0,0|1,0,0]=3 1035 B9R0.7 CC(C)CNC(C)C(C)C 2230a_100000211541_100000210760 [1,0,1,0,0,0|1,0,0]=3 1036 B9R0.7 CC(C)CNC(C)C(C)C 270004a_100000211541_100000210432 [1,0,1,0,0,0|1,0,0]=3 1037 B9R0.7 CC(C)COC(C)C(C)C 7a_100000748068_100000210760 [1,0,1,0,0,0|1,0,0]=3 1038 B9R0.7 CC(C)N(C)CCN(C)C 269982a_100000225618_100000210206 [1,0,1,0,0,0|2,0,0]=4 1039 B9R0.7 CC(C)N(C)CCN(C)C 269982a_200000211004_100000755713 [1,0,1,0,0,0|2,0,0]=4 1040 B9R0.7 CC(C)NCC(O)C(C)C 2230a_100000759067_100000210206 [1,0,1,0,0,0|1,0,0]=3 1041 B9R0.7 CC(C)NCC(O)C(C)C 34a_100000759067_100000210206 [1,0,1,0,0,0|1,0,0]=3 1042 B9R0.7 CC(C)OCN(C)C(C)C 269982a_200000211004_100000709892 [1,0,1,0,0,0|2,0,0]=4 1043 B9R0.7 CC(C)OC[C@H](N)C(C)C 34a_100011830312_100000210206 [1,0,1,0,0,0|2,0,0]=4 1044 B9R0.7 CC(O)CCN(C)C(C)C 269982a_200000211004_100012276601 [1,0,1,0,0,0|2,0,0]=4 1045 B9R0.7 CC(O)CNC(C)C(C)C 2230a_100000211541_100011218427 [1,0,1,0,0,0|2,0,0]=4 1046 B9R0.7 CC(O)COC(C)C(C)C 7a_100000748068_100011218427 [1,0,1,0,0,0|2,0,0]=4 1047 B9R0.23 CCC(=O)[C@@H](O)CC(C)C 1458a_100012027011_100000210202 [1,0,1,0,0,0|1,0,1]=4 1048 B9R0.23 CCC(C)C(=O)CC(C)C 1458a_100000210554_100000758301 [1,0,1,0,0,0|0,0,2]=4 1049 B9R0.23 CCC(C)C(=O)CC(C)C 1458a_100011192722_100000210624 [1,0,1,0,0,0|0,0,2]=4 1050 B9R0.23 CCC(C)C(C)OC(C)C 7a_100011215189_100000210206 [1,0,1,0,0,0|2,0,0]=4 1051 B9R0.23 CCC(C)N(C)CC(C)C 2230a_100000741768_100000210760 [1,0,1,0,0,0|2,0,0]=4 1052 B9R0.23 CCC(C)N(C)CC(C)C 2230a_100000747067_100000758301 [1,0,1,0,0,0|2,0,0]=4 1053 B9R0.23 CCC(C)N(C)CC(C)C 269982a_100000741768_100000210624 [1,0,1,0,0,0|2,0,0]=4 1054 B9R0.23 CCC(C)N(C)CC(C)C 269982a_100000747067_100000758301 [1,0,1,0,0,0|2,0,0]=4 1055 B9R0.23 CCC(C)N(C)CC(C)C 270004a_100000741768_100000210432 [1,0,1,0,0,0|2,0,0]=4 1056 B9R0.23 CCN(C)C(C)CC(C)C 2230a_100000225621_100000731052 [1,0,1,0,0,0|2,0,0]=4 1057 B9R0.23 CCN(C)C(C)CC(C)C 2230a_100000745462_100000210202 [1,0,1,0,0,0|2,0,0]=4 1058 B9R0.23 CCN(C)C(C)CC(C)C 269982a_100000225621_100000731052 [1,0,1,0,0,0|2,0,0]=4 1059 B9R0.23 CCN(C)C(C)CC(C)C 269982a_100000745462_100000204670 [1,0,1,0,0,0|2,0,0]=4 1060 B9R0.53 CC(C)CC(=O)CC(C)C 1458a_100000210554_100000210624 [1,0,1,0,0,0|0,0,2]=4 1061 B9R0.53 CC(C)CC(C)NC(C)C 2230a_100000692259_100000210206 [1,0,1,0,0,0|2,0,0]=4 1062 B9R0.53 CC(C)CC(C)NC(C)C 2230a_100138425928_100000731052 [1,0,1,0,0,0|2,0,0]=4 1063 B9R0.53 CC(C)CC(C)NC(C)C 34a_100138425928_100000731052 [1,0,1,0,0,0|2,0,0]=4 1064 B9R0.53 CC(C)CC(C)OC(C)C 34a_100000211805_100000210206 [1,0,1,0,0,0|2,0,0]=4 1065 B9R0.53 CC(C)CC(C)OC(C)C 34a_100000212225_100000731052 [1,0,1,0,0,0|2,0,0]=4 1066 B9R0.53 CC(C)CC(C)OC(C)C 7a_100000211805_100000210206 [1,0,1,0,0,0|2,0,0]=4 1067 B9R0.53 CC(C)CC(C)SC(C)C 62a_100000210206_100000731052 [1,0,1,0,0,0|2,0,0]=4 1068 B9R0.53 CC(C)CC(C)SC(C)C 62a_100000731052_100000210206 [1,0,1,0,0,0|2,0,0]=4 1069 B9R0.53 CC(C)CN(C)CC(C)C 2230a_100000201412_200000210301 [1,0,1,0,0,0|2,0,0]=4 1070 B9R0.53 CC(C)CN(C)CC(C)C 2230a_100000747067_100000210760 [1,0,1,0,0,0|2,0,0]=4 1071 B9R0.53 CC(C)CN(C)CC(C)C 269982a_100000201412_200000210301 [1,0,1,0,0,0|2,0,0]=4 1072 B9R0.53 CC(C)CN(C)CC(C)C 269982a_100000747067_100000210624 [1,0,1,0,0,0|2,0,0]=4 1073 B9R0.53 CC(C)CN(C)CC(C)C 270004a_100000747067_100000210432 [1,0,1,0,0,0|2,0,0]=4 1074 B9R0.53 CC(C)CN(C)CC(C)C 34a_100000201412_200000210301 [1,0,1,0,0,0|2,0,0]=4 1075 B9R0.53 CC(C)CN([13CH3])CC(C)C 2230a_100000201412_200025704644 [1,0,1,0,0,0|2,0,0]=4 1076 B9R0.53 CC(C)CN([13CH3])CC(C)C 269982a_100000201412_200025704644 [1,0,1,0,0,0|2,0,0]=4 1077 B9R0.53 CC(C)CN([13CH3])CC(C)C 34a_100000201412_200025704644 [1,0,1,0,0,0|2,0,0]=4 1078 B9R0.13 CC(C)C(CO)CNCF 34a_100000692819_100015361967 [1,0,1,0,0,0|2,0,0]=4 1079 B9R0.13 CC(C)[C@H](CO)NCCF 2230a_100011830312_100011217306 [1,0,1,0,0,0|2,0,0]=4 1080 B9R0.13 CC(C)[C@H](CO)NCCF 34a_100011830312_100011217306 [1,0,1,0,0,0|2,0,0]=4 1081 B9R0.13 CC(C)[C@H](CO)NCCO 2230a_100011830312_100000211926 [1,0,1,0,0,0|2,0,0]=4 1082 B9R0.13 CC(C)[C@H](CO)NCCO 34a_100011830312_100000211926 [1,0,1,0,0,0|2,0,0]=4 1083 B9R0.13 CCC(COCF)C(C)C 34a_100011995916_100015361967 [1,0,1,0,0,0|2,0,0]=4 1084 B9R0.13 CCC(COCF)C(C)C 7a_100011995916_100015361967 [1,0,1,0,0,0|2,0,0]=4 1085 B9R0.13 CCC(NCCO)C(C)C 270004a_100000210304_100000210600 [1,0,1,0,0,0|2,0,0]=4 1086 B9R0.13 CCC(OCCF)C(C)C 34a_100011218073_100011217306 [1,0,1,0,0,0|2,0,0]=4 1087 B9R0.13 CCC(OCCF)C(C)C 7a_100011218073_100011217306 [1,0,1,0,0,0|2,0,0]=4 1088 B9R0.13 CCC(OCCO)C(C)C 34a_100011218073_100000211926 [1,0,1,0,0,0|2,0,0]=4 1089 B9R0.13 CCC(OCCO)C(C)C 7a_100011218073_100000211926 [1,0,1,0,0,0|2,0,0]=4 1090 B9R0.13 CCC(OCSC)C(C)C 34a_100011218073_100011218213 [1,0,1,0,0,0|2,0,0]=4 1091 B9R0.13 CCCCC(CC)C(=O)C 1458a_100000070787_200011216223 [1,0,1,0,0,0|0,0,2]=4 1092 B9R0.13 CCCCC(CC)C(=O)C 1458a_100000211130_200000210301 [1,0,1,0,0,0|0,0,2]=4 1093 B9R0.13 CCCCC(CC)C(=O)[13CH3] 1458a_100000211130_200025704644 [1,0,1,0,0,0|0,0,2]=4 1094 B9R0.13 CCCCC(CC)N(C)C 269982a_100102631434_200011216223 [1,0,1,0,0,0|1,0,0]=3 1095 B9R0.13 CCCCC(CC)N(C)C 270004a_100102631434_100000753412 [1,0,1,0,0,0|1,0,0]=3 1096 B9R0.13 CCCCC(NC)C(C)C 270004a_106832991635_200011215219 [1,0,1,0,0,0|1,0,0]=3 1097 B9R0.13 CCCCN(CC)C(C)C 2230a_100000207398_100000210202 [1,0,1,0,0,0|1,0,0]=3 1098 B9R0.13 CCCCN(CC)C(C)C 2230a_100000207695_100000210206 [1,0,1,0,0,0|1,0,0]=3 1099 B9R0.13 CCCCN(CC)C(C)C 2230a_100000223864_100000210211 [1,0,1,0,0,0|1,0,0]=3 1100 B9R0.13 CCCCN(CC)C(C)C 269982a_100000207398_100000204670 [1,0,1,0,0,0|1,0,0]=3 1101 B9R0.13 CCCCN(CC)C(C)C 269982a_100000207695_100000210206 [1,0,1,0,0,0|1,0,0]=3 1102 B9R0.13 CCCCN(CC)C(C)C 269982a_100000223864_100000210211 [1,0,1,0,0,0|1,0,0]=3 1103 B9R0.13 CCCCN(CF)C(C)C 269982a_100000207398_100015361967 [1,0,1,0,0,0|2,0,0]=4 1104 B9R0.13 CCCNC(CC)C(C)C 270004a_100020643023_100000210600 [1,0,1,0,0,0|1,0,0]=3 1105 B9R0.13 CCCN[C@@H](CC)[C@@H](C)O 2230a_100161114882_100000210303 [1,0,1,0,0,0|1,0,0]=3 1106 B9R0.13 CCCN[C@@H](CC)[C@@H](C)O 34a_100161114882_100000210303 [1,0,1,0,0,0|1,0,0]=3 1107 B9R0.13 CCCN[C@@H](CO)C(C)C 2230a_100011830312_100000210303 [1,0,1,0,0,0|1,0,0]=3 1108 B9R0.13 CCCN[C@@H](CO)C(C)C 34a_100011830312_100000210303 [1,0,1,0,0,0|1,0,0]=3 1109 B9R0.13 CCCN[C@H](CO)[C@@H](C)O 2230a_100015196842_100000210303 [1,0,1,0,0,0|2,0,0]=4 1110 B9R0.13 CCCN[C@H](CO)[C@@H](C)O 34a_100015196842_100000210303 [1,0,1,0,0,0|2,0,0]=4 1111 B9R0.13 CCCOC(CC)C(C)C 34a_100011218073_100000210303 [1,0,1,0,0,0|1,0,0]=3 1112 B9R0.13 CCCOC(CC)C(C)C 7a_100011218073_100000210303 [1,0,1,0,0,0|1,0,0]=3 1113 B9R0.13 CCCOC(CN)C(C)C 34a_100000759067_100000210303 [1,0,1,0,0,0|2,0,0]=4 1114 B9R0.13 CCN(CCCF)C(C)C 2230a_100000223864_100011934791 [1,0,1,0,0,0|2,0,0]=4 1115 B9R0.13 CCN(CCCF)C(C)C 269982a_100000223864_100011934791 [1,0,1,0,0,0|2,0,0]=4 1116 B9R0.13 CCN(CCCO)C(C)C 2230a_100000182298_100000210202 [1,0,1,0,0,0|2,0,0]=4 1117 B9R0.13 CCN(CCCO)C(C)C 2230a_100000223864_100000230001 [1,0,1,0,0,0|2,0,0]=4 1118 B9R0.13 CCN(CCCO)C(C)C 269982a_100000182298_100000204670 [1,0,1,0,0,0|2,0,0]=4 1119 B9R0.13 CCN(CCCO)C(C)C 269982a_100000223864_100011215043 [1,0,1,0,0,0|2,0,0]=4 1120 B9R0.13 CCN(CCOC)C(C)C 2230a_100000223864_100011201679 [1,0,1,0,0,0|2,0,0]=4 1121 B9R0.13 CCN(CCOC)C(C)C 2230a_100000731262_100000210206 [1,0,1,0,0,0|2,0,0]=4 1122 B9R0.13 CCN(CCOC)C(C)C 2230a_200000223778_100000210202 [1,0,1,0,0,0|2,0,0]=4 1123 B9R0.13 CCN(CCOC)C(C)C 269982a_100000223864_100000233755 [1,0,1,0,0,0|2,0,0]=4 1124 B9R0.13 CCN(CCOC)C(C)C 269982a_100000731262_100000210206 [1,0,1,0,0,0|2,0,0]=4 1125 B9R0.13 CCN(CCOC)C(C)C 269982a_200000223778_100000204670 [1,0,1,0,0,0|2,0,0]=4 1126 B9R0.13 CCN(CCSC)C(C)C 2230a_100000223864_100000751147 [1,0,1,0,0,0|2,0,0]=4 1127 B9R0.13 CCN(CCSC)C(C)C 269982a_100000223864_100000212216 [1,0,1,0,0,0|2,0,0]=4 1128 B9R0.13 CCNCC(CC)C(C)C 269862a_100015525214_100011214906 [1,0,1,0,0,0|1,0,0]=3 1129 B9R0.13 CCNCC(CO)C(C)C 34a_100000692819_100000210202 [1,0,1,0,0,0|1,0,0]=3 1130 B9R0.13 CCOCC(CC)C(C)C 34a_100011995916_100000210202 [1,0,1,0,0,0|1,0,0]=3 1131 B9R0.13 CCOCC(CC)C(C)C 7a_100011995916_100000210202 [1,0,1,0,0,0|1,0,0]=3 1132 B9R0.13 CCOCC(CN)C(C)C 34a_100000692819_100000210202 [1,0,1,0,0,0|2,0,0]=4 1133 B9R0.13 CCOCN(CC)C(C)C 269982a_100000223864_100000739092 [1,0,1,0,0,0|2,0,0]=4 1134 B9R0.13 CC[C@H](NCCF)[C@@H](C)O 2230a_100161114882_100011217306 [1,0,1,0,0,0|2,0,0]=4 1135 B9R0.13 CC[C@H](NCCF)[C@@H](C)O 34a_100161114882_100011217306 [1,0,1,0,0,0|2,0,0]=4 1136 B9R0.13 CC[C@H](NCCO)[C@@H](C)O 2230a_100161114882_100000211926 [1,0,1,0,0,0|2,0,0]=4 1137 B9R0.13 CC[C@H](NCCO)[C@@H](C)O 34a_100161114882_100000211926 [1,0,1,0,0,0|2,0,0]=4 1138 B9R0.13 CC[C@H](NCOC)[C@@H](C)O 2230a_100161114882_100000766300 [1,0,1,0,0,0|2,0,0]=4 1139 B9R0.13 CC[C@H](NCSC)[C@@H](C)O 2230a_100161114882_100011218213 [1,0,1,0,0,0|2,0,0]=4 1140 B9R0.13 CC[C@H](NCSC)[C@@H](C)O 34a_100161114882_100011218213 [1,0,1,0,0,0|2,0,0]=4 1141 B9R0.13 COCN[C@@H](CO)C(C)C 2230a_100011830312_100000766300 [1,0,1,0,0,0|2,0,0]=4 1142 B9R0.13 CSCN[C@@H](CO)C(C)C 2230a_100011830312_100011218213 [1,0,1,0,0,0|2,0,0]=4 1143 B9R0.13 CSCN[C@@H](CO)C(C)C 34a_100011830312_100011218213 [1,0,1,0,0,0|2,0,0]=4 1144 B9R0.33 CCCN(C(C)C)C(C)C 2230a_100000086832_100000210303 [1,0,1,0,0,0|2,0,0]=4 1145 B9R0.33 CCCN(C(C)C)C(C)C 2230a_106256033942_100000210206 [1,0,1,0,0,0|2,0,0]=4 1146 B9R0.33 CCCN(C(C)C)C(C)C 269982a_100000086832_100000210303 [1,0,1,0,0,0|2,0,0]=4 1147 B9R0.33 CCCN(C(C)C)C(C)C 269982a_106256033942_100000210206 [1,0,1,0,0,0|2,0,0]=4 1148 B9R0.33 CCCN(C(C)C)C(C)C 34a_100000086832_100000210303 [1,0,1,0,0,0|2,0,0]=4 1149 B9R0.33 CCNC(C(C)C)C(C)C 2230a_100000690608_100000210202 [1,0,1,0,0,0|2,0,0]=4 1150 B9R0.33 CCNC(C(C)C)C(C)C 34a_100000690608_100000210202 [1,0,1,0,0,0|2,0,0]=4 1151 B9R0.33 CCOC(C(C)C)C(C)C 34a_100011216681_100000210202 [1,0,1,0,0,0|2,0,0]=4 1152 B9R0.33 CCOC(C(C)C)C(C)C 7a_100011216681_100000210202 [1,0,1,0,0,0|2,0,0]=4 1153 B9R0.4 CC(C)C[C@H](N)CCO[13CH3] 34a_100161151251_200025704644 [1,0,1,0,0,0|2,0,0]=4 1154 B9R0.4 CCCCC(=O)CC(C)C 1458a_100000210183_100000210624 [1,0,1,0,0,0|0,0,2]=4 1155 B9R0.4 CCCCC(=O)CC(C)C 1458a_100000210554_100000210211 [1,0,1,0,0,0|0,0,2]=4 1156 B9R0.4 CCCCC(C)NC(C)C 2230a_100000126638_100000210206 [1,0,1,0,0,0|2,0,0]=4 1157 B9R0.4 CCCCC(C)NC(C)C 2230a_100138425928_200011215066 [1,0,1,0,0,0|2,0,0]=4 1158 B9R0.4 CCCCC(C)NC(C)C 34a_100138425928_200011215066 [1,0,1,0,0,0|2,0,0]=4 1159 B9R0.4 CCCCC(C)OC(C)C 34a_100000212225_200011215066 [1,0,1,0,0,0|2,0,0]=4 1160 B9R0.4 CCCCC(C)OC(C)C 34a_100000687866_100000210206 [1,0,1,0,0,0|2,0,0]=4 1161 B9R0.4 CCCCC(C)OC(C)C 7a_100000687866_100000210206 [1,0,1,0,0,0|2,0,0]=4 1162 B9R0.4 CCCCC(C)SC(C)C 62a_100000210206_200011215066 [1,0,1,0,0,0|2,0,0]=4 1163 B9R0.4 CCCCC(C)SC(C)C 62a_200011215066_100000210206 [1,0,1,0,0,0|2,0,0]=4 1164 B9R0.4 CCCCN(C)CC(C)C 2230a_100000207549_100000210760 [1,0,1,0,0,0|2,0,0]=4 1165 B9R0.4 CCCCN(C)CC(C)C 2230a_100000747067_100000210211 [1,0,1,0,0,0|2,0,0]=4 1166 B9R0.4 CCCCN(C)CC(C)C 269982a_100000207549_100000210624 [1,0,1,0,0,0|2,0,0]=4 1167 B9R0.4 CCCCN(C)CC(C)C 269982a_100000747067_100000210211 [1,0,1,0,0,0|2,0,0]=4 1168 B9R0.4 CCCCN(C)CC(C)C 270004a_100000207549_100000210432 [1,0,1,0,0,0|2,0,0]=4 1169 B9R0.4 CCCNC(C)CC(C)C 2230a_100000692259_100000210303 [1,0,1,0,0,0|2,0,0]=4 1170 B9R0.4 CCCOC(C)CC(C)C 34a_100000210258_100000731052 [1,0,1,0,0,0|2,0,0]=4 1171 B9R0.4 CCCOC(C)CC(C)C 34a_100000211805_100000210303 [1,0,1,0,0,0|2,0,0]=4 1172 B9R0.4 CCCOC(C)CC(C)C 7a_100000211805_100000210303 [1,0,1,0,0,0|2,0,0]=4 1173 B9R0.4 CCCSC(C)CC(C)C 62a_100000210303_100000731052 [1,0,1,0,0,0|2,0,0]=4 1174 B9R0.4 CCCSC(C)CC(C)C 62a_100000731052_100000210303 [1,0,1,0,0,0|2,0,0]=4 1175 B9R0.4 CCOC[C@@H](N)CC(C)C 34a_100011830311_100000210202 [1,0,1,0,0,0|2,0,0]=4 1176 B9R0.4 COCC[C@@H](N)CC(C)C 34a_100161151251_200000210301 [1,0,1,0,0,0|2,0,0]=4 1177 B9R0.34 CCCC(=O)CC(C)CC 1458a_100000211992_100000748023 [1,0,1,0,0,0|0,0,2]=4 1178 B9R0.34 CCCC(=O)CC(C)CC 1458a_100000708755_100000210303 [1,0,1,0,0,0|0,0,2]=4 1179 B9R0.34 CCCC(=O)C[C@@H](C)CC 1458a_100000211992_100009816398 [1,0,1,0,0,0|0,0,2]=4 1180 B9R0.34 CCCC(C)CN(C)CC 2230a_100000225621_100011216630 [1,0,1,0,0,0|2,0,0]=4 1181 B9R0.34 CCCC(C)CN(C)CC 269982a_100000225621_100011216630 [1,0,1,0,0,0|2,0,0]=4 1182 B9R0.34 CCCC(C)NC(C)CC 2230a_100000209981_100000766640 [1,0,1,0,0,0|2,0,0]=4 1183 B9R0.34 CCCC(C)NC(C)CC 2230a_100000741246_100000758301 [1,0,1,0,0,0|2,0,0]=4 1184 B9R0.34 CCCC(C)NC(C)CC 270004a_100000209981_100000211909 [1,0,1,0,0,0|2,0,0]=4 1185 B9R0.34 CCCC(C)OC(C)CC 34a_100000764384_100011215416 [1,0,1,0,0,0|2,0,0]=4 1186 B9R0.34 CCCC(C)OC(C)CC 7a_100000210228_100000766640 [1,0,1,0,0,0|2,0,0]=4 1187 B9R0.34 CCCC(C)OC(C)CC 7a_100000764384_100000758301 [1,0,1,0,0,0|2,0,0]=4 1188 B9R0.34 CCCC(C)SC(C)CC 62a_100000758301_100000766640 [1,0,1,0,0,0|2,0,0]=4 1189 B9R0.34 CCCC(C)SC(C)CC 62a_100000766640_100000758301 [1,0,1,0,0,0|2,0,0]=4 1190 B9R0.34 CCCN(C)CC(C)CC 2230a_100000747261_100000748023 [1,0,1,0,0,0|2,0,0]=4 1191 B9R0.34 CCCN(C)CC(C)CC 2230a_100000753921_100000210303 [1,0,1,0,0,0|2,0,0]=4 1192 B9R0.34 CCCN(C)CC(C)CC 269982a_100000747261_100000748023 [1,0,1,0,0,0|2,0,0]=4 1193 B9R0.34 CCCN(C)CC(C)CC 269982a_100000753921_100000210303 [1,0,1,0,0,0|2,0,0]=4 1194 B9R0.34 CCCN(C)CC(C)CC 270004a_100000747261_100000243153 [1,0,1,0,0,0|2,0,0]=4 1195 B9R0.34 CCCN(C)C[C@@H](C)CC 2230a_100000747261_100009816398 [1,0,1,0,0,0|2,0,0]=4 1196 B9R0.34 CCCN(C)C[C@@H](C)CC 269982a_100000747261_100009816398 [1,0,1,0,0,0|2,0,0]=4 1197 B9R0.34 CCN(C)CC(O)COC 2230a_100000739405_100000210202 [1,0,1,0,0,0|2,0,0]=4 1198 B9R0.34 CCN(C)CC(O)COC 269982a_100000739405_100000204670 [1,0,1,0,0,0|2,0,0]=4 1199 B9R0.34 CCNC(C)CC(C)CC 2230a_100000763565_100000210202 [1,0,1,0,0,0|2,0,0]=4 1200 B9R0.34 CCNC(C)CC(C)CC 270004a_100015525214_100011710205 [1,0,1,0,0,0|2,0,0]=4 1201 B9R0.43 CC(C)CNC(CO)CO 2230a_100000759517_100000210760 [1,0,1,0,0,0|2,0,0]=4 1202 B9R0.43 CCC(CC)CNC(C)C 2230a_100102946423_100000210206 [1,0,1,0,0,0|2,0,0]=4 1203 B9R0.43 CCC(CC)CNC(C)C 2230a_100138425928_100011215472 [1,0,1,0,0,0|2,0,0]=4 1204 B9R0.43 CCC(CC)CNC(C)C 34a_100138425928_100011215472 [1,0,1,0,0,0|2,0,0]=4 1205 B9R0.43 CCC(CC)COC(C)C 34a_100000212225_100011215472 [1,0,1,0,0,0|2,0,0]=4 1206 B9R0.43 CCC(CC)COC(C)C 7a_100000703878_100000210206 [1,0,1,0,0,0|2,0,0]=4 1207 B9R0.43 CCC(CC)CSC(C)C 62a_100000210206_100011215472 [1,0,1,0,0,0|2,0,0]=4 1208 B9R0.43 CCC(CC)CSC(C)C 62a_100011215472_100000210206 [1,0,1,0,0,0|2,0,0]=4 1209 B9R0.43 CCC(CC)NCC(C)C 2230a_100000199018_100000210760 [1,0,1,0,0,0|2,0,0]=4 1210 B9R0.43 CCC(CC)NCC(C)C 270004a_100000199018_100000210432 [1,0,1,0,0,0|2,0,0]=4 1211 B9R0.43 CCC(CC)NCC(C)C 270004a_100000210953_100000210860 [1,0,1,0,0,0|2,0,0]=4 1212 B9R0.43 CCC(CC)OCC(C)C 7a_100000688536_100000210760 [1,0,1,0,0,0|2,0,0]=4 1213 B9R0.43 CCC(CC)SCC(C)C 62a_100000210505_100000210760 [1,0,1,0,0,0|2,0,0]=4 1214 B9R0.43 CCC(CC)SCC(C)C 62a_100000210624_100000210505 [1,0,1,0,0,0|2,0,0]=4 1215 B9R0.43 CCC(CCC(C)C)OC 34a_100011216567_200000210301 [1,0,1,0,0,0|2,0,0]=4 1216 B9R0.43 CCC(CCC(C)C)OC 7a_100011216567_200000210301 [1,0,1,0,0,0|2,0,0]=4 1217 B9R0.43 CCC(CCC(C)C)O[13CH3] 34a_100011216567_200025704644 [1,0,1,0,0,0|2,0,0]=4 1218 B9R0.43 CCC(CCC(C)C)O[13CH3] 7a_100011216567_200025704644 [1,0,1,0,0,0|2,0,0]=4 1219 B9R0.43 CCN(CC)CCC(C)C 2230a_100000207693_100000210202 [1,0,1,0,0,0|2,0,0]=4 1220 B9R0.43 CCN(CC)CCC(C)C 2230a_100000724800_100000210312 [1,0,1,0,0,0|2,0,0]=4 1221 B9R0.43 CCN(CC)CCC(C)C 269956a_100000042499_100000210312 [1,0,1,0,0,0|2,0,0]=4 1222 B9R0.43 CCN(CC)CCC(C)C 269982a_100000207693_100000204670 [1,0,1,0,0,0|2,0,0]=4 1223 B9R0.43 CCN(CC)CCC(C)C 269982a_100000724800_100000210312 [1,0,1,0,0,0|2,0,0]=4 1224 B9R0.43 CCN(CF)CCC(C)C 269982a_100000207693_100015361967 [1,0,1,0,0,0|2,0,0]=4 1225 B9R0.43 CC[C@@H](CO)NCC(C)C 2230a_100000709445_100000210760 [1,0,1,0,0,0|1,0,0]=3 1226 B9R0.43 CC[C@@H](CO)NCC(C)C 270004a_100000709445_100000210432 [1,0,1,0,0,0|1,0,0]=3 1227 B9R0.43 CC[C@@H](CO)NCC(C)O 2230a_100000709445_100011218427 [1,0,1,0,0,0|2,0,0]=4 1228 B9R0.43 CC[C@@H](CO)NC[C@@H](C)O 2230a_100000709445_100009817552 [1,0,1,0,0,0|2,0,0]=4 1229 B9R0.29 CCC(C)N(CC)C(C)C 2230a_100000223864_100000758301 [1,0,1,0,0,0|2,0,0]=4 1230 B9R0.29 CCC(C)N(CC)C(C)C 2230a_100000732650_100000210206 [1,0,1,0,0,0|2,0,0]=4 1231 B9R0.29 CCC(C)N(CC)C(C)C 269982a_100000223864_100000758301 [1,0,1,0,0,0|2,0,0]=4 1232 B9R0.29 CCC(C)N(CC)C(C)C 269982a_100000732650_100000210206 [1,0,1,0,0,0|2,0,0]=4 1233 B9R0.37 CCCC(=O)C(CC)CC 1458a_100000211163_100000210303 [1,0,1,0,0,0|0,0,2]=4 1234 B9R0.37 CCCC(=O)C(CC)CC 1458a_100000211992_100000210505 [1,0,1,0,0,0|0,0,2]=4 1235 B9R0.37 CCCC(C)C(CC)OC 34a_200011218412_200000210301 [1,0,1,0,0,0|2,0,0]=4 1236 B9R0.37 CCCC(C)C(CC)OC 7a_200011218412_200000210301 [1,0,1,0,0,0|2,0,0]=4 1237 B9R0.37 CCCC(C)C(CC)O[13CH3] 34a_200011218412_200025704644 [1,0,1,0,0,0|2,0,0]=4 1238 B9R0.37 CCCC(C)C(CC)O[13CH3] 7a_200011218412_200025704644 [1,0,1,0,0,0|2,0,0]=4 1239 B9R0.37 CCCC(C)N(CC)CC 2230a_100000724800_100000766640 [1,0,1,0,0,0|2,0,0]=4 1240 B9R0.37 CCCC(C)N(CC)CC 269956a_100000042499_100000766640 [1,0,1,0,0,0|2,0,0]=4 1241 B9R0.37 CCCC(C)N(CC)CC 269982a_100000724800_100000766640 [1,0,1,0,0,0|2,0,0]=4 1242 B9R0.37 CCCC(C)N(CC)CC 270004a_100000724800_100000211909 [1,0,1,0,0,0|2,0,0]=4 1243 B9R0.37 CCCN(C)C(CC)CC 2230a_100000737045_100000210303 [1,0,1,0,0,0|2,0,0]=4 1244 B9R0.37 CCCN(C)C(CC)CC 2230a_100015185089_200000210301 [1,0,1,0,0,0|2,0,0]=4 1245 B9R0.37 CCCN(C)C(CC)CC 269982a_100000737045_100000210303 [1,0,1,0,0,0|2,0,0]=4 1246 B9R0.37 CCCN(C)C(CC)CC 269982a_100000747261_100000210505 [1,0,1,0,0,0|2,0,0]=4 1247 B9R0.37 CCCN(C)C(CC)CC 269982a_100015185089_200000210301 [1,0,1,0,0,0|2,0,0]=4 1248 B9R0.37 CCCN(C)C(CC)CC 270004a_100000747261_100000210860 [1,0,1,0,0,0|2,0,0]=4 1249 B9R0.37 CCCN([13CH3])C(CC)CC 2230a_100015185089_200025704644 [1,0,1,0,0,0|2,0,0]=4 1250 B9R0.37 CCCN([13CH3])C(CC)CC 269982a_100015185089_200025704644 [1,0,1,0,0,0|2,0,0]=4 1251 B9R0.37 CCNC(C)C(CC)CC 269862a_100015525214_100011393642 [1,0,1,0,0,0|2,0,0]=4 1252 B9R0.37 CCNC(C)C(CC)CC 270004a_100015525214_100011393642 [1,0,1,0,0,0|2,0,0]=4 1253 B9R1.1 CC1CCC(CC1)O[13CH3] 34a_100000210714_200025704644 [2,0,0,0,0,0|1,0,0]=3 1254 B9R1.1 CC1CCC(CC1)O[13CH3] 7a_100000210714_200025704644 [2,0,0,0,0,0|1,0,0]=3 1255 B9R1.1 CC1CCC(CC1)S[13CH3] 62a_200025704644_200011216234 [2,0,0,0,0,0|1,0,0]=3 1256 B9R1.1 CC1CCN(CC1)CF 269982a_100000188429_100015361967 [2,0,0,0,0,0|2,0,0]=4 1257 B9R1.1 CC1CCN(CC1)CF 34a_100000188429_100015361967 [2,0,0,0,0,0|2,0,0]=4 1258 B9R1.1 CCC1CCN(CC1)C 2230a_100000754474_200000210301 [2,0,0,0,0,0|1,0,0]=3 1259 B9R1.1 CCC1CCN(CC1)C 269982a_100000754474_200000210301 [2,0,0,0,0,0|1,0,0]=3 1260 B9R1.1 CCC1CCN(CC1)C 34a_100000754474_200000210301 [2,0,0,0,0,0|1,0,0]=3 1261 B9R1.1 CCC1CCN(CC1)[13CH3] 2230a_100000754474_200025704644 [2,0,0,0,0,0|1,0,0]=3 1262 B9R1.1 CCC1CCN(CC1)[13CH3] 269982a_100000754474_200025704644 [2,0,0,0,0,0|1,0,0]=3 1263 B9R1.1 CCC1CCN(CC1)[13CH3] 34a_100000754474_200025704644 [2,0,0,0,0,0|1,0,0]=3 1264 B9R1.1 CCN1CCC(CC1)C 2230a_100000188429_100000210202 [2,0,0,0,0,0|1,0,0]=3 1265 B9R1.1 CCN1CCC(CC1)C 269982a_100000188429_100000204670 [2,0,0,0,0,0|1,0,0]=3 1266 B9R1.1 CCN1CCC(CC1)C 34a_100000188429_100000210202 [2,0,0,0,0,0|1,0,0]=3 1267 B9R1.1 CCN1CCC(CC1)F 2230a_100015193889_100000210202 [2,0,0,0,0,0|2,0,0]=4 1268 B9R1.1 CCN1CCC(CC1)F 269982a_100015193889_100000204670 [2,0,0,0,0,0|2,0,0]=4 1269 B9R1.1 CCN1CCC(CC1)F 34a_100015193889_100000210202 [2,0,0,0,0,0|2,0,0]=4 1270 B9R1.1 CCN1CCC(CC1)O 2230a_100025773856_100000210202 [2,0,0,0,0,0|2,0,0]=4 1271 B9R1.1 CCN1CCC(CC1)O 269982a_100025773856_100000204670 [2,0,0,0,0,0|2,0,0]=4 1272 B9R1.1 CCN1CCN(CC1)C 2230a_100000188432_100000210202 [2,0,0,0,0,0|2,0,0]=4 1273 B9R1.1 CCN1CCN(CC1)C 2230a_100000210033_200000210301 [2,0,0,0,0,0|2,0,0]=4 1274 B9R1.1 CCN1CCN(CC1)C 269982a_100000188432_100000204670 [2,0,0,0,0,0|2,0,0]=4 1275 B9R1.1 CCN1CCN(CC1)C 269982a_100000210033_200000210301 [2,0,0,0,0,0|2,0,0]=4 1276 B9R1.1 CCN1CCN(CC1)[13CH3] 2230a_100000210033_200025704644 [2,0,0,0,0,0|2,0,0]=4 1277 B9R1.1 CCN1CCN(CC1)[13CH3] 269982a_100000210033_200025704644 [2,0,0,0,0,0|2,0,0]=4 1278 B9R1.1 CN1CCC(CC1)CF 2230a_100015203933_200000210301 [2,0,0,0,0,0|2,0,0]=4 1279 B9R1.1 CN1CCC(CC1)CF 269982a_100015203933_200000210301 [2,0,0,0,0,0|2,0,0]=4 1280 B9R1.1 CN1CCC(CC1)CF 34a_100015203933_200000210301 [2,0,0,0,0,0|2,0,0]=4 1281 B9R1.1 CN1CCC(CC1)CO 2230a_100000738675_200000210301 [2,0,0,0,0,0|2,0,0]=4 1282 B9R1.1 CN1CCC(CC1)CO 269982a_100000738675_200000210301 [2,0,0,0,0,0|2,0,0]=4 1283 B9R1.1 CN1CCC(CC1)CO 34a_100000738675_200000210301 [2,0,0,0,0,0|2,0,0]=4 1284 B9R1.1 CN1CCC(CC1)S[13CH3] 62a_200025704644_100011215917 [2,0,0,0,0,0|2,0,0]=4 1285 B9R1.1 CNC1CCC(CC1)C 270004a_106832991635_100000185489 [2,0,0,0,0,0|1,0,0]=3 1286 B9R1.1 CNC1CCC(CC1)C 34a_100102657272_200011216234 [2,0,0,0,0,0|1,0,0]=3 1287 B9R1.1 CNC1CCC(CC1)O 270004a_106832991635_100000764474 [2,0,0,0,0,0|2,0,0]=4 1288 B9R1.1 CNC1CCN(CC1)C 270004a_106832991635_100000210137 [2,0,0,0,0,0|2,0,0]=4 1289 B9R1.1 CN[C@H]1CC[C@@H](CC1)C 2230a_100020625639_200000210301 [2,0,0,0,0,0|1,0,0]=3 1290 B9R1.1 CN[C@H]1CC[C@@H](CC1)C 34a_100020625639_200000210301 [2,0,0,0,0,0|1,0,0]=3 1291 B9R1.1 COC1CCC(CC1)C 34a_100000210714_200000210301 [2,0,0,0,0,0|1,0,0]=3 1292 B9R1.1 COC1CCC(CC1)C 34a_100138415774_200011216234 [2,0,0,0,0,0|1,0,0]=3 1293 B9R1.1 COC1CCC(CC1)C 7a_100000210714_200000210301 [2,0,0,0,0,0|1,0,0]=3 1294 B9R1.1 COC1CCN(CC1)C 2230a_100000234800_200000210301 [2,0,0,0,0,0|2,0,0]=4 1295 B9R1.1 COC1CCN(CC1)C 269982a_100000234800_200000210301 [2,0,0,0,0,0|2,0,0]=4 1296 B9R1.1 COC1CCN(CC1)C 34a_100000234800_200000210301 [2,0,0,0,0,0|2,0,0]=4 1297 B9R1.1 COC1CCN(CC1)[13CH3] 2230a_100000234800_200025704644 [2,0,0,0,0,0|2,0,0]=4 1298 B9R1.1 COC1CCN(CC1)[13CH3] 269982a_100000234800_200025704644 [2,0,0,0,0,0|2,0,0]=4 1299 B9R1.1 COC1CCN(CC1)[13CH3] 34a_100000234800_200025704644 [2,0,0,0,0,0|2,0,0]=4 1300 B9R1.1 CO[C@H]1CC[C@H](CC1)N 34a_100020628982_200000210301 [2,0,0,0,0,0|2,0,0]=4 1301 B9R1.1 CSC1CCC(CC1)C 62a_200000210301_200011216234 [2,0,0,0,0,0|1,0,0]=3 1302 B9R1.1 CSC1CCN(CC1)C 2230a_100015202541_200000210301 [2,0,0,0,0,0|2,0,0]=4 1303 B9R1.1 CSC1CCN(CC1)C 269982a_100015202541_200000210301 [2,0,0,0,0,0|2,0,0]=4 1304 B9R1.1 CSC1CCN(CC1)C 34a_100015202541_200000210301 [2,0,0,0,0,0|2,0,0]=4 1305 B9R1.1 CSC1CCN(CC1)C 62a_200000210301_100011215917 [2,0,0,0,0,0|2,0,0]=4 1306 B9R1.1 CSC1CCN(CC1)[13CH3] 2230a_100015202541_200025704644 [2,0,0,0,0,0|2,0,0]=4 1307 B9R1.1 CSC1CCN(CC1)[13CH3] 269982a_100015202541_200025704644 [2,0,0,0,0,0|2,0,0]=4 1308 B9R1.1 CSC1CCN(CC1)[13CH3] 34a_100015202541_200025704644 [2,0,0,0,0,0|2,0,0]=4 1309 B9R1.1 C[C@H]1CC[C@@H](CC1)N[13CH3] 2230a_100020625639_200025704644 [2,0,0,0,0,0|1,0,0]=3 1310 B9R1.1 C[C@H]1CC[C@@H](CC1)N[13CH3] 34a_100020625639_200025704644 [2,0,0,0,0,0|1,0,0]=3 1311 B9R1.1 [13CH3]N1CCC(CC1)CF 2230a_100015203933_200025704644 [2,0,0,0,0,0|2,0,0]=4 1312 B9R1.1 [13CH3]N1CCC(CC1)CF 269982a_100015203933_200025704644 [2,0,0,0,0,0|2,0,0]=4 1313 B9R1.1 [13CH3]N1CCC(CC1)CF 34a_100015203933_200025704644 [2,0,0,0,0,0|2,0,0]=4 1314 B9R1.1 [13CH3]N1CCC(CC1)CO 2230a_100000738675_200025704644 [2,0,0,0,0,0|2,0,0]=4 1315 B9R1.1 [13CH3]N1CCC(CC1)CO 269982a_100000738675_200025704644 [2,0,0,0,0,0|2,0,0]=4 1316 B9R1.1 [13CH3]N1CCC(CC1)CO 34a_100000738675_200025704644 [2,0,0,0,0,0|2,0,0]=4 1317 B9R1.1 [13CH3]O[C@H]1CC[C@H](CC1)N 34a_100020628982_200025704644 [2,0,0,0,0,0|2,0,0]=4 1318 B9R1.6 CC(=O)C1CCCCC1 1458a_100000070787_100000210327 [2,0,0,0,0,0|1,0,1]=4 1319 B9R1.6 CC(=O)C1CCCCC1 1458a_100000210647_200000210301 [2,0,0,0,0,0|1,0,1]=4 1320 B9R1.6 CC(C)N1CCCOC1 2230a_100000131196_100000210206 [2,0,0,0,0,0|2,0,0]=4 1321 B9R1.6 CC(C)N1CCCOC1 269982a_100000131196_100000210206 [2,0,0,0,0,0|2,0,0]=4 1322 B9R1.6 CC(C)N1CCCOC1 34a_100000131196_100000210206 [2,0,0,0,0,0|2,0,0]=4 1323 B9R1.6 CC(C)N1CCOCC1 2230a_100015191051_100000210206 [2,0,0,0,0,0|2,0,0]=4 1324 B9R1.6 CC(C)N1CCOCC1 269982a_100015191051_100000210206 [2,0,0,0,0,0|2,0,0]=4 1325 B9R1.6 CC(C)N1CCOCC1 34a_100015191051_100000210206 [2,0,0,0,0,0|2,0,0]=4 1326 B9R1.6 CC(C)N1CCSCC1 2230a_100000737611_100000210206 [2,0,0,0,0,0|2,0,0]=4 1327 B9R1.6 CC(C)N1CCSCC1 269982a_100000737611_100000210206 [2,0,0,0,0,0|2,0,0]=4 1328 B9R1.6 CN(C)C1CCCCC1 2230a_100000207522_200000210301 [2,0,0,0,0,0|1,0,0]=3 1329 B9R1.6 CN(C)C1CCCCC1 269982a_100000207522_200000210301 [2,0,0,0,0,0|1,0,0]=3 1330 B9R1.6 CN(C)C1CCCCC1 269982a_100102631434_100000210327 [2,0,0,0,0,0|1,0,0]=3 1331 B9R1.6 CN(C)C1CCCCC1 270004a_100102631434_100000210434 [2,0,0,0,0,0|1,0,0]=3 1332 B9R1.6 CN(C)C1CCCCC1 34a_100000207522_200000210301 [2,0,0,0,0,0|1,0,0]=3 1333 B9R1.6 CN(C)C1CCCOC1 269982a_100102631434_100000693364 [2,0,0,0,0,0|2,0,0]=4 1334 B9R1.6 CN(C)C1CCCOC1 270004a_100102631434_100000753404 [2,0,0,0,0,0|2,0,0]=4 1335 B9R1.6 CN(C)C1CCCSC1 270004a_100102631434_100000057913 [2,0,0,0,0,0|2,0,0]=4 1336 B9R1.6 CN(C)C1CCNCC1 270004a_100102631434_100015192401 [2,0,0,0,0,0|2,0,0]=4 1337 B9R1.6 CN(C)C1CCOCC1 2230a_100020587155_200000210301 [2,0,0,0,0,0|2,0,0]=4 1338 B9R1.6 CN(C)C1CCOCC1 269982a_100020587155_200000210301 [2,0,0,0,0,0|2,0,0]=4 1339 B9R1.6 CN(C)C1CCOCC1 269982a_100102631434_100011324220 [2,0,0,0,0,0|2,0,0]=4 1340 B9R1.6 CN(C)C1CCOCC1 270004a_100102631434_100011217826 [2,0,0,0,0,0|2,0,0]=4 1341 B9R1.6 CN(C)C1CCOCC1 34a_100020587155_200000210301 [2,0,0,0,0,0|2,0,0]=4 1342 B9R1.6 CN(C)C1CCSCC1 2230a_100015184757_200000210301 [2,0,0,0,0,0|2,0,0]=4 1343 B9R1.6 CN(C)C1CCSCC1 269982a_100015184757_200000210301 [2,0,0,0,0,0|2,0,0]=4 1344 B9R1.6 CN(C)C1CCSCC1 269982a_100102631434_100000069128 [2,0,0,0,0,0|2,0,0]=4 1345 B9R1.6 CN(C)C1CCSCC1 270004a_100102631434_100000203788 [2,0,0,0,0,0|2,0,0]=4 1346 B9R1.6 CN(C)C1CCSCC1 34a_100015184757_200000210301 [2,0,0,0,0,0|2,0,0]=4 1347 B9R1.6 CN([13CH3])C1CCCCC1 2230a_100000207522_200025704644 [2,0,0,0,0,0|1,0,0]=3 1348 B9R1.6 CN([13CH3])C1CCCCC1 269982a_100000207522_200025704644 [2,0,0,0,0,0|1,0,0]=3 1349 B9R1.6 CN([13CH3])C1CCCCC1 34a_100000207522_200025704644 [2,0,0,0,0,0|1,0,0]=3 1350 B9R1.6 CN([13CH3])C1CCOCC1 2230a_100020587155_200025704644 [2,0,0,0,0,0|2,0,0]=4 1351 B9R1.6 CN([13CH3])C1CCOCC1 269982a_100020587155_200025704644 [2,0,0,0,0,0|2,0,0]=4 1352 B9R1.6 CN([13CH3])C1CCOCC1 34a_100020587155_200025704644 [2,0,0,0,0,0|2,0,0]=4 1353 B9R1.6 CN([13CH3])C1CCSCC1 2230a_100015184757_200025704644 [2,0,0,0,0,0|2,0,0]=4 1354 B9R1.6 CN([13CH3])C1CCSCC1 269982a_100015184757_200025704644 [2,0,0,0,0,0|2,0,0]=4 1355 B9R1.6 CN([13CH3])C1CCSCC1 34a_100015184757_200025704644 [2,0,0,0,0,0|2,0,0]=4 1356 B9R1.6 [13CH3]C(=O)C1CCCCC1 1458a_100000210647_200025704644 [2,0,0,0,0,0|1,0,1]=4 1357 B9R1.15 CC1CCCCC1N[13CH3] 2230a_100000211402_200025704644 [2,0,0,0,0,0|2,0,0]=4 1358 B9R1.15 CC1CCCCC1N[13CH3] 34a_100000211402_200025704644 [2,0,0,0,0,0|2,0,0]=4 1359 B9R1.15 CC1CCCCC1O[13CH3] 34a_100000211207_200025704644 [2,0,0,0,0,0|2,0,0]=4 1360 B9R1.15 CC1CCCCC1O[13CH3] 7a_100000211207_200025704644 [2,0,0,0,0,0|2,0,0]=4 1361 B9R1.15 CCC1CCCCN1C 2230a_100000210034_200000210301 [2,0,0,0,0,0|2,0,0]=4 1362 B9R1.15 CCC1CCCCN1C 269982a_100000210034_200000210301 [2,0,0,0,0,0|2,0,0]=4 1363 B9R1.15 CCC1CCCCN1C 34a_100000210034_200000210301 [2,0,0,0,0,0|2,0,0]=4 1364 B9R1.15 CCC1CCCCN1[13CH3] 2230a_100000210034_200025704644 [2,0,0,0,0,0|2,0,0]=4 1365 B9R1.15 CCC1CCCCN1[13CH3] 269982a_100000210034_200025704644 [2,0,0,0,0,0|2,0,0]=4 1366 B9R1.15 CCC1CCCCN1[13CH3] 34a_100000210034_200025704644 [2,0,0,0,0,0|2,0,0]=4 1367 B9R1.15 CCN1CCCCC1C 2230a_100000211376_100000210202 [2,0,0,0,0,0|2,0,0]=4 1368 B9R1.15 CCN1CCCCC1C 269982a_100000211376_100000204670 [2,0,0,0,0,0|2,0,0]=4 1369 B9R1.15 CCN1CCCCC1C 34a_100000211376_100000210202 [2,0,0,0,0,0|2,0,0]=4 1370 B9R1.15 CNC1CCCCC1C 2230a_100000211402_200000210301 [2,0,0,0,0,0|2,0,0]=4 1371 B9R1.15 CNC1CCCCC1C 269862a_106832991636_100000210921 [2,0,0,0,0,0|2,0,0]=4 1372 B9R1.15 CNC1CCCCC1C 270004a_106832991635_100000210921 [2,0,0,0,0,0|2,0,0]=4 1373 B9R1.15 CNC1CCCCC1C 34a_100000211402_200000210301 [2,0,0,0,0,0|2,0,0]=4 1374 B9R1.15 CNC1CCCCC1F 34a_100102657272_100015423560 [2,0,0,0,0,0|2,0,0]=4 1375 B9R1.15 CNC1CCCCC1O 34a_100102657272_100000038908 [2,0,0,0,0,0|1,0,0]=3 1376 B9R1.15 CN[C@@H]1CCCC[C@H]1F 2230a_100015195156_200000210301 [2,0,0,0,0,0|2,0,0]=4 1377 B9R1.15 CN[C@@H]1CCCC[C@H]1F 34a_100015195156_200000210301 [2,0,0,0,0,0|2,0,0]=4 1378 B9R1.15 CN[C@@H]1CCOC[C@@H]1O 2230a_100016994285_200000210301 [2,0,0,0,0,0|2,0,0]=4 1379 B9R1.15 CN[C@H]1COCC[C@@H]1O 2230a_100015739063_200000210301 [2,0,0,0,0,0|2,0,0]=4 1380 B9R1.15 COC1CCCCC1C 34a_100000211207_200000210301 [2,0,0,0,0,0|2,0,0]=4 1381 B9R1.15 COC1CCCCC1C 7a_100000211207_200000210301 [2,0,0,0,0,0|2,0,0]=4 1382 B9R1.15 COC1CCCCC1Cl 34a_100000038908_200000210301 [2,0,0,0,0,0|2,0,0]=4 1383 B9R1.15 COC1CCCCC1Cl 7a_100000038908_200000210301 [2,0,0,0,0,0|2,0,0]=4 1384 B9R1.15 COC1CCCCC1F 34a_100138415774_100015423560 [2,0,0,0,0,0|2,0,0]=4 1385 B9R1.15 COC1CCCCC1O 34a_100138415774_100000038908 [2,0,0,0,0,0|1,0,0]=3 1386 B9R1.15 CO[C@@H]1CCCC[C@H]1F 34a_100009816020_200000210301 [2,0,0,0,0,0|2,0,0]=4 1387 B9R1.15 CO[C@@H]1CCCC[C@H]1F 7a_100009816020_200000210301 [2,0,0,0,0,0|2,0,0]=4 1388 B9R1.15 CO[C@H]1CCCC[C@H]1N 34a_100015191688_200000210301 [2,0,0,0,0,0|2,0,0]=4 1389 B9R1.15 CSC1CCCCC1F 62a_100015423560_200000210301 [2,0,0,0,0,0|2,0,0]=4 1390 B9R1.15 CSC1CCCCC1F 62a_200000210301_100015423560 [2,0,0,0,0,0|2,0,0]=4 1391 B9R1.15 CSC1CCCCC1O 62a_100000038908_200000210301 [2,0,0,0,0,0|1,0,0]=3 1392 B9R1.15 CSC1CCCCC1O 62a_200000210301_100000038908 [2,0,0,0,0,0|1,0,0]=3 1393 B9R1.15 [13CH3]N[C@@H]1CCCC[C@H]1F 2230a_100015195156_200025704644 [2,0,0,0,0,0|2,0,0]=4 1394 B9R1.15 [13CH3]N[C@@H]1CCCC[C@H]1F 34a_100015195156_200025704644 [2,0,0,0,0,0|2,0,0]=4 1395 B9R1.15 [13CH3]N[C@@H]1CCOC[C@@H]1O 2230a_100016994285_200025704644 [2,0,0,0,0,0|2,0,0]=4 1396 B9R1.15 [13CH3]N[C@H]1COCC[C@@H]1O 2230a_100015739063_200025704644 [2,0,0,0,0,0|2,0,0]=4 1397 B9R1.15 [13CH3]OC1CCCCC1Cl 34a_100000038908_200025704644 [2,0,0,0,0,0|2,0,0]=4 1398 B9R1.15 [13CH3]OC1CCCCC1Cl 7a_100000038908_200025704644 [2,0,0,0,0,0|2,0,0]=4 1399 B9R1.15 [13CH3]O[C@@H]1CCCC[C@H]1F 34a_100009816020_200025704644 [2,0,0,0,0,0|2,0,0]=4 1400 B9R1.15 [13CH3]O[C@@H]1CCCC[C@H]1F 7a_100009816020_200025704644 [2,0,0,0,0,0|2,0,0]=4 1401 B9R1.15 [13CH3]O[C@H]1CCCC[C@H]1N 34a_100015191688_200025704644 [2,0,0,0,0,0|2,0,0]=4 1402 B9R1.15 [13CH3]SC1CCCCC1F 62a_100015423560_200025704644 [2,0,0,0,0,0|2,0,0]=4 1403 B9R1.15 [13CH3]SC1CCCCC1F 62a_200025704644_100015423560 [2,0,0,0,0,0|2,0,0]=4 1404 B9R1.15 [13CH3]SC1CCCCC1O 62a_100000038908_200025704644 [2,0,0,0,0,0|1,0,0]=3 1405 B9R1.15 [13CH3]SC1CCCCC1O 62a_200025704644_100000038908 [2,0,0,0,0,0|1,0,0]=3 1406 B9R1.69 CC1CCN(CC1O)C 2230a_100000696640_200000210301 [2,0,0,0,0,0|1,0,0]=3 1407 B9R1.69 CC1CCN(CC1O)C 269982a_100000696640_200000210301 [2,0,0,0,0,0|1,0,0]=3 1408 B9R1.69 CC1CCN(CC1O)[13CH3] 2230a_100000696640_200025704644 [2,0,0,0,0,0|1,0,0]=3 1409 B9R1.69 CC1CCN(CC1O)[13CH3] 269982a_100000696640_200025704644 [2,0,0,0,0,0|1,0,0]=3 1410 B9R1.69 CN1CC[C@H]([C@H](C1)O)O 2230a_100000690696_200000210301 [2,0,0,0,0,0|2,0,0]=4 1411 B9R1.69 CN1CC[C@H]([C@H](C1)O)O 269982a_100000690696_200000210301 [2,0,0,0,0,0|2,0,0]=4 1412 B9R1.69 [13CH3]N1CC[C@H]([C@H](C1)O)O 2230a_100000690696_200025704644 [2,0,0,0,0,0|2,0,0]=4 1413 B9R1.69 [13CH3]N1CC[C@H]([C@H](C1)O)O 269982a_100000690696_200025704644 [2,0,0,0,0,0|2,0,0]=4 1414 B11R0.1 CC(C)CC(=O)N[C@H](C)CCO 240690a_100000706166_100000210554 [0,1,1,0,0,0|1,0,1]=4 1415 B11R0.1 CC(C)CC(=O)N[C@H](C)CCO 527a_100000706166_100000210554 [0,1,1,0,0,0|1,0,1]=4 1416 B11R0.1 CC(C)CC(C)NC(C)CCO 2230a_100000692259_100009893172 [0,1,1,0,0,0|1,0,0]=3 1417 B11R0.1 CC(C)CC(C)N[C@H](C)CCO 2230a_100000706166_100000731052 [0,1,1,0,0,0|1,0,0]=3 1418 B11R0.1 CC(C)CC(C)N[C@H](C)CCO 34a_100000706166_100000731052 [0,1,1,0,0,0|1,0,0]=3 1419 B11R0.1 CC(C)CC(C)OC(C)CCBr 34a_100012276601_100000731052 [0,1,1,0,0,0|2,0,0]=4 1420 B11R0.1 CC(C)CC(C)OC(C)CCO 34a_100000211805_100009893172 [0,1,1,0,0,0|1,0,0]=3 1421 B11R0.1 CC(C)CC(C)OC(C)CCO 7a_100000211805_100009893172 [0,1,1,0,0,0|1,0,0]=3 1422 B11R0.1 CC(C)CC(C)SC(C)CCO 62a_100000731052_100009893172 [0,1,1,0,0,0|1,0,0]=3 1423 B11R0.1 CC(C)CC(C)SC(C)CCO 62a_100009893172_100000731052 [0,1,1,0,0,0|1,0,0]=3 1424 B11R0.1 CC(CCO)SC(C)CN(C)C 62a_100009893172_100020606517 [0,1,1,0,0,0|2,0,0]=4 1425 B11R0.1 CC(CCO)SC(C)CN(C)C 62a_100020606517_100009893172 [0,1,1,0,0,0|2,0,0]=4 1426 B11R0.1 CC(CN(C)C)CN(C)CCO 2230a_100000210263_100015348159 [0,1,1,0,0,0|2,0,0]=4 1427 B11R0.1 CC(CN(C)C)CN(C)CCO 269982a_100000210263_100015348159 [0,1,1,0,0,0|2,0,0]=4 1428 B11R0.1 CCCC(C)CC(=O)CC(C)C 1458a_100000210554_100011216630 [0,1,1,0,0,0|1,0,1]=4 1429 B11R0.1 CCCC(C)CC(=O)CC(C)C 1458a_100000748435_100000210624 [0,1,1,0,0,0|1,0,1]=4 1430 B11R0.1 CCCC(C)CN(C)CC(C)C 2230a_100000747067_100011216630 [0,1,1,0,0,0|2,0,0]=4 1431 B11R0.1 CCCC(C)CN(C)CC(C)C 269982a_100000747067_100011216630 [0,1,1,0,0,0|2,0,0]=4 1432 B11R0.1 CCCC(C)CN(C)CC(C)C 270004a_100000747067_100000243154 [0,1,1,0,0,0|2,0,0]=4 1433 B11R0.1 CCCC(C)NC(C)CC(C)C 2230a_100000692259_100000766640 [0,1,1,0,0,0|2,0,0]=4 1434 B11R0.1 CCCC(C)NC(C)CC(C)C 2230a_100000741246_100000731052 [0,1,1,0,0,0|2,0,0]=4 1435 B11R0.1 CCCC(C)NC(C)CC(C)C 270004a_100000692259_100000211909 [0,1,1,0,0,0|2,0,0]=4 1436 B11R0.1 CCCC(C)OC(C)CC(C)C 34a_100000211805_100000766640 [0,1,1,0,0,0|2,0,0]=4 1437 B11R0.1 CCCC(C)OC(C)CC(C)C 34a_100000764384_100000731052 [0,1,1,0,0,0|2,0,0]=4 1438 B11R0.1 CCCC(C)OC(C)CC(C)C 7a_100000211805_100000766640 [0,1,1,0,0,0|2,0,0]=4 1439 B11R0.1 CCCC(C)OC(C)CC(C)C 7a_100000764384_100000731052 [0,1,1,0,0,0|2,0,0]=4 1440 B11R0.1 CCCC(C)SC(C)CC(C)C 62a_100000731052_100000766640 [0,1,1,0,0,0|2,0,0]=4 1441 B11R0.1 CCCC(C)SC(C)CC(C)C 62a_100000766640_100000731052 [0,1,1,0,0,0|2,0,0]=4 1442 B11R0.6 CC(C)CCCC(=O)CC(C)O 1458a_100011216857_100011218427 [0,1,1,0,0,0|1,0,1]=4 1443 B11R0.6 CC(C)CCCC(=O)C[C@@H](C)O 1458a_100011933948_100011214892 [0,1,1,0,0,0|1,0,1]=4 1444 B11R0.6 CC(C)CCCC(C)NC(C)C 2230a_100000210607_100000210206 [0,1,1,0,0,0|2,0,0]=4 1445 B11R0.6 CC(C)CCCC(C)OC(C)C 34a_200011218570_100000210206 [0,1,1,0,0,0|2,0,0]=4 1446 B11R0.6 CC(C)CCCC(C)OC(C)C 7a_200011218570_100000210206 [0,1,1,0,0,0|2,0,0]=4 1447 B11R0.6 CC(C)CCCN(C)CC(=O)O 269956a_100000746989_100011214892 [0,1,1,0,0,0|1,0,1]=4 1448 B11R0.6 CC(C)CCCN(C)CC(C)C 2230a_100000747067_100011214892 [0,1,1,0,0,0|2,0,0]=4 1449 B11R0.6 CC(C)CCCN(C)CC(C)C 269982a_100000747067_100011214892 [0,1,1,0,0,0|2,0,0]=4 1450 B11R0.6 CC(C)CCCN(C)CC(C)O 2230a_100000227577_100011214892 [0,1,1,0,0,0|1,0,0]=3 1451 B11R0.6 CC(C)CCCN(C)CC(C)O 269982a_100000227577_100011214892 [0,1,1,0,0,0|1,0,0]=3 1452 B11R0.6 CC(C)CCNC(C)CC(C)C 2230a_100000692259_100000210312 [0,1,1,0,0,0|2,0,0]=4 1453 B11R0.6 CC(C)CCNC(C)CC(C)C 269862a_100000692259_100000185833 [0,1,1,0,0,0|2,0,0]=4 1454 B11R0.6 CC(C)CCOC(C)CC(C)C 34a_100000210254_100000731052 [0,1,1,0,0,0|2,0,0]=4 1455 B11R0.6 CC(C)CCOC(C)CC(C)C 34a_100000211805_100000210312 [0,1,1,0,0,0|2,0,0]=4 1456 B11R0.6 CC(C)CCOC(C)CC(C)C 7a_100000210254_100000731052 [0,1,1,0,0,0|2,0,0]=4 1457 B11R0.6 CC(C)CCOC(C)CC(C)C 7a_100000211805_100000210626 [0,1,1,0,0,0|2,0,0]=4 1458 B11R0.6 CC(C)CCSC(C)CC(C)C 62a_100000210312_100000731052 [0,1,1,0,0,0|2,0,0]=4 1459 B11R0.6 CC(C)CCSC(C)CC(C)C 62a_100000731052_100000210312 [0,1,1,0,0,0|2,0,0]=4 1460 B11R0.6 CC(O)CCCN(C)CC(C)O 2230a_100000227577_200000718107 [0,1,1,0,0,0|2,0,0]=4 1461 B11R0.6 CC(O)CCCN(C)CC(C)O 269982a_100000227577_200000718107 [0,1,1,0,0,0|2,0,0]=4 1462 B11R0.6 CC(O)CN(C)CCCN(C)C 269982a_100000225831_100011218427 [0,1,1,0,0,0|2,0,0]=4 1463 B11R0.6 CC(O)CN(C)CCCN(C)C 269982a_100000227577_100000757444 [0,1,1,0,0,0|2,0,0]=4 1464 B11R0.6 CC(O)CN(C)CCOC(C)C 2230a_100000227577_100000211751 [0,1,1,0,0,0|2,0,0]=4 1465 B11R0.6 CC(O)CN(C)CCOC(C)C 269982a_100000227577_100000211751 [0,1,1,0,0,0|2,0,0]=4 1466 B11R0.6 CC(O)CN(C)CCSC(C)C 2230a_100000227577_100000730970 [0,1,1,0,0,0|2,0,0]=4 1467 B11R0.6 CC(O)CN(C)CCSC(C)C 269982a_100000227577_100000730970 [0,1,1,0,0,0|2,0,0]=4 1468 B11R0.6 C[C@@H](O)CN(C)CCCN(C)C 269982a_100000225831_100009817552 [0,1,1,0,0,0|2,0,0]=4 1469 B11R0.45 CCCC(CC)NCCC(C)C 2230a_100000747048_100000210312 [0,1,1,0,0,0|2,0,0]=4 1470 B11R0.45 CCCC(CC)NCCC(C)C 269862a_100000747048_100000185833 [0,1,1,0,0,0|2,0,0]=4 1471 B11R0.45 CCCC(CC)NCCC(C)C 270004a_100000210545_100000687865 [0,1,1,0,0,0|2,0,0]=4 1472 B11R0.45 CCCC(CC)OCCC(C)C 34a_100000687864_100000210312 [0,1,1,0,0,0|2,0,0]=4 1473 B11R0.45 CCCC(CC)OCCC(C)C 7a_100000210254_100011219200 [0,1,1,0,0,0|2,0,0]=4 1474 B11R0.45 CCCC(CC)OCCC(C)C 7a_100000687864_100000210626 [0,1,1,0,0,0|2,0,0]=4 1475 B11R0.45 CCCC(CC)SCCC(C)C 62a_100000210312_100011219200 [0,1,1,0,0,0|2,0,0]=4 1476 B11R0.45 CCCC(CC)SCCC(C)C 62a_100011219200_100000210312 [0,1,1,0,0,0|2,0,0]=4 1477 B11R0.45 CCCC(CCOC(C)C)SC 34a_100000032865_100000210206 [0,1,1,0,0,0|2,0,0]=4 1478 B11R0.45 CCCC(CCOC(C)C)SC 7a_100000032865_100000210206 [0,1,1,0,0,0|2,0,0]=4 1479 B11R0.45 CCCN(CC)CCCC(C)C 2230a_100000226822_100011214892 [0,1,1,0,0,0|2,0,0]=4 1480 B11R0.45 CCCN(CC)CCCC(C)C 269982a_100000226822_100011214892 [0,1,1,0,0,0|2,0,0]=4 1481 B11R0.45 CCC[C@@H](CO)NCCC(C)C 2230a_100000732646_100000210312 [0,1,1,0,0,0|2,0,0]=4 1482 B11R0.45 CCC[C@@H](CO)NCCC(C)C 269862a_100000732646_100000185833 [0,1,1,0,0,0|2,0,0]=4 1483 B11R0.45 CCC[C@@H](CO)NCCC(C)C 34a_100000732646_100000210312 [0,1,1,0,0,0|2,0,0]=4 1484 B11R0.45 CCN(CCO)CCCC(C)C 2230a_100000210973_100011214892 [0,1,1,0,0,0|1,0,0]=3 1485 B11R0.45 CCN(CCO)CCCC(C)C 269982a_100000210973_100011214892 [0,1,1,0,0,0|1,0,0]=3 1486 B11R0.45 CCN(CCO)CCCC(C)O 2230a_100000210973_200000718107 [0,1,1,0,0,0|2,0,0]=4 1487 B11R0.45 CCN(CCO)CCCC(C)O 269982a_100000210973_200000718107 [0,1,1,0,0,0|2,0,0]=4 1488 B11R0.45 CCN(CCO)CCCN(C)C 269982a_100000210973_100000757444 [0,1,1,0,0,0|2,0,0]=4 1489 B11R0.45 CCN(CCO)CCCN(C)C 269982a_100000225837_100000211926 [0,1,1,0,0,0|2,0,0]=4 1490 B11R0.45 CCN(CCO)CCOC(C)C 2230a_100000210973_100000211751 [0,1,1,0,0,0|2,0,0]=4 1491 B11R0.45 CCN(CCO)CCOC(C)C 269982a_100000210973_100000211751 [0,1,1,0,0,0|2,0,0]=4 1492 B11R0.45 CCN(CCO)CCSC(C)C 2230a_100000210973_100000730970 [0,1,1,0,0,0|2,0,0]=4 1493 B11R0.45 CCN(CCO)CCSC(C)C 269982a_100000210973_100000730970 [0,1,1,0,0,0|2,0,0]=4 1494 B11R0.59 CC(C)CCC(=O)C(C)CCO 1458a_100000181311_100009893172 [0,1,1,0,0,0|0,0,1]=3 1495 B11R0.59 CC(C)CCC(=O)N(C)CCO 240690a_100000210263_100000181311 [0,1,1,0,0,0|1,0,1]=4 1496 B11R0.59 CC(C)CCC(=O)N(C)CCO 527a_100000210263_100000181311 [0,1,1,0,0,0|1,0,1]=4 1497 B11R0.59 CC(C)CCC(C)C(=O)CCO 1458a_100011216618_100011261404 [0,1,1,0,0,0|1,0,1]=4 1498 B11R0.59 CC(C)CCC(C)N(C)CCO 2230a_100000210263_100011261404 [0,1,1,0,0,0|1,0,0]=3 1499 B11R0.59 CC(C)CCC(C)N(C)CCO 269982a_100000210263_100011261404 [0,1,1,0,0,0|1,0,0]=3 1500 B11R0.59 CC(C)CCC(C)N(C)CCO 270004a_100000210263_100000210476 [0,1,1,0,0,0|1,0,0]=3 1501 B11R0.59 CC(C)CCN(C)C(C)CCO 2230a_100000731037_100000210312 [0,1,1,0,0,0|1,0,0]=3 1502 B11R0.59 CC(C)CCN(C)C(C)CCO 2230a_100000742789_100009893172 [0,1,1,0,0,0|1,0,0]=3 1503 B11R0.59 CC(C)CCN(C)C(C)CCO 269982a_100000731037_100000210312 [0,1,1,0,0,0|1,0,0]=3 1504 B11R0.59 CC(C)CCN(C)C(C)CCO 269982a_100000742789_100009893172 [0,1,1,0,0,0|1,0,0]=3 1505 B11R0.59 CC(C)OCC(=O)C(C)CCO 1458a_100000745533_100009893172 [0,1,1,0,0,0|1,0,1]=4 1506 B11R0.59 CC(C)OCN(C)C(C)CCO 2230a_100000731037_100000709892 [0,1,1,0,0,0|2,0,0]=4 1507 B11R0.59 CC(C)OCN(C)C(C)CCO 269982a_100000731037_100000709892 [0,1,1,0,0,0|2,0,0]=4 1508 B11R0.59 CC(C)SCC(=O)C(C)CCO 1458a_100000241585_100009893172 [0,1,1,0,0,0|1,0,1]=4 1509 B11R0.59 CC(CCO)C(=O)CC[S+](C)C 1458a_100009452791_100009893172 [0,1,1,0,0,0|1,0,1]=4 1510 B11R0.59 CC(CCO)N(C)CCN(C)C 269982a_100000225618_100009893172 [0,1,1,0,0,0|2,0,0]=4 1511 B11R0.59 CC(CCO)N(C)CCN(C)C 269982a_100000731037_100000755713 [0,1,1,0,0,0|2,0,0]=4 1512 B11R0.59 CC(O)CCN(C)C(C)CCO 2230a_100000731037_100012276601 [0,1,1,0,0,0|2,0,0]=4 1513 B11R0.59 CC(O)CCN(C)C(C)CCO 269982a_100000731037_100012276601 [0,1,1,0,0,0|2,0,0]=4 1514 B11R0.59 CCCC(C)C(=O)CCC(C)C 1458a_100000181311_100000766640 [0,1,1,0,0,0|1,0,1]=4 1515 B11R0.59 CCCC(C)C(=O)CCC(C)C 1458a_100000210906_100000210312 [0,1,1,0,0,0|1,0,1]=4 1516 B11R0.59 CCCC(C)C(C)NCC(C)C 270004a_100000210953_100011216282 [0,1,1,0,0,0|2,0,0]=4 1517 B11R0.59 CCCC(C)C(C)OCC(C)C 34a_100000708338_100000210624 [0,1,1,0,0,0|2,0,0]=4 1518 B11R0.59 CCCC(C)C(C)OCC(C)C 7a_100000708338_100000210760 [0,1,1,0,0,0|2,0,0]=4 1519 B11R0.59 CCCC(C)N(C)CCC(C)C 2230a_100000742789_100000766640 [0,1,1,0,0,0|2,0,0]=4 1520 B11R0.59 CCCC(C)N(C)CCC(C)C 269982a_100000742789_100000766640 [0,1,1,0,0,0|2,0,0]=4 1521 B11R0.59 CCCC(C)N(C)CCC(C)C 270004a_100000742789_100000211909 [0,1,1,0,0,0|2,0,0]=4 1522 B11R0.59 CCCN(C)C(C)CCC(C)C 2230a_100000747261_100011261404 [0,1,1,0,0,0|2,0,0]=4 1523 B11R0.59 CCCN(C)C(C)CCC(C)C 269982a_100000747261_100011261404 [0,1,1,0,0,0|2,0,0]=4 1524 B11R0.59 CCCN(C)C(C)CCC(C)C 270004a_100000747261_100000210476 [0,1,1,0,0,0|2,0,0]=4 1525 B11R0.104 CC(C)CCCC(C)(C)OCF 7a_100011215742_100015361967 [0,1,1,0,0,0|2,0,0]=4 1526 B11R0.104 CC(C)CCOC(C)(C)CCBr 7a_100000702414_100000210626 [0,1,1,0,0,0|2,0,0]=4 1527 B11R0.104 CC(C)CSC[N+](C)(C)CCO 62a_100000210624_200010270792 [0,1,1,0,0,0|2,0,0]=4 1528 B11R0.104 CC(C)CSC[N+](C)(C)CCO 62a_200010270792_100000210760 [0,1,1,0,0,0|2,0,0]=4 1529 B11R0.104 CCCC(C)(C)COCC(C)C 7a_100011995695_100000210760 [0,1,1,0,0,0|2,0,0]=4 1530 B11R0.104 CCCC(C)(C)OCCC(C)C 7a_100000748436_100000210626 [0,1,1,0,0,0|2,0,0]=4 1531 B11R0.104 CCOC(C)(C)CCCC(C)C 7a_100011215742_100000210202 [0,1,1,0,0,0|2,0,0]=4 1532 B11R0.141 CC(C)C(=O)CN[C@H](C)CCO 2230a_100000706166_100000753385 [0,1,1,0,0,0|1,0,1]=4 1533 B11R0.141 CC(C)C(=O)CN[C@H](C)CCO 34a_100000706166_100000753385 [0,1,1,0,0,0|1,0,1]=4 1534 B11R0.141 CC(CCO)NCC(O)C(C)C 2230a_100000759067_100009893172 [0,1,1,0,0,0|1,0,0]=3 1535 B11R0.141 CC(CCO)NCC(O)C(C)C 34a_100000759067_100009893172 [0,1,1,0,0,0|1,0,0]=3 1536 B11R0.141 CC(CCO)OC[C@H](N)C(C)C 34a_100011830312_100009893172 [0,1,1,0,0,0|1,0,0]=3 1537 B11R0.141 CC(CCO)SCC(=O)C(C)C 62a_100000753385_100009893172 [0,1,1,0,0,0|1,0,1]=4 1538 B11R0.141 CC(CCO)SCC(=O)C(C)C 62a_100009893172_100000753385 [0,1,1,0,0,0|1,0,1]=4 1539 B11R0.141 CCCC(C)CCC(C)N(C)C 270004a_100102631434_200011216527 [0,1,1,0,0,0|2,0,0]=4 1540 B11R0.141 CCCC(C)CNC(C)C(C)C 2230a_100000211541_100011216630 [0,1,1,0,0,0|2,0,0]=4 1541 B11R0.141 CCCC(C)CNC(C)C(C)C 270004a_100000211541_100000243154 [0,1,1,0,0,0|2,0,0]=4 1542 B11R0.141 CCCC(C)COC(C)C(C)C 7a_100000748068_100011216630 [0,1,1,0,0,0|2,0,0]=4 1543 B11R0.141 CCCC(C)NCC(O)C(C)C 2230a_100000759067_100000766640 [0,1,1,0,0,0|2,0,0]=4 1544 B11R0.141 CCCC(C)NCC(O)C(C)C 270004a_100000759067_100000211909 [0,1,1,0,0,0|2,0,0]=4 1545 B11R0.141 CCCC(C)NCC(O)C(C)C 34a_100000759067_100000766640 [0,1,1,0,0,0|2,0,0]=4 1546 B11R0.141 CCCC(C)OC[C@H](N)C(C)C 34a_100011830312_100000766640 [0,1,1,0,0,0|2,0,0]=4 1547 B11R0.145 CC(C)CCCC(=O)C(O)CO 1458a_100011215603_100011214892 [0,1,1,0,0,0|1,0,1]=4 1548 B11R0.145 CC(C)CCCN(C)C(C)CO 2230a_100000693034_100011214892 [0,1,1,0,0,0|1,0,0]=3 1549 B11R0.145 CC(C)CCCN(C)C(C)CO 269982a_100000693034_100011214892 [0,1,1,0,0,0|1,0,0]=3 1550 B11R0.145 CC(C)OCCN(C)C(C)CO 2230a_100000693034_100000211751 [0,1,1,0,0,0|2,0,0]=4 1551 B11R0.145 CC(C)OCCN(C)C(C)CO 269982a_100000693034_100000211751 [0,1,1,0,0,0|2,0,0]=4 1552 B11R0.145 CC(C)SCCN(C)C(C)CO 2230a_100000693034_100000730970 [0,1,1,0,0,0|2,0,0]=4 1553 B11R0.145 CC(C)SCCN(C)C(C)CO 269982a_100000693034_100000730970 [0,1,1,0,0,0|2,0,0]=4 1554 B11R0.145 CC(CO)N(C)CCCN(C)C 269982a_100000693034_100000757444 [0,1,1,0,0,0|2,0,0]=4 1555 B11R0.145 CC(O)CCCN(C)C(C)CO 2230a_100000693034_200000718107 [0,1,1,0,0,0|2,0,0]=4 1556 B11R0.145 CC(O)CCCN(C)C(C)CO 269982a_100000693034_200000718107 [0,1,1,0,0,0|2,0,0]=4 1557 B11R0.145 CCC(C)C(C)NCCC(C)C 269862a_100000210545_100000210599 [0,1,1,0,0,0|2,0,0]=4 1558 B11R0.145 CCC(C)C(C)NCCC(C)C 270004a_100000210545_100000210599 [0,1,1,0,0,0|2,0,0]=4 1559 B11R0.145 CCC(C)C(C)OCCC(C)C 7a_100011215189_100000210626 [0,1,1,0,0,0|2,0,0]=4 1560 B11R0.145 CCC(C)N(C)CCCC(C)C 2230a_100000741768_100011214892 [0,1,1,0,0,0|2,0,0]=4 1561 B11R0.145 CCC(C)N(C)CCCC(C)C 269982a_100000741768_100011214892 [0,1,1,0,0,0|2,0,0]=4 1562 B11R0.145 C[C@H](CO)N(C)CCCN(C)C 269982a_100000225831_100016084084 [0,1,1,0,0,0|2,0,0]=4 1563 B11R0.147 C#CCNC(C)CCCC(C)C 2230a_100000210607_100000038162 [0,1,1,0,0,0|1,0,1]=4 1564 B11R0.147 C#CCOC(C)CCCC(C)C 34a_200011218570_100000184674 [0,1,1,0,0,0|1,0,1]=4 1565 B11R0.147 C#CCOC(C)CCCC(C)C 7a_200011218570_100000038162 [0,1,1,0,0,0|1,0,1]=4 1566 B11R0.147 C=CCCC(C)NCCC(C)C 270004a_100000210545_100000762624 [0,1,1,0,0,0|2,0,0]=4 1567 B11R0.147 C=CCCC(C)OCCC(C)C 34a_100000765329_100000210312 [0,1,1,0,0,0|2,0,0]=4 1568 B11R0.147 C=CCCC(C)OCCC(C)C 7a_100000765329_100000210626 [0,1,1,0,0,0|2,0,0]=4 1569 B11R0.147 C=CCCN(C)CCCC(C)C 2230a_100020639649_100011214892 [0,1,1,0,0,0|2,0,0]=4 1570 B11R0.147 C=CCCN(C)CCCC(C)C 269982a_100020639649_100011214892 [0,1,1,0,0,0|2,0,0]=4 1571 B11R0.147 C=CCNC(C)CCCC(C)C 2230a_100000210607_100000210623 [0,1,1,0,0,0|1,0,1]=4 1572 B11R0.147 C=CCNC(C)CCCC(C)C 270004a_100020586998_100000753411 [0,1,1,0,0,0|1,0,1]=4 1573 B11R0.147 C=CCOC(C)CCCC(C)C 34a_200011218570_100015514636 [0,1,1,0,0,0|1,0,1]=4 1574 B11R0.147 C=CCOC(C)CCCC(C)C 7a_200011218570_100015514636 [0,1,1,0,0,0|1,0,1]=4 1575 B11R0.147 CC(=CCCC(C)CCO[13CH3])C 34a_100000017536_200025704644 [0,1,1,0,0,0|0,0,2]=4 1576 B11R0.147 CC(=CCCC(C)CCO[13CH3])C 7a_100000017536_200025704644 [0,1,1,0,0,0|0,0,2]=4 1577 B11R0.147 CC(=CCCC(C)NCCO)C 270004a_100000210304_100000765506 [0,1,1,0,0,0|0,0,2]=4 1578 B11R0.147 CC(=CCCC(C)OCCO)C 34a_100102619829_100000211926 [0,1,1,0,0,0|0,0,2]=4 1579 B11R0.147 CC(=CCCC(C)OCCO)C 7a_100102619829_100000211926 [0,1,1,0,0,0|0,0,2]=4 1580 B11R0.147 CC(C)CCCC(=O)CCCO 1458a_100011216857_100011215043 [0,1,1,0,0,0|1,0,1]=4 1581 B11R0.147 CC(C)CCCC(=O)NCCO 240690a_100000210304_100011216857 [0,1,1,0,0,0|1,0,1]=4 1582 B11R0.147 CC(C)CCCC(=O)NCCO 527a_100000210304_100011216857 [0,1,1,0,0,0|1,0,1]=4 1583 B11R0.147 CC(C)CCCC(C)CCN[13CH3] 2230a_102516457229_200025704644 [0,1,1,0,0,0|1,0,0]=3 1584 B11R0.147 CC(C)CCCC(C)CCO[13CH3] 34a_100000015991_200025704644 [0,1,1,0,0,0|0,0,0]=2 1585 B11R0.147 CC(C)CCCC(C)CCO[13CH3] 7a_100000015991_200025704644 [0,1,1,0,0,0|0,0,0]=2 1586 B11R0.147 CC(C)CCCC(C)CCS[13CH3] 62a_100009816328_200025704644 [0,1,1,0,0,0|0,1,0]=3 1587 B11R0.147 CC(C)CCCC(C)CCS[13CH3] 62a_200025704644_100009816328 [0,1,1,0,0,0|0,1,0]=3 1588 B11R0.147 CC(C)CCCC(C)NCC#N 2230a_100000210607_100011215382 [0,1,1,0,0,0|1,0,1]=4 1589 B11R0.147 CC(C)CCCC(C)NCC=O 2230a_100000210607_200015260668 [0,1,1,0,0,0|0,0,2]=4 1590 B11R0.147 CC(C)CCCC(C)NCCF 2230a_100000210607_100011217306 [0,1,1,0,0,0|1,0,0]=3 1591 B11R0.147 CC(C)CCCC(C)NCCO 2230a_100000210607_100000211926 [0,1,1,0,0,0|0,0,0]=2 1592 B11R0.147 CC(C)CCCC(C)NCCO 270004a_100000210304_100000753411 [0,1,1,0,0,0|0,0,0]=2 1593 B11R0.147 CC(C)CCCC(C)OCC#N 7a_200011218570_100011215382 [0,1,1,0,0,0|1,0,1]=4 1594 B11R0.147 CC(C)CCCC(C)OCC=O 34a_200011218570_200009817547 [0,1,1,0,0,0|0,0,2]=4 1595 B11R0.147 CC(C)CCCC(C)OCC=O 7a_200011218570_200015260668 [0,1,1,0,0,0|0,0,2]=4 1596 B11R0.147 CC(C)CCCC(C)OCCF 34a_200011218570_100011217306 [0,1,1,0,0,0|1,0,0]=3 1597 B11R0.147 CC(C)CCCC(C)OCCF 7a_200011218570_100011217306 [0,1,1,0,0,0|1,0,0]=3 1598 B11R0.147 CC(C)CCCC(C)OCCO 34a_200011218570_100000211926 [0,1,1,0,0,0|0,0,0]=2 1599 B11R0.147 CC(C)CCCC(C)OCCO 7a_200011218570_100000211926 [0,1,1,0,0,0|0,0,0]=2 1600 B11R0.147 CC(C)CCCN(C)CCC#N 2230a_100000184479_100011214892 [0,1,1,0,0,0|2,0,0]=4 1601 B11R0.147 CC(C)CCCN(C)CCCO 2230a_100000213112_100011214892 [0,1,1,0,0,0|1,0,0]=3 1602 B11R0.147 CC(C)CCCN(C)CCCO 269982a_100000213112_100011214892 [0,1,1,0,0,0|1,0,0]=3 1603 B11R0.147 CC(C)CCOC(C)CCCCl 34a_200000718107_100000210312 [0,1,1,0,0,0|2,0,0]=4 1604 B11R0.147 CC(C)CCOC(C)CCCCl 7a_200000718107_100000210626 [0,1,1,0,0,0|2,0,0]=4 1605 B11R0.147 CC(C)CNC[C@H](C)CCCO 2230a_100160569302_100000210760 [0,1,1,0,0,0|1,0,0]=3 1606 B11R0.147 CC(C)CNC[C@H](C)CCCO 270004a_100160569302_100000210432 [0,1,1,0,0,0|1,0,0]=3 1607 B11R0.147 CC(C)CNC[C@H](C)CCCO 34a_100160569302_100000210624 [0,1,1,0,0,0|1,0,0]=3 1608 B11R0.147 CC(C)OCCN(C)CCCO 2230a_100000213112_100000211751 [0,1,1,0,0,0|2,0,0]=4 1609 B11R0.147 CC(C)OCCN(C)CCCO 269982a_100000213112_100000211751 [0,1,1,0,0,0|2,0,0]=4 1610 B11R0.147 CC(C)SCCN(C)CCCO 2230a_100000213112_100000730970 [0,1,1,0,0,0|2,0,0]=4 1611 B11R0.147 CC(C)SCCN(C)CCCO 269982a_100000213112_100000730970 [0,1,1,0,0,0|2,0,0]=4 1612 B11R0.147 CC(CCOC(C)C)NCCO 270004a_100000210304_200011219172 [0,1,1,0,0,0|1,0,0]=3 1613 B11R0.147 CC(O)CCCN(C)CCCO 2230a_100000213112_200000718107 [0,1,1,0,0,0|2,0,0]=4 1614 B11R0.147 CC(O)CCCN(C)CCCO 269982a_100000213112_200000718107 [0,1,1,0,0,0|2,0,0]=4 1615 B11R0.147 CC(O)CNC[C@H](C)CCCO 2230a_100160569302_100011218427 [0,1,1,0,0,0|2,0,0]=4 1616 B11R0.147 CC(O)CNC[C@H](C)CCCO 34a_100160569302_100011218427 [0,1,1,0,0,0|2,0,0]=4 1617 B11R0.147 CCCCC(C)COCC(C)C 34a_100011995851_100000210624 [0,1,1,0,0,0|2,0,0]=4 1618 B11R0.147 CCCCC(C)COCC(C)C 7a_100011995851_100000210760 [0,1,1,0,0,0|2,0,0]=4 1619 B11R0.147 CCCCC(C)NCCC(C)C 2230a_100000126638_100000210312 [0,1,1,0,0,0|2,0,0]=4 1620 B11R0.147 CCCCC(C)NCCC(C)C 269862a_100000126638_100000185833 [0,1,1,0,0,0|2,0,0]=4 1621 B11R0.147 CCCCC(C)NCCC(C)C 270004a_100000210545_100000210087 [0,1,1,0,0,0|2,0,0]=4 1622 B11R0.147 CCCCC(C)OCCC(C)C 34a_100000210254_200011215066 [0,1,1,0,0,0|2,0,0]=4 1623 B11R0.147 CCCCC(C)OCCC(C)C 34a_100000687866_100000210312 [0,1,1,0,0,0|2,0,0]=4 1624 B11R0.147 CCCCC(C)OCCC(C)C 7a_100000210254_200011215066 [0,1,1,0,0,0|2,0,0]=4 1625 B11R0.147 CCCCC(C)OCCC(C)C 7a_100000687866_100000210626 [0,1,1,0,0,0|2,0,0]=4 1626 B11R0.147 CCCCC(C)SCCC(C)C 62a_100000210312_200011215066 [0,1,1,0,0,0|2,0,0]=4 1627 B11R0.147 CCCCC(C)SCCC(C)C 62a_200011215066_100000210312 [0,1,1,0,0,0|2,0,0]=4 1628 B11R0.147 CCCCN(C)CCCC(C)C 2230a_100000207549_100011214892 [0,1,1,0,0,0|2,0,0]=4 1629 B11R0.147 CCCCN(C)CCCC(C)C 269982a_100000207549_100011214892 [0,1,1,0,0,0|2,0,0]=4 1630 B11R0.147 CCCNC(C)CCCC(C)C 2230a_100000210607_100000210303 [0,1,1,0,0,0|1,0,0]=3 1631 B11R0.147 CCCNC(C)CCCC(C)C 270004a_100020643023_100000753411 [0,1,1,0,0,0|1,0,0]=3 1632 B11R0.147 CCCNC(C)CCOC(C)C 270004a_100020643023_200011219172 [0,1,1,0,0,0|2,0,0]=4 1633 B11R0.147 CCCOC(C)CCCC(C)C 34a_200011218570_100000210303 [0,1,1,0,0,0|1,0,0]=3 1634 B11R0.147 CCCOC(C)CCCC(C)C 7a_200011218570_100000210303 [0,1,1,0,0,0|1,0,0]=3 1635 B11R0.147 CCCOC(C)CNCC(C)C 2230a_100015185124_100000210760 [0,1,1,0,0,0|2,0,0]=4 1636 B11R0.147 CCCOC(C)CNCC(C)C 270004a_100015185124_100000210432 [0,1,1,0,0,0|2,0,0]=4 1637 B11R0.147 CCCOC(C)CNCC(C)C 34a_100015185124_100000210624 [0,1,1,0,0,0|2,0,0]=4 1638 B11R0.147 CCOCC(C)OCCC(C)C 34a_100000718985_100000210312 [0,1,1,0,0,0|2,0,0]=4 1639 B11R0.147 CCOCC(C)OCCC(C)C 7a_100000718985_100000210626 [0,1,1,0,0,0|2,0,0]=4 1640 B11R0.147 CCSCC(C)NCCC(C)C 270004a_100000210545_200011216171 [0,1,1,0,0,0|2,0,0]=4 1641 B11R0.147 CN(C)CCCN(C)CCCO 269982a_100000213112_100000757444 [0,1,1,0,0,0|2,0,0]=4 1642 B11R0.147 CN(C)CCCN(C)CCCO 269982a_100000225831_100011215043 [0,1,1,0,0,0|2,0,0]=4 1643 B11R0.147 CNCCC(C)CCCC(C)C 2230a_102516457229_200000210301 [0,1,1,0,0,0|1,0,0]=3 1644 B11R0.147 CNCCC(C)CCCC(C)C 2230a_106832991635_100009816328 [0,1,1,0,0,0|1,0,0]=3 1645 B11R0.147 CNCCC(C)CCCC(C)C 34a_100102657272_100009816328 [0,1,1,0,0,0|1,0,0]=3 1646 B11R0.147 CNCCC(C)CCCC(C)C 7a_106832991635_100009816328 [0,1,1,0,0,0|1,0,0]=3 1647 B11R0.147 COCCC(=O)CCCC(C)C 1458a_100000749529_100011214892 [0,1,1,0,0,0|1,0,1]=4 1648 B11R0.147 COCCC(=O)CCCC(C)C 1458a_100011216857_100000233755 [0,1,1,0,0,0|1,0,1]=4 1649 B11R0.147 COCCC(C)CCC=C(C)C 34a_100000017536_200000210301 [0,1,1,0,0,0|0,0,2]=4 1650 B11R0.147 COCCC(C)CCC=C(C)C 34a_100138415774_100009814015 [0,1,1,0,0,0|0,0,2]=4 1651 B11R0.147 COCCC(C)CCC=C(C)C 7a_100000017536_200000210301 [0,1,1,0,0,0|0,0,2]=4 1652 B11R0.147 COCCC(C)CCCC(C)C 34a_100000015991_200000210301 [0,1,1,0,0,0|0,0,0]=2 1653 B11R0.147 COCCC(C)CCCC(C)C 34a_100138415774_100009816328 [0,1,1,0,0,0|0,0,0]=2 1654 B11R0.147 COCCC(C)CCCC(C)C 7a_100000015991_200000210301 [0,1,1,0,0,0|0,0,0]=2 1655 B11R0.147 COCCC(C)NCCC(C)C 270004a_100000210545_100000742357 [0,1,1,0,0,0|1,0,0]=3 1656 B11R0.147 COCCC(C)NCCC(C)O 270004a_200000755665_100000742357 [0,1,1,0,0,0|2,0,0]=4 1657 B11R0.147 COCCC(C)NCCN(C)C 270004a_100000210585_100000742357 [0,1,1,0,0,0|2,0,0]=4 1658 B11R0.147 COCCN(C)CCCC(C)C 2230a_100000743101_100011214892 [0,1,1,0,0,0|1,0,0]=3 1659 B11R0.147 COCCN(C)CCCC(C)C 269982a_100000743101_100011214892 [0,1,1,0,0,0|1,0,0]=3 1660 B11R0.147 COCCN(C)CCCC(C)O 2230a_100000743101_200000718107 [0,1,1,0,0,0|2,0,0]=4 1661 B11R0.147 COCCN(C)CCCC(C)O 269982a_100000743101_200000718107 [0,1,1,0,0,0|2,0,0]=4 1662 B11R0.147 COCCN(C)CCCN(C)C 269982a_100000225831_100000233755 [0,1,1,0,0,0|2,0,0]=4 1663 B11R0.147 COCCN(C)CCCN(C)C 269982a_100000743101_100000757444 [0,1,1,0,0,0|2,0,0]=4 1664 B11R0.147 COCCN(C)CCOC(C)C 2230a_100000743101_100000211751 [0,1,1,0,0,0|2,0,0]=4 1665 B11R0.147 COCCN(C)CCOC(C)C 269982a_100000743101_100000211751 [0,1,1,0,0,0|2,0,0]=4 1666 B11R0.147 COCCN(C)CCSC(C)C 2230a_100000743101_100000730970 [0,1,1,0,0,0|2,0,0]=4 1667 B11R0.147 COCCN(C)CCSC(C)C 269982a_100000743101_100000730970 [0,1,1,0,0,0|2,0,0]=4 1668 B11R0.147 COCNC(C)CCCC(C)C 2230a_100000210607_100000766300 [0,1,1,0,0,0|1,0,0]=3 1669 B11R0.147 COCO[C@H](C)COCC(C)C 34a_100016172286_100000210624 [0,1,1,0,0,0|2,0,0]=4 1670 B11R0.147 COCO[C@H](C)COCC(C)C 7a_100016172286_100000210760 [0,1,1,0,0,0|2,0,0]=4 1671 B11R0.147 CSCCC(C)CCCC(C)C 62a_100009816328_200000210301 [0,1,1,0,0,0|0,1,0]=3 1672 B11R0.147 CSCCC(C)CCCC(C)C 62a_200000210301_100009816328 [0,1,1,0,0,0|0,1,0]=3 1673 B11R0.147 CSCCC(C)NCCC(C)C 270004a_100000210545_100011217047 [0,1,1,0,0,0|1,1,0]=4 1674 B11R0.147 CSCCN(C)CCCC(C)C 2230a_100000686725_100011214892 [0,1,1,0,0,0|1,1,0]=4 1675 B11R0.147 CSCCN(C)CCCC(C)C 269982a_100000686725_100011214892 [0,1,1,0,0,0|1,1,0]=4 1676 B11R0.147 CSCNC(C)CCCC(C)C 2230a_100000210607_100011218213 [0,1,1,0,0,0|1,1,0]=4 1677 B11R0.147 CSCOC(C)CCCC(C)C 34a_200011218570_100011218213 [0,1,1,0,0,0|1,1,0]=4 1678 B11R0.147 C[C@H](CCCO)CNC[C@@H](C)O 2230a_100160569302_100009817552 [0,1,1,0,0,0|2,0,0]=4 1679 B11R0.147 C[C@H](CCCO)CNC[C@@H](C)O 34a_100160569302_100009817552 [0,1,1,0,0,0|2,0,0]=4 1680 B11R0.174 CC(CCN)COC[C@@H](C)CO 34a_106354213184_100000059175 [0,1,1,0,0,0|2,0,0]=4 1681 B11R0.174 CC(CO)CCNC(C)CCO 2230a_106354213184_100009893172 [0,1,1,0,0,0|1,0,0]=3 1682 B11R0.174 CC(CO)CCNC(C)CCO 34a_106354213184_100009893172 [0,1,1,0,0,0|1,0,0]=3 1683 B11R0.174 CCC(C)CCNC(C)CCO 2230a_100020591266_100009893172 [0,1,1,0,0,0|1,0,0]=3 1684 B11R0.174 CCC(C)CCOC(C)CCO 7a_100011215188_100009893172 [0,1,1,0,0,0|1,0,0]=3 1685 B11R0.174 CCC(C)COCC(C)CCN 34a_106354213184_100000748023 [0,1,1,0,0,0|2,0,0]=4 1686 B11R0.174 CCCC(C)CCOC(C)CC 34a_100011217855_100011215416 [0,1,1,0,0,0|2,0,0]=4 1687 B11R0.174 CCCC(C)CCOC(C)CC 7a_100011217855_100000758301 [0,1,1,0,0,0|2,0,0]=4 1688 B11R0.174 CCCC(C)CCOC(C)CO 34a_100011217855_100012180447 [0,1,1,0,0,0|2,0,0]=4 1689 B11R0.174 CCCC(C)CCOC(C)CO 7a_100011217855_100012180447 [0,1,1,0,0,0|2,0,0]=4 1690 B11R0.174 CCCC(C)CNCC(C)CC 2230a_100020588543_100011216630 [0,1,1,0,0,0|2,0,0]=4 1691 B11R0.174 CCCC(C)CNCC(C)CC 270004a_100020588543_100000243154 [0,1,1,0,0,0|2,0,0]=4 1692 B11R0.174 CCCC(C)CNCC(C)CO 34a_100000744482_100011216630 [0,1,1,0,0,0|2,0,0]=4 1693 B11R0.174 CCCC(C)CNC[C@@H](C)OC 2230a_100020591295_100011216630 [0,1,1,0,0,0|2,0,0]=4 1694 B11R0.174 CCCC(C)CNC[C@@H](C)OC 270004a_100020591295_100000243154 [0,1,1,0,0,0|2,0,0]=4 1695 B11R0.174 CCCC(C)COCC(C)CC 34a_100000688023_100000748023 [0,1,1,0,0,0|2,0,0]=4 1696 B11R0.174 CCCC(C)COCC(C)CC 7a_100000688023_100000748023 [0,1,1,0,0,0|2,0,0]=4 1697 B11R0.174 CCCC(C)COCC(C)CN 34a_100000744482_100011216630 [0,1,1,0,0,0|2,0,0]=4 1698 B11R0.174 CCCC(C)COCC(C)OC 34a_100000690652_100011216630 [0,1,1,0,0,0|2,0,0]=4 1699 B11R0.174 CCCC(C)COC[C@@H](C)CC 34a_100000688023_100009816398 [0,1,1,0,0,0|2,0,0]=4 1700 B11R0.174 CCCC(C)COC[C@@H](C)CC 7a_100000688023_100009816398 [0,1,1,0,0,0|2,0,0]=4 1701 B11R0.174 CCCC(C)COC[C@@H](C)CC 7a_100009816381_100011216630 [0,1,1,0,0,0|2,0,0]=4 1702 B11R0.174 CCCC(C)COC[C@@H](C)CO 34a_100000688023_100000059175 [0,1,1,0,0,0|2,0,0]=4 1703 B11R0.174 CCCC(C)COC[C@@H](C)CO 7a_100000688023_100000059175 [0,1,1,0,0,0|2,0,0]=4 1704 B11R0.174 CCCC(C)CSCC(C)CC 62a_100000748023_100011216630 [0,1,1,0,0,0|2,0,0]=4 1705 B11R0.174 CCCC(C)CSCC(C)CC 62a_100011216630_100000748023 [0,1,1,0,0,0|2,0,0]=4 1706 B11R0.174 CCCC(C)CSC[C@@H](C)CC 62a_100009816398_100011216630 [0,1,1,0,0,0|2,0,0]=4 1707 B11R0.174 CCCC(C)CSC[C@@H](C)CC 62a_100011216630_100009816398 [0,1,1,0,0,0|2,0,0]=4 1708 B11R0.174 CCCC(C)CSC[C@@H](C)CO 62a_100000059175_100011216630 [0,1,1,0,0,0|2,0,0]=4 1709 B11R0.174 CCCC(C)CSC[C@@H](C)CO 62a_100011216630_100000059175 [0,1,1,0,0,0|2,0,0]=4 1710 B11R0.174 CCCC(C)NCCC(C)CC 2230a_100020591266_100000766640 [0,1,1,0,0,0|2,0,0]=4 1711 B11R0.174 CCCC(C)NCCC(C)CC 270004a_100020591266_100000211909 [0,1,1,0,0,0|2,0,0]=4 1712 B11R0.174 CCCC(C)NCCC(C)CO 2230a_106354213184_100000766640 [0,1,1,0,0,0|2,0,0]=4 1713 B11R0.174 CCCC(C)NCCC(C)CO 270004a_106354213184_100000211909 [0,1,1,0,0,0|2,0,0]=4 1714 B11R0.174 CCCC(C)NCCC(C)CO 34a_106354213184_100000766640 [0,1,1,0,0,0|2,0,0]=4 1715 B11R0.174 CCCC(C)OCCC(C)CC 7a_100011215188_100000766640 [0,1,1,0,0,0|2,0,0]=4 1716 B11R0.174 CCCC(C)OCCC(C)OC 7a_100000764861_100000766640 [0,1,1,0,0,0|2,0,0]=4 1717 B11R0.174 CCN(C)CCCN(C)CCO 2230a_100000210263_100015186262 [0,1,1,0,0,0|2,0,0]=4 1718 B11R0.174 CCN(C)CCCN(C)CCO 269982a_100000210263_100015186262 [0,1,1,0,0,0|2,0,0]=4 1719 B11R0.174 CC[C@H](C)COCC(C)CCN 34a_106354213184_100009816398 [0,1,1,0,0,0|2,0,0]=4 1720 B11R0.174 COC(C)CCOC(C)CCO 7a_100000764861_100009893172 [0,1,1,0,0,0|1,0,0]=3 1721 B11R0.180 CC(CCBr)OCCC(C)(C)C 34a_100012276601_100000755188 [0,1,1,0,0,0|2,0,0]=4 1722 B11R0.180 CC(CCBr)OCCC(C)(C)O 34a_100012276601_100000702414 [0,1,1,0,0,0|2,0,0]=4 1723 B11R0.180 CC(CCN)COCC(C)(C)C 34a_106354213184_100011219605 [0,1,1,0,0,0|2,0,0]=4 1724 B11R0.180 CC(CCN)COCC(C)(C)F 34a_106354213184_100011997219 [0,1,1,0,0,0|2,0,0]=4 1725 B11R0.180 CC(CCN)COCC(C)(C)O 34a_106354213184_100000764493 [0,1,1,0,0,0|2,0,0]=4 1726 B11R0.180 CC(CCO)NCCC(C)(C)C 2230a_100000738805_100009893172 [0,1,1,0,0,0|1,0,0]=3 1727 B11R0.180 CC(CCO)NCCC(C)(C)F 2230a_100016253952_100009893172 [0,1,1,0,0,0|1,0,0]=3 1728 B11R0.180 CC(CCO)OCCC(C)(C)C 7a_100000765024_100009893172 [0,1,1,0,0,0|1,0,0]=3 1729 B11R0.180 CC(CCO)OCC[N+](C)(C)C 7a_200020618287_100009893172 [0,1,1,0,0,0|2,0,0]=4 1730 B11R0.180 CC(CCO)OCC[Si](C)(C)C 7a_100000039746_100009893172 [0,1,1,0,0,0|1,1,0]=4 1731 B11R0.180 CC(CCO)SCCC(C)(C)C 62a_100000755188_100009893172 [0,1,1,0,0,0|1,0,0]=3 1732 B11R0.180 CC(CCO)SCCC(C)(C)C 62a_100009893172_100000755188 [0,1,1,0,0,0|1,0,0]=3 1733 B11R0.180 CC(CCO)SCCC(C)(C)O 62a_100000702414_100009893172 [0,1,1,0,0,0|1,0,0]=3 1734 B11R0.180 CC(CCO)SCCC(C)(C)O 62a_100009893172_100000702414 [0,1,1,0,0,0|1,0,0]=3 1735 B11R0.180 CC(CCO)SCC[N+](C)(C)C 62a_100000085578_100009893172 [0,1,1,0,0,0|2,0,0]=4 1736 B11R0.180 CC(CCO)SCC[N+](C)(C)C 62a_100009893172_100000085578 [0,1,1,0,0,0|2,0,0]=4 1737 B11R0.180 CC(CCO)SCC[Si](C)(C)C 62a_100009893172_200000733723 [0,1,1,0,0,0|1,1,0]=4 1738 B11R0.180 CC(CCO)SCC[Si](C)(C)C 62a_200000733723_100009893172 [0,1,1,0,0,0|1,1,0]=4 1739 B11R0.180 CCCC(C)CCOC(C)(C)C 34a_100011217855_100000210625 [0,1,1,0,0,0|2,0,0]=4 1740 B11R0.180 CCCC(C)CNCC(C)(C)C 2230a_100000743828_100011216630 [0,1,1,0,0,0|2,0,0]=4 1741 B11R0.180 CCCC(C)CNCC(C)(C)C 270004a_100000743828_100000243154 [0,1,1,0,0,0|2,0,0]=4 1742 B11R0.180 CCCC(C)CNCC(C)(C)F 2230a_100020643315_100011216630 [0,1,1,0,0,0|2,0,0]=4 1743 B11R0.180 CCCC(C)CNCC(C)(C)F 270004a_100020643315_100000243154 [0,1,1,0,0,0|2,0,0]=4 1744 B11R0.180 CCCC(C)CNCC(C)(C)O 2230a_100000751335_100011216630 [0,1,1,0,0,0|2,0,0]=4 1745 B11R0.180 CCCC(C)CNCC(C)(C)O 270004a_100000751335_100000243154 [0,1,1,0,0,0|2,0,0]=4 1746 B11R0.180 CCCC(C)COCC(C)(C)C 34a_100000688023_100011219605 [0,1,1,0,0,0|2,0,0]=4 1747 B11R0.180 CCCC(C)COCC(C)(C)F 34a_100000688023_100011997219 [0,1,1,0,0,0|2,0,0]=4 1748 B11R0.180 CCCC(C)COCC(C)(C)F 34a_100000716592_100011216630 [0,1,1,0,0,0|2,0,0]=4 1749 B11R0.180 CCCC(C)COCC(C)(C)O 34a_100000688023_100000764493 [0,1,1,0,0,0|2,0,0]=4 1750 B11R0.180 CCCC(C)COCC(C)(C)O 7a_100000688023_100000764493 [0,1,1,0,0,0|2,0,0]=4 1751 B11R0.180 CCCC(C)CSCC(C)(C)C 62a_100011216630_100011219605 [0,1,1,0,0,0|2,0,0]=4 1752 B11R0.180 CCCC(C)CSCC(C)(C)C 62a_100011219605_100011216630 [0,1,1,0,0,0|2,0,0]=4 1753 B11R0.180 CCCC(C)CSCC(C)(C)F 62a_100011216630_100011997219 [0,1,1,0,0,0|2,0,0]=4 1754 B11R0.180 CCCC(C)CSCC(C)(C)F 62a_100011997219_100011216630 [0,1,1,0,0,0|2,0,0]=4 1755 B11R0.180 CCCC(C)CSCC(C)(C)O 62a_100000764493_100011216630 [0,1,1,0,0,0|2,0,0]=4 1756 B11R0.180 CCCC(C)CSCC(C)(C)O 62a_100011216630_100000764493 [0,1,1,0,0,0|2,0,0]=4 1757 B11R0.180 CCCC(C)NCCC(C)(C)C 2230a_100000738805_100000766640 [0,1,1,0,0,0|2,0,0]=4 1758 B11R0.180 CCCC(C)NCCC(C)(C)C 2230a_100000741246_100000755188 [0,1,1,0,0,0|2,0,0]=4 1759 B11R0.180 CCCC(C)NCCC(C)(C)C 270004a_100000738805_100000211909 [0,1,1,0,0,0|2,0,0]=4 1760 B11R0.180 CCCC(C)NCCC(C)(C)F 2230a_100016253952_100000766640 [0,1,1,0,0,0|2,0,0]=4 1761 B11R0.180 CCCC(C)NCCC(C)(C)F 270004a_100016253952_100000211909 [0,1,1,0,0,0|2,0,0]=4 1762 B11R0.180 CCCC(C)NCCC(C)(C)O 2230a_100000741246_100000702414 [0,1,1,0,0,0|2,0,0]=4 1763 B11R0.180 CCCC(C)NCCC(C)(C)O 270004a_100000707701_100000211909 [0,1,1,0,0,0|2,0,0]=4 1764 B11R0.180 CCCC(C)OCCC(C)(C)C 34a_100000764384_100000755188 [0,1,1,0,0,0|2,0,0]=4 1765 B11R0.180 CCCC(C)OCCC(C)(C)C 7a_100000764384_100000755188 [0,1,1,0,0,0|2,0,0]=4 1766 B11R0.180 CCCC(C)OCCC(C)(C)C 7a_100000765024_100000766640 [0,1,1,0,0,0|2,0,0]=4 1767 B11R0.180 CCCC(C)OCCC(C)(C)O 34a_100000764384_100000702414 [0,1,1,0,0,0|2,0,0]=4 1768 B11R0.180 CCCC(C)OCCC(C)(C)O 7a_100000764384_100000702414 [0,1,1,0,0,0|2,0,0]=4 1769 B11R0.180 CCCC(C)SCCC(C)(C)C 62a_100000755188_100000766640 [0,1,1,0,0,0|2,0,0]=4 1770 B11R0.180 CCCC(C)SCCC(C)(C)C 62a_100000766640_100000755188 [0,1,1,0,0,0|2,0,0]=4 1771 B11R0.180 CCCC(C)SCCC(C)(C)O 62a_100000702414_100000766640 [0,1,1,0,0,0|2,0,0]=4 1772 B11R0.180 CCCC(C)SCCC(C)(C)O 62a_100000766640_100000702414 [0,1,1,0,0,0|2,0,0]=4 1773 B11R0.180 CCCN(C)CCCC(C)(C)O 2230a_100000747261_100009888830 [0,1,1,0,0,0|2,0,0]=4 1774 B11R0.180 CCCN(C)CCCC(C)(C)O 269982a_100000747261_100009888830 [0,1,1,0,0,0|2,0,0]=4 1775 B11R0.180 CN(CCO)CCCC(C)(C)O 2230a_100000210263_100009888830 [0,1,1,0,0,0|1,0,0]=3 1776 B11R0.180 CN(CCO)CCCC(C)(C)O 269982a_100000210263_100009888830 [0,1,1,0,0,0|1,0,0]=3 1777 B11R0.180 CN(CCO)CCC[N+](C)(C)C 2230a_100000210263_100016990835 [0,1,1,0,0,0|2,0,0]=4 1778 B11R0.180 CN(CCO)CCC[N+](C)(C)C 269982a_100000210263_100016990835 [0,1,1,0,0,0|2,0,0]=4 1779 B11R0.180 CN(CCO)CCC[Si](C)(C)C 2230a_100000210263_100011219597 [0,1,1,0,0,0|1,1,0]=4 1780 B11R0.180 CN(CCO)CCC[Si](C)(C)C 269982a_100000210263_100011219597 [0,1,1,0,0,0|1,1,0]=4 1781 B11R0.180 CN(CCO)CCOC(C)(C)C 2230a_100000690421_100000211926 [0,1,1,0,0,0|2,0,0]=4 1782 B11R0.180 CN(CCO)CCOC(C)(C)C 269982a_100000690421_100000211926 [0,1,1,0,0,0|2,0,0]=4 1783 B11R0.180 C[C@H](CCO)NCCC(C)(C)C 2230a_100000706166_100000755188 [0,1,1,0,0,0|1,0,0]=3 1784 B11R0.180 C[C@H](CCO)NCCC(C)(C)C 34a_100000706166_100000755188 [0,1,1,0,0,0|1,0,0]=3 1785 B11R0.180 C[C@H](CCO)NCCC(C)(C)O 2230a_100000706166_100000702414 [0,1,1,0,0,0|1,0,0]=3 1786 B11R0.180 C[C@H](CCO)NCCC(C)(C)O 34a_100000706166_100000702414 [0,1,1,0,0,0|1,0,0]=3 1787 B11R0.180 C[C@H](CCO)NCC[N+](C)(C)C 34a_100000706166_100000085578 [0,1,1,0,0,0|2,0,0]=4 1788 B11R0.180 C[C@H](CCO)NCC[Si](C)(C)C 2230a_100000706166_200000733723 [0,1,1,0,0,0|1,1,0]=4 1789 B11R0.180 C[C@H](CCO)NCC[Si](C)(C)C 34a_100000706166_200000733723 [0,1,1,0,0,0|1,1,0]=4 1790 B11R0.51 CC(C)CC(C)N(C)C(C)(C)C 269982a_100000745462_100000210625 [0,1,1,0,0,0|2,0,0]=4 1791 B11R0.51 CC(C)CC(C)N(C)C(C)(C)C 269982a_100011215553_100000731052 [0,1,1,0,0,0|2,0,0]=4 1792 B11R0.51 CC(C)CN(C)C(C)C(C)(C)C 2230a_100000745498_100000210760 [0,1,1,0,0,0|2,0,0]=4 1793 B11R0.51 CC(C)CN(C)C(C)C(C)(C)C 269982a_100000745498_100000210624 [0,1,1,0,0,0|2,0,0]=4 1794 B11R0.51 CC(C)CN(C)C(C)C(C)(C)C 270004a_100000745498_100000210432 [0,1,1,0,0,0|2,0,0]=4 1795 B11R0.63 CC(C)CC(C)N(C)C(C)CO 2230a_100000693034_100000731052 [0,1,1,0,0,0|2,0,0]=4 1796 B11R0.63 CC(C)CC(C)N(C)C(C)CO 2230a_100000745462_100012180447 [0,1,1,0,0,0|2,0,0]=4 1797 B11R0.63 CC(C)CC(C)N(C)C(C)CO 269982a_100000693034_100000731052 [0,1,1,0,0,0|2,0,0]=4 1798 B11R0.63 CC(C)CC(C)N(C)[C@H](C)CO 269982a_100000745462_100016084084 [0,1,1,0,0,0|2,0,0]=4 1799 B11R0.63 CCC(C)C(=O)[C@@H](O)CC(C)C 1458a_100012027011_100000758301 [0,1,1,0,0,0|1,0,1]=4 1800 B11R0.63 CCC(C)C(C)C(C)OC(C)C 7a_200011290770_100000210206 [0,1,1,0,0,0|2,0,0]=4 1801 B11R0.63 CCC(C)C(C)N(C)CC(C)C 270004a_100000747067_100000210599 [0,1,1,0,0,0|2,0,0]=4 1802 B11R0.63 CCC(C)N(C)C(C)CC(C)C 2230a_100000741768_100000731052 [0,1,1,0,0,0|2,0,0]=4 1803 B11R0.63 CCC(C)N(C)C(C)CC(C)C 2230a_100000745462_100000758301 [0,1,1,0,0,0|2,0,0]=4 1804 B11R0.63 CCC(C)N(C)C(C)CC(C)C 269982a_100000741768_100000731052 [0,1,1,0,0,0|2,0,0]=4 1805 B11R0.63 CCC(C)N(C)C(C)CC(C)C 269982a_100000745462_100000758301 [0,1,1,0,0,0|2,0,0]=4 1806 B11R0.63 COC(C)N(C)C(C)CC(C)C 269982a_100000745462_100009879195 [0,1,1,0,0,0|2,0,0]=4 1807 B11R0.92 CC(C)C(C)C(=O)C[C@@H](C)CO 1458a_100000755409_100000059175 [0,1,1,0,0,0|0,0,2]=4 1808 B11R0.92 CC(C)C(C)N(C)C[C@@H](C)CO 2230a_100000228512_100000059175 [0,1,1,0,0,0|2,0,0]=4 1809 B11R0.92 CC(C)C(C)N(C)C[C@@H](C)CO 269982a_100000228512_100000059175 [0,1,1,0,0,0|2,0,0]=4 1810 B11R0.92 CCC(C)CC(=O)C(C)C(C)C 1458a_100000755409_100000748023 [0,1,1,0,0,0|0,0,2]=4 1811 B11R0.92 CCC(C)CC(C)N(C)C(C)C 270004a_200000211004_100011710205 [0,1,1,0,0,0|2,0,0]=4 1812 B11R0.92 CCC(C)CN(C)C(C)C(C)C 2230a_100000228512_100000748023 [0,1,1,0,0,0|2,0,0]=4 1813 B11R0.92 CCC(C)CN(C)C(C)C(C)C 269982a_100000228512_100000748023 [0,1,1,0,0,0|2,0,0]=4 1814 B11R0.92 CCC(C)CN(C)C(C)C(C)C 270004a_100000228512_100000243153 [0,1,1,0,0,0|2,0,0]=4 1815 B11R0.92 CC[C@H](C)CC(=O)C(C)C(C)C 1458a_100000755409_100009816398 [0,1,1,0,0,0|0,0,2]=4 1816 B11R0.92 CC[C@H](C)CN(C)C(C)C(C)C 2230a_100000228512_100009816398 [0,1,1,0,0,0|2,0,0]=4 1817 B11R0.92 CC[C@H](C)CN(C)C(C)C(C)C 269982a_100000228512_100009816398 [0,1,1,0,0,0|2,0,0]=4 1818 B11R0.144 CCN(CC(C)C)C(C)C(C)C 2230a_100000746363_100000210760 [0,1,1,0,0,0|2,0,0]=4 1819 B11R0.144 CCN(CC(C)C)C(C)C(C)C 269982a_100000746363_100000210624 [0,1,1,0,0,0|2,0,0]=4 1820 B11R0.144 CCN(CC(C)C)C(C)C(C)C 270004a_100000746363_100000210432 [0,1,1,0,0,0|2,0,0]=4 1821 B11R0.282 CCC(C(C)C)N(C)CC(C)C 270004a_100000747067_100000210600 [0,1,1,0,0,0|2,0,0]=4 1822 B11R0.282 CCN(C(C)C)C(C)CC(C)C 2230a_100000223864_100000731052 [0,1,1,0,0,0|2,0,0]=4 1823 B11R0.282 CCN(C(C)C)C(C)CC(C)C 269982a_100000223864_100000731052 [0,1,1,0,0,0|2,0,0]=4 1824 B11R0.308 CC(C)C(C)N(C)CC(C)(C)C 270004a_100000228512_100011204126 [0,1,1,0,0,0|2,0,0]=4 1825 B11R0.335 CC(C)CC(C)(O)C(=O)C(C)C 1458a_100011434877_100000210206 [0,1,1,0,0,0|1,0,1]=4 1826 B11R0.28 CC(C)C(NC[C@@H](C)O)C(C)C 2230a_100000690608_100009817552 [0,1,1,0,0,0|2,0,0]=4 1827 B11R0.28 CC(C)C(NC[C@@H](C)O)C(C)C 34a_100000690608_100009817552 [0,1,1,0,0,0|2,0,0]=4 1828 B11R0.28 CC(C)C(OC[C@@H](C)O)C(C)C 34a_100011216681_100009817552 [0,1,1,0,0,0|2,0,0]=4 1829 B11R0.28 CC(C)C(OC[C@@H](C)O)C(C)C 7a_100011216681_100009817552 [0,1,1,0,0,0|2,0,0]=4 1830 B11R0.28 CC(C)CCN(C(C)C)C(C)C 2230a_100000086832_100000210312 [0,1,1,0,0,0|2,0,0]=4 1831 B11R0.28 CC(C)CCN(C(C)C)C(C)C 269982a_100000086832_100000210312 [0,1,1,0,0,0|2,0,0]=4 1832 B11R0.28 CC(C)CCN(C(C)C)C(C)C 34a_100000086832_100000210312 [0,1,1,0,0,0|2,0,0]=4 1833 B11R0.28 CC(C)CNC(C(C)C)C(C)C 2230a_100000690608_100000210760 [0,1,1,0,0,0|2,0,0]=4 1834 B11R0.28 CC(C)CNC(C(C)C)C(C)C 270004a_100000690608_100000210432 [0,1,1,0,0,0|2,0,0]=4 1835 B11R0.28 CC(C)CNC(C(C)C)C(C)C 34a_100000690608_100000210624 [0,1,1,0,0,0|2,0,0]=4 1836 B11R0.28 CC(C)COC(C(C)C)C(C)C 34a_100011216681_100000210624 [0,1,1,0,0,0|2,0,0]=4 1837 B11R0.28 CC(C)COC(C(C)C)C(C)C 7a_100011216681_100000210760 [0,1,1,0,0,0|2,0,0]=4 1838 B11R0.28 CC(O)CCN(C(C)C)C(C)C 2230a_100000086832_100012276601 [0,1,1,0,0,0|2,0,0]=4 1839 B11R0.28 CC(O)CCN(C(C)C)C(C)C 269982a_100000086832_100012276601 [0,1,1,0,0,0|2,0,0]=4 1840 B11R0.28 CC(O)CCN(C(C)C)C(C)C 34a_100000086832_100012276601 [0,1,1,0,0,0|2,0,0]=4 1841 B11R0.28 CC(O)CNC(C(C)C)C(C)C 2230a_100000690608_100011218427 [0,1,1,0,0,0|2,0,0]=4 1842 B11R0.28 CC(O)CNC(C(C)C)C(C)C 34a_100000690608_100011218427 [0,1,1,0,0,0|2,0,0]=4 1843 B11R0.28 CC(O)COC(C(C)C)C(C)C 34a_100011216681_100011218427 [0,1,1,0,0,0|2,0,0]=4 1844 B11R0.28 CC(O)COC(C(C)C)C(C)C 7a_100011216681_100011218427 [0,1,1,0,0,0|2,0,0]=4 1845 B11R0.108 CCC(C)CN(C(C)C)C(C)C 2230a_100000086832_100000748023 [0,1,1,0,0,0|2,0,0]=4 1846 B11R0.108 CCC(C)CN(C(C)C)C(C)C 269982a_100000086832_100000748023 [0,1,1,0,0,0|2,0,0]=4 1847 B11R0.108 CCC(C)CN(C(C)C)C(C)C 34a_100000086832_100000748023 [0,1,1,0,0,0|2,0,0]=4 1848 B11R0.108 CCC(C)NC(C(C)C)C(C)C 2230a_100000690608_100000758301 [0,1,1,0,0,0|2,0,0]=4 1849 B11R0.108 CCC(C)NC(C(C)C)C(C)C 34a_100000690608_100011215416 [0,1,1,0,0,0|2,0,0]=4 1850 B11R0.108 CCC(C)OC(C(C)C)C(C)C 34a_100011216681_100011215416 [0,1,1,0,0,0|2,0,0]=4 1851 B11R0.108 CCC(C)OC(C(C)C)C(C)C 7a_100011216681_100000758301 [0,1,1,0,0,0|2,0,0]=4 1852 B11R0.108 CCC(O)CN(C(C)C)C(C)C 2230a_100000086832_100011218378 [0,1,1,0,0,0|2,0,0]=4 1853 B11R0.108 CCC(O)CN(C(C)C)C(C)C 269982a_100000086832_100011218378 [0,1,1,0,0,0|2,0,0]=4 1854 B11R0.108 CCC(O)CN(C(C)C)C(C)C 34a_100000086832_100011218378 [0,1,1,0,0,0|2,0,0]=4 1855 B11R0.108 CC[C@H](C)CN(C(C)C)C(C)C 2230a_100000086832_100009816398 [0,1,1,0,0,0|2,0,0]=4 1856 B11R0.108 CC[C@H](C)CN(C(C)C)C(C)C 269982a_100000086832_100009816398 [0,1,1,0,0,0|2,0,0]=4 1857 B11R0.108 CC[C@H](C)CN(C(C)C)C(C)C 34a_100000086832_100009816398 [0,1,1,0,0,0|2,0,0]=4 1858 B11R0.153 CC(C)C(NCCCF)C(C)C 2230a_100000690608_100011934791 [0,1,1,0,0,0|2,0,0]=4 1859 B11R0.153 CC(C)C(NCCCF)C(C)C 34a_100000690608_100011934791 [0,1,1,0,0,0|2,0,0]=4 1860 B11R0.153 CC(C)C(NCCCO)C(C)C 2230a_100000690608_100000230001 [0,1,1,0,0,0|2,0,0]=4 1861 B11R0.153 CC(C)C(NCCCO)C(C)C 34a_100000690608_100000230001 [0,1,1,0,0,0|2,0,0]=4 1862 B11R0.153 CC(C)C(OCCCF)C(C)C 34a_100011216681_100011934791 [0,1,1,0,0,0|2,0,0]=4 1863 B11R0.153 CC(C)C(OCCCF)C(C)C 7a_100011216681_100011934791 [0,1,1,0,0,0|2,0,0]=4 1864 B11R0.153 CC(C)C(OCCCO)C(C)C 34a_100011216681_100000230001 [0,1,1,0,0,0|2,0,0]=4 1865 B11R0.153 CC(C)C(OCCCO)C(C)C 7a_100011216681_100011215043 [0,1,1,0,0,0|2,0,0]=4 1866 B11R0.153 CC(C)N(CCCCF)C(C)C 2230a_100000086832_100000729493 [0,1,1,0,0,0|2,0,0]=4 1867 B11R0.153 CC(C)N(CCCCF)C(C)C 269982a_100000086832_100000729493 [0,1,1,0,0,0|2,0,0]=4 1868 B11R0.153 CC(C)N(CCCCF)C(C)C 34a_100000086832_100000729493 [0,1,1,0,0,0|2,0,0]=4 1869 B11R0.153 CC(C)N(CCCCO)C(C)C 2230a_100000086832_100000210776 [0,1,1,0,0,0|2,0,0]=4 1870 B11R0.153 CC(C)N(CCCCO)C(C)C 2230a_100011521146_100000210206 [0,1,1,0,0,0|2,0,0]=4 1871 B11R0.153 CC(C)N(CCCCO)C(C)C 269982a_100000086832_100000210776 [0,1,1,0,0,0|2,0,0]=4 1872 B11R0.153 CC(C)N(CCCCO)C(C)C 269982a_100011521146_100000210206 [0,1,1,0,0,0|2,0,0]=4 1873 B11R0.153 CC(C)N(CCCCO)C(C)C 34a_100000086832_100011216708 [0,1,1,0,0,0|2,0,0]=4 1874 B11R0.153 CC(C)P(CCCN[13CH3])C(C)C 2230a_107094911147_200025704644 [0,1,1,0,0,0|2,0,0]=4 1875 B11R0.153 CC(C)P(CCCN[13CH3])C(C)C 34a_107094911147_200025704644 [0,1,1,0,0,0|2,0,0]=4 1876 B11R0.153 CCCCCN(C(C)C)C(C)C 2230a_100000086832_100000210326 [0,1,1,0,0,0|2,0,0]=4 1877 B11R0.153 CCCCCN(C(C)C)C(C)C 2230a_100000223497_100000210206 [0,1,1,0,0,0|2,0,0]=4 1878 B11R0.153 CCCCCN(C(C)C)C(C)C 269982a_100000086832_100000210215 [0,1,1,0,0,0|2,0,0]=4 1879 B11R0.153 CCCCCN(C(C)C)C(C)C 269982a_100000223497_100000210206 [0,1,1,0,0,0|2,0,0]=4 1880 B11R0.153 CCCCCN(C(C)C)C(C)C 34a_100000086832_100000718602 [0,1,1,0,0,0|2,0,0]=4 1881 B11R0.153 CCCCNC(C(C)C)C(C)C 2230a_100000690608_100000210211 [0,1,1,0,0,0|1,0,0]=3 1882 B11R0.153 CCCCNC(C(C)C)C(C)C 34a_100000690608_100000210210 [0,1,1,0,0,0|1,0,0]=3 1883 B11R0.153 CCCCN[C@@H](C(=O)O)C(C)C 269956a_100000745019_100000210211 [0,1,1,0,0,0|1,0,1]=4 1884 B11R0.153 CCCCOC(C(C)C)C(C)C 34a_100011216681_100000210210 [0,1,1,0,0,0|1,0,0]=3 1885 B11R0.153 CCCCOC(C(C)C)C(C)C 7a_100011216681_100000210211 [0,1,1,0,0,0|1,0,0]=3 1886 B11R0.153 CCNCCP(C(C)C)C(C)C 2230a_107094795181_100000210202 [0,1,1,0,0,0|2,0,0]=4 1887 B11R0.153 CCNCCP(C(C)C)C(C)C 34a_107094795181_100000210202 [0,1,1,0,0,0|2,0,0]=4 1888 B11R0.153 CCOCCN(C(C)C)C(C)C 2230a_100000086832_100011215890 [0,1,1,0,0,0|2,0,0]=4 1889 B11R0.153 CCOCCN(C(C)C)C(C)C 269982a_100000086832_100011215890 [0,1,1,0,0,0|2,0,0]=4 1890 B11R0.153 CCOCCN(C(C)C)C(C)C 34a_100000086832_100000210147 [0,1,1,0,0,0|2,0,0]=4 1891 B11R0.153 CCSCCN(C(C)C)C(C)C 2230a_100000086832_100000757381 [0,1,1,0,0,0|2,0,0]=4 1892 B11R0.153 CCSCCN(C(C)C)C(C)C 269982a_100000086832_100000757381 [0,1,1,0,0,0|2,0,0]=4 1893 B11R0.153 CCSCCN(C(C)C)C(C)C 34a_100000086832_100000757381 [0,1,1,0,0,0|2,0,0]=4 1894 B11R0.153 CNCCCP(C(C)C)C(C)C 2230a_107094911147_200000210301 [0,1,1,0,0,0|2,0,0]=4 1895 B11R0.153 CNCCCP(C(C)C)C(C)C 34a_107094911147_200000210301 [0,1,1,0,0,0|2,0,0]=4 1896 B11R0.153 COCCCN(C(C)C)C(C)C 2230a_100000086832_100000740836 [0,1,1,0,0,0|2,0,0]=4 1897 B11R0.153 COCCCN(C(C)C)C(C)C 269982a_100000086832_100000740836 [0,1,1,0,0,0|2,0,0]=4 1898 B11R0.153 COCCCN(C(C)C)C(C)C 34a_100000086832_100000740836 [0,1,1,0,0,0|2,0,0]=4 1899 B11R0.153 COCCNC(C(C)C)C(C)C 2230a_100000690608_100011201679 [0,1,1,0,0,0|2,0,0]=4 1900 B11R0.153 COCCNC(C(C)C)C(C)C 34a_100000690608_100011201679 [0,1,1,0,0,0|2,0,0]=4 1901 B11R0.153 COCCOC(C(C)C)C(C)C 34a_100011216681_100011201679 [0,1,1,0,0,0|2,0,0]=4 1902 B11R0.153 COCCOC(C(C)C)C(C)C 7a_100011216681_100000233755 [0,1,1,0,0,0|2,0,0]=4 1903 B11R0.153 CSCCNC(C(C)C)C(C)C 2230a_100000690608_100000751147 [0,1,1,0,0,0|2,0,0]=4 1904 B11R0.153 CSCCNC(C(C)C)C(C)C 34a_100000690608_100000212216 [0,1,1,0,0,0|2,0,0]=4 1905 B11R0.153 CSCCOC(C(C)C)C(C)C 34a_100011216681_100000212216 [0,1,1,0,0,0|2,0,0]=4 1906 B11R0.153 CSCCOC(C(C)C)C(C)C 7a_100011216681_100000212216 [0,1,1,0,0,0|2,0,0]=4 1907 B11R0.167 C=CC(C)N(CCCC)C(C)C 269982a_100000207398_100011215867 [0,1,1,0,0,0|2,0,0]=4 1908 B11R0.167 CC(C)N(CCCO)C(C)CO 2230a_100000182298_100012180447 [0,1,1,0,0,0|2,0,0]=4 1909 B11R0.167 CC(C)N(CCCO)[C@H](C)CO 269982a_100000182298_100016084084 [0,1,1,0,0,0|2,0,0]=4 1910 B11R0.167 CCCCN(C(C)C)C(C)C#N 2230a_100000207398_100000184139 [0,1,1,0,0,0|2,0,0]=4 1911 B11R0.167 CCCCN(C(C)C)C(C)C#N 269982a_100000207398_100000703298 [0,1,1,0,0,0|2,0,0]=4 1912 B11R0.167 CCCCN(C(C)C)C(C)CC 2230a_100000207357_100000210206 [0,1,1,0,0,0|2,0,0]=4 1913 B11R0.167 CCCCN(C(C)C)C(C)CC 2230a_100000207398_100000758301 [0,1,1,0,0,0|2,0,0]=4 1914 B11R0.167 CCCCN(C(C)C)C(C)CC 269982a_100000207357_100000210206 [0,1,1,0,0,0|2,0,0]=4 1915 B11R0.167 CCCCN(C(C)C)C(C)CC 269982a_100000207398_100000758301 [0,1,1,0,0,0|2,0,0]=4 1916 B11R0.167 CCCCN(C(C)C)C(C)CO 2230a_100000207398_100012180447 [0,1,1,0,0,0|1,0,0]=3 1917 B11R0.167 CCCCN(C(C)C)C(C)OC 269982a_100000207398_100009879195 [0,1,1,0,0,0|1,0,0]=3 1918 B11R0.167 CCCCN(C(C)C)[C@H](C)CO 269982a_100000207398_100016084084 [0,1,1,0,0,0|1,0,0]=3 1919 B11R0.167 COC(C)N(CCCO)C(C)C 269982a_100000182298_100009879195 [0,1,1,0,0,0|2,0,0]=4 1920 B11R0.167 COCCN(C(C)C)C(C)CO 2230a_200000223778_100012180447 [0,1,1,0,0,0|2,0,0]=4 1921 B11R0.167 COCCN(C(C)C)C(C)OC 269982a_200000223778_100009879195 [0,1,1,0,0,0|2,0,0]=4 1922 B11R0.167 COCCN(C(C)C)[C@H](C)CO 269982a_200000223778_100016084084 [0,1,1,0,0,0|2,0,0]=4 1923 B11R0.175 CCCC(C)N(C(C)C)C(C)C 2230a_100000086832_100000766640 [0,1,1,0,0,0|2,0,0]=4 1924 B11R0.175 CCCC(C)N(C(C)C)C(C)C 269982a_100000086832_100000766640 [0,1,1,0,0,0|2,0,0]=4 1925 B11R0.175 CCCC(C)N(C(C)C)C(C)C 34a_100000086832_100000766640 [0,1,1,0,0,0|2,0,0]=4 1926 B11R0.205 CC(C)[C@H](NCCF)C(C)(C)O 2230a_100000718284_100011217306 [0,1,1,0,0,0|2,0,0]=4 1927 B11R0.205 CC(C)[C@H](NCCO)C(C)(C)O 2230a_100000718284_100000211926 [0,1,1,0,0,0|2,0,0]=4 1928 B11R0.205 CCCCN(C(C)C)C(C)(C)C 269982a_100000207398_100000210625 [0,1,1,0,0,0|2,0,0]=4 1929 B11R0.205 CCCCN(C(C)C)C(C)(C)C 269982a_200020682127_100000210211 [0,1,1,0,0,0|2,0,0]=4 1930 B11R0.205 CCCN[C@@H](C(C)C)C(C)(C)O 2230a_100000718284_100000210303 [0,1,1,0,0,0|1,0,0]=3 1931 B11R0.205 COCN[C@@H](C(C)C)C(C)(C)O 2230a_100000718284_100000766300 [0,1,1,0,0,0|2,0,0]=4 1932 B11R0.205 CSCN[C@@H](C(C)C)C(C)(C)O 2230a_100000718284_100011218213 [0,1,1,0,0,0|2,0,0]=4 1933 B11R0.248 CCCOC(C)(C(C)C)C(C)C 7a_100011216372_100000210303 [0,1,1,0,0,0|2,0,0]=4 1934 B11R0.19 CCC(CC)CC(=O)CC(C)C 1458a_100000210554_100011215472 [0,1,1,0,0,0|0,0,2]=4 1935 B11R0.19 CCC(CC)CN(C)CC(C)C 2230a_100000747067_100011215472 [0,1,1,0,0,0|2,0,0]=4 1936 B11R0.19 CCC(CC)CN(C)CC(C)C 269982a_100000747067_100011215472 [0,1,1,0,0,0|2,0,0]=4 1937 B11R0.19 CCC(CC)CN(C)CC(C)C 270004a_100000747067_100000211137 [0,1,1,0,0,0|2,0,0]=4 1938 B11R0.19 CCC(CC)NC(C)CC(C)C 2230a_100000199018_100000731052 [0,1,1,0,0,0|2,0,0]=4 1939 B11R0.19 CCC(CC)NC(C)CC(C)C 270004a_100000692259_100000210860 [0,1,1,0,0,0|2,0,0]=4 1940 B11R0.19 CCC(CC)OC(C)CC(C)C 7a_100000211805_100000210505 [0,1,1,0,0,0|2,0,0]=4 1941 B11R0.19 CCC(CC)OC(C)CC(C)C 7a_100000688536_100000731052 [0,1,1,0,0,0|2,0,0]=4 1942 B11R0.19 CCC(CC)SC(C)CC(C)C 62a_100000210505_100000731052 [0,1,1,0,0,0|2,0,0]=4 1943 B11R0.19 CCC(CC)SC(C)CC(C)C 62a_100000731052_100000210505 [0,1,1,0,0,0|2,0,0]=4 1944 B11R0.19 CC[C@@H](CO)NC(C)CC(C)C 2230a_100000709445_100000731052 [0,1,1,0,0,0|2,0,0]=4 1945 B11R0.33 CC(C)CC(C)NC(C)C(C)C 2230a_100000211541_100000731052 [0,1,1,0,0,0|2,0,0]=4 1946 B11R0.33 CC(C)CC(C)OC(C)C(C)C 7a_100000748068_100000731052 [0,1,1,0,0,0|2,0,0]=4 1947 B11R0.91 C#CC(CC(C)C)OC(C)CC 34a_100011215986_100011215416 [0,1,1,0,0,0|2,0,0]=4 1948 B11R0.91 C#CC(CC(C)C)OC(C)CC 7a_100011215986_100000758301 [0,1,1,0,0,0|2,0,0]=4 1949 B11R0.91 C=CC(CC(C)C)OC(C)CC 34a_100012186643_100011215416 [0,1,1,0,0,0|2,0,0]=4 1950 B11R0.91 C=CC(CC(C)C)OC(C)CC 7a_100012186643_100000758301 [0,1,1,0,0,0|2,0,0]=4 1951 B11R0.91 CC(C)C[C@@H](CO)NC(C)CO 2230a_100011830311_100012180447 [0,1,1,0,0,0|2,0,0]=4 1952 B11R0.91 CC(C)C[C@@H](CO)NC(C)CO 34a_100011830311_100012180447 [0,1,1,0,0,0|2,0,0]=4 1953 B11R0.91 CCC(C)CC(CC)OC(C)C 7a_200011216566_100000210206 [0,1,1,0,0,0|2,0,0]=4 1954 B11R0.91 CCC(C)CN(CC)CC(C)C 2230a_100000738554_100000748023 [0,1,1,0,0,0|2,0,0]=4 1955 B11R0.91 CCC(C)CN(CC)CC(C)C 269982a_100000738554_100000748023 [0,1,1,0,0,0|2,0,0]=4 1956 B11R0.91 CCC(C)CN(CC)CC(C)C 270004a_100000738554_100000243153 [0,1,1,0,0,0|2,0,0]=4 1957 B11R0.91 CCC(C)NC(C#N)CC(C)C 2230a_100000741378_100000758301 [0,1,1,0,0,0|2,0,0]=4 1958 B11R0.91 CCC(C)N[C@H](CO)CC(C)C 2230a_100011830311_100000758301 [0,1,1,0,0,0|1,0,0]=3 1959 B11R0.91 CCC(C)N[C@H](CO)CC(C)C 34a_100011830311_100011215416 [0,1,1,0,0,0|1,0,0]=3 1960 B11R0.91 CCC(C)OC(C#N)CC(C)C 34a_200011294978_100011215416 [0,1,1,0,0,0|2,0,0]=4 1961 B11R0.91 CCC(C)OC(C#N)CC(C)C 7a_200011294978_100000758301 [0,1,1,0,0,0|2,0,0]=4 1962 B11R0.91 CC[C@H](C)CN(CC)CC(C)C 2230a_100000738554_100009816398 [0,1,1,0,0,0|2,0,0]=4 1963 B11R0.91 CC[C@H](C)CN(CC)CC(C)C 269982a_100000738554_100009816398 [0,1,1,0,0,0|2,0,0]=4 1964 B11R0.110 CCC(C)CC(=O)CC(C)CC 1458a_100000708755_100000748023 [0,1,1,0,0,0|0,0,2]=4 1965 B11R0.110 CCC(C)CC(=O)C[C@@H](C)CC 1458a_100000708755_100009816398 [0,1,1,0,0,0|0,0,2]=4 1966 B11R0.110 CCC(C)CC(=O)C[C@@H](C)CO 1458a_100000708755_100000059175 [0,1,1,0,0,0|0,0,2]=4 1967 B11R0.110 CCC(C)CC(C)NC(C)CC 2230a_100000763565_100000758301 [0,1,1,0,0,0|2,0,0]=4 1968 B11R0.110 CCC(C)CC(C)NC(C)CC 270004a_100000209981_100011710205 [0,1,1,0,0,0|2,0,0]=4 1969 B11R0.110 CCC(C)CC(C)NC(C)CO 2230a_100000763565_100012180447 [0,1,1,0,0,0|2,0,0]=4 1970 B11R0.110 CCC(C)CC(C)N[C@H](C)CF 270004a_100102880703_100011710205 [0,1,1,0,0,0|2,0,0]=4 1971 B11R0.110 CCC(C)CC(C)N[C@H](C)CO 270004a_100000737577_100011710205 [0,1,1,0,0,0|2,0,0]=4 1972 B11R0.110 CCC(C)CN(C)CC(C)CC 2230a_100000753921_100000748023 [0,1,1,0,0,0|2,0,0]=4 1973 B11R0.110 CCC(C)CN(C)CC(C)CC 269982a_100000753921_100000748023 [0,1,1,0,0,0|2,0,0]=4 1974 B11R0.110 CCC(C)CN(C)CC(C)CC 270004a_100000753921_100000243153 [0,1,1,0,0,0|2,0,0]=4 1975 B11R0.110 CCC(C)CN(C)C[C@@H](C)CC 2230a_100000753921_100009816398 [0,1,1,0,0,0|2,0,0]=4 1976 B11R0.110 CCC(C)CN(C)C[C@@H](C)CC 269982a_100000753921_100009816398 [0,1,1,0,0,0|2,0,0]=4 1977 B11R0.110 CCC(C)CN(C)C[C@@H](C)CO 2230a_100000753921_100000059175 [0,1,1,0,0,0|2,0,0]=4 1978 B11R0.110 CCC(C)CN(C)C[C@@H](C)CO 269982a_100000753921_100000059175 [0,1,1,0,0,0|2,0,0]=4 1979 B11R0.119 CCC(C)CC(=O)CC(C)(C)C 1458a_100000211214_100000748023 [0,1,1,0,0,0|0,0,2]=4 1980 B11R0.119 CCC(C)CC(=O)CC(C)(C)O 1458a_100000693243_100000748023 [0,1,1,0,0,0|0,0,2]=4 1981 B11R0.119 CCC(C)CN(C)CC(C)(C)C 2230a_100000742839_100000748023 [0,1,1,0,0,0|2,0,0]=4 1982 B11R0.119 CCC(C)CN(C)CC(C)(C)C 269982a_100000742839_100000748023 [0,1,1,0,0,0|2,0,0]=4 1983 B11R0.119 CCC(C)CN(C)CC(C)(C)C 270004a_100000742839_100000243153 [0,1,1,0,0,0|2,0,0]=4 1984 B11R0.119 CCC(C)CN(C)CC(C)(C)C 270004a_100000753921_100011204126 [0,1,1,0,0,0|2,0,0]=4 1985 B11R0.119 CCC(C)CN(C)CC(C)(C)O 2230a_100000755907_100000748023 [0,1,1,0,0,0|2,0,0]=4 1986 B11R0.119 CCC(C)CN(C)CC(C)(C)O 269982a_100000755907_100000748023 [0,1,1,0,0,0|2,0,0]=4 1987 B11R0.119 CCC(C)CN(C)CC(C)(C)O 270004a_100000755907_100000243153 [0,1,1,0,0,0|2,0,0]=4 1988 B11R0.119 CCC(C)N[C@@H](C)CC(C)(C)C 2230a_106358413534_100000758301 [0,1,1,0,0,0|2,0,0]=4 1989 B11R0.119 CCC(C)OC(C)CC(C)(C)C 7a_200011218616_100000758301 [0,1,1,0,0,0|2,0,0]=4 1990 B11R0.119 CCN(C)CC(O)C[N+](C)(C)C 2230a_100000225621_100000032816 [0,1,1,0,0,0|2,0,0]=4 1991 B11R0.119 CCN(C)CC(O)C[N+](C)(C)C 269982a_100000225621_100000032816 [0,1,1,0,0,0|2,0,0]=4 1992 B11R0.119 CC[C@H](C)CC(=O)CC(C)(C)C 1458a_100000211214_100009816398 [0,1,1,0,0,0|0,0,2]=4 1993 B11R0.119 CC[C@H](C)CC(=O)CC(C)(C)O 1458a_100000693243_100009816398 [0,1,1,0,0,0|0,0,2]=4 1994 B11R0.119 CC[C@H](C)CN(C)CC(C)(C)C 2230a_100000742839_100009816398 [0,1,1,0,0,0|2,0,0]=4 1995 B11R0.119 CC[C@H](C)CN(C)CC(C)(C)C 269982a_100000742839_100009816398 [0,1,1,0,0,0|2,0,0]=4 1996 B11R0.119 CC[C@H](C)CN(C)CC(C)(C)O 2230a_100000755907_100009816398 [0,1,1,0,0,0|2,0,0]=4 1997 B11R0.119 CC[C@H](C)CN(C)CC(C)(C)O 269982a_100000755907_100009816398 [0,1,1,0,0,0|2,0,0]=4 1998 B11R0.255 CCC(C)NC(C)(C)CC(C)C 2230a_100011346068_100000758301 [0,1,1,0,0,0|2,0,0]=4 1999 B11R0.300 CCC(C)(C)CC(=O)CC(C)C 1458a_200000763500_100000210624 [0,1,1,0,0,0|0,0,2]=4 2000 B11R0.300 CCC(C)(C)NC(C)CC(C)C 2230a_100000211385_100000731052 [0,1,1,0,0,0|2,0,0]=4 2001 B11R0.300 CCC(C)(C)OC(C)CC(C)C 7a_100000210230_100000731052 [0,1,1,0,0,0|2,0,0]=4 2002 B11R0.300 CCC(C)(C)OC(C)CC(C)C 7a_100000211805_100000210677 [0,1,1,0,0,0|2,0,0]=4 2003 B11R0.300 CCC(C)(C)SC(C)CC(C)C 62a_100000032637_100000731052 [0,1,1,0,0,0|2,0,0]=4 2004 B11R0.300 CCC(C)(C)SC(C)CC(C)C 62a_100000731052_100000032637 [0,1,1,0,0,0|2,0,0]=4 2005 B11R0.300 CCC(C)(O)CC(=O)CC(C)C 1458a_200011219800_100000210624 [0,1,1,0,0,0|0,0,2]=4 2006 B11R0.90 C#CC(C)NCC(CO)C(C)C 34a_100000692819_200000035995 [0,1,1,0,0,0|1,0,1]=4 2007 B11R0.90 CC(C)C(CN)OC[C@@H](C)CO 34a_100000759067_100000059175 [0,1,1,0,0,0|2,0,0]=4 2008 B11R0.90 CC(C)[C@H](CO)NCC(O)CO 2230a_100011830312_100011219619 [0,1,1,0,0,0|2,0,0]=4 2009 B11R0.90 CC(C)[C@H](CO)NCC(O)CO 34a_100011830312_100011219619 [0,1,1,0,0,0|2,0,0]=4 2010 B11R0.90 CC(C)[C@H](CO)NC[C@@H](C)CO 2230a_100011830312_100000059175 [0,1,1,0,0,0|1,0,0]=3 2011 B11R0.90 CC(C)[C@H](CO)NC[C@@H](C)CO 34a_100011830312_100000059175 [0,1,1,0,0,0|1,0,0]=3 2012 B11R0.90 CC(C)[C@H](CO)NC[C@@H](O)CF 2230a_100011830312_100015614560 [0,1,1,0,0,0|2,0,0]=4 2013 B11R0.90 CC(C)[C@H](CO)NC[C@@H](O)CF 34a_100011830312_100015614560 [0,1,1,0,0,0|2,0,0]=4 2014 B11R0.90 CC(C)[C@H](CO)NC[C@@H](O)CO 2230a_100011830312_100009815848 [0,1,1,0,0,0|2,0,0]=4 2015 B11R0.90 CC(C)[C@H](CO)NC[C@@H](O)CO 34a_100011830312_100009815848 [0,1,1,0,0,0|2,0,0]=4 2016 B11R0.90 CC(CO)NCC(CO)C(C)C 34a_100000692819_100012180447 [0,1,1,0,0,0|1,0,0]=3 2017 B11R0.90 CC(CO)OCC(CN)C(C)C 34a_100000692819_100012180447 [0,1,1,0,0,0|2,0,0]=4 2018 B11R0.90 CCC(C)CNC(CC)C(C)C 270004a_100000745074_100000243153 [0,1,1,0,0,0|2,0,0]=4 2019 B11R0.90 CCC(C)CNC(CC)C(C)C 270004a_100020588543_100000210600 [0,1,1,0,0,0|2,0,0]=4 2020 B11R0.90 CCC(C)CN[C@@H](CO)C(C)C 2230a_100011830312_100000748023 [0,1,1,0,0,0|1,0,0]=3 2021 B11R0.90 CCC(C)CN[C@@H](CO)C(C)C 270004a_100011830312_100000243153 [0,1,1,0,0,0|1,0,0]=3 2022 B11R0.90 CCC(C)CN[C@@H](CO)C(C)C 34a_100011830312_100000748023 [0,1,1,0,0,0|1,0,0]=3 2023 B11R0.90 CCC(C)CN[C@H](CO)[C@@H](C)O 2230a_100015196842_100000748023 [0,1,1,0,0,0|2,0,0]=4 2024 B11R0.90 CCC(C)CN[C@H](CO)[C@@H](C)O 34a_100015196842_100000748023 [0,1,1,0,0,0|2,0,0]=4 2025 B11R0.90 CCC(C)COC(CC)C(C)C 34a_100011218073_100000748023 [0,1,1,0,0,0|2,0,0]=4 2026 B11R0.90 CCC(C)COC(CC)C(C)C 7a_100011218073_100000748023 [0,1,1,0,0,0|2,0,0]=4 2027 B11R0.90 CCC(C)COC(CN)C(C)C 34a_100000759067_100000748023 [0,1,1,0,0,0|2,0,0]=4 2028 B11R0.90 CCC(C)NCC(CC)C(C)C 269862a_100000209981_100011214906 [0,1,1,0,0,0|2,0,0]=4 2029 B11R0.90 CCC(C)NCC(CO)C(C)C 34a_100000692819_100011215416 [0,1,1,0,0,0|1,0,0]=3 2030 B11R0.90 CCC(C)OCC(CC)C(C)C 34a_100011995916_100011215416 [0,1,1,0,0,0|2,0,0]=4 2031 B11R0.90 CCC(C)OCC(CC)C(C)C 7a_100011995916_100000758301 [0,1,1,0,0,0|2,0,0]=4 2032 B11R0.90 CCC(C)OCC(CN)C(C)C 34a_100000692819_100011215416 [0,1,1,0,0,0|2,0,0]=4 2033 B11R0.90 CCC(CN[C@H](C)CF)C(C)C 269862a_100102880703_100011214906 [0,1,1,0,0,0|2,0,0]=4 2034 B11R0.90 CCC(CN[C@H](C)CO)C(C)C 269862a_100000737577_100011214906 [0,1,1,0,0,0|2,0,0]=4 2035 B11R0.90 CCC(COC(C)CO)C(C)C 34a_100011995916_100012180447 [0,1,1,0,0,0|2,0,0]=4 2036 B11R0.90 CCC(COC(C)CO)C(C)C 7a_100011995916_100012180447 [0,1,1,0,0,0|2,0,0]=4 2037 B11R0.90 CCC(NC[C@@H](C)OC)C(C)C 270004a_100020591295_100000210600 [0,1,1,0,0,0|2,0,0]=4 2038 B11R0.90 CCC(O)CN[C@@H](CO)C(C)C 2230a_100011830312_100011218378 [0,1,1,0,0,0|2,0,0]=4 2039 B11R0.90 CCC(O)CN[C@@H](CO)C(C)C 34a_100011830312_100011218378 [0,1,1,0,0,0|2,0,0]=4 2040 B11R0.90 CCC(OC[C@@H](C)CC)C(C)C 34a_100011218073_100009816398 [0,1,1,0,0,0|2,0,0]=4 2041 B11R0.90 CCC(OC[C@@H](C)CC)C(C)C 7a_100011218073_100009816398 [0,1,1,0,0,0|2,0,0]=4 2042 B11R0.90 CCC(OC[C@@H](C)CO)C(C)C 34a_100011218073_100000059175 [0,1,1,0,0,0|2,0,0]=4 2043 B11R0.90 CCC(OC[C@@H](C)CO)C(C)C 7a_100011218073_100000059175 [0,1,1,0,0,0|2,0,0]=4 2044 B11R0.90 CC[C@H](C)CN[C@@H](CO)C(C)C 2230a_100011830312_100009816398 [0,1,1,0,0,0|1,0,0]=3 2045 B11R0.90 CC[C@H](C)CN[C@@H](CO)C(C)C 34a_100011830312_100009816398 [0,1,1,0,0,0|1,0,0]=3 2046 B11R0.90 CC[C@H](C)CN[C@H](CO)[C@@H](C)O 2230a_100015196842_100009816398 [0,1,1,0,0,0|2,0,0]=4 2047 B11R0.90 CC[C@H](C)CN[C@H](CO)[C@@H](C)O 34a_100015196842_100009816398 [0,1,1,0,0,0|2,0,0]=4 2048 B11R0.90 CC[C@H](C)COC(CN)C(C)C 34a_100000759067_100009816398 [0,1,1,0,0,0|2,0,0]=4 2049 B11R0.90 C[C@@H](CO)CN[C@H](CO)[C@@H](C)O 2230a_100015196842_100000059175 [0,1,1,0,0,0|2,0,0]=4 2050 B11R0.90 C[C@@H](CO)CN[C@H](CO)[C@@H](C)O 34a_100015196842_100000059175 [0,1,1,0,0,0|2,0,0]=4 2051 B11R0.118 CCC(C)N(CC)CCC(C)C 2230a_100000207693_100000758301 [0,1,1,0,0,0|2,0,0]=4 2052 B11R0.118 CCC(C)N(CC)CCC(C)C 2230a_100000732650_100000210312 [0,1,1,0,0,0|2,0,0]=4 2053 B11R0.118 CCC(C)N(CC)CCC(C)C 269982a_100000207693_100000758301 [0,1,1,0,0,0|2,0,0]=4 2054 B11R0.118 CCC(C)N(CC)CCC(C)C 269982a_100000732650_100000210312 [0,1,1,0,0,0|2,0,0]=4 2055 B11R0.118 CCN(CCC(C)C)C(C)CO 2230a_100000207693_100012180447 [0,1,1,0,0,0|2,0,0]=4 2056 B11R0.118 CCN(CCC(C)C)C(C)CO 2230a_100000731049_100000210312 [0,1,1,0,0,0|2,0,0]=4 2057 B11R0.118 CCN(CCC(C)C)C(C)CO 269982a_100000731049_100000210312 [0,1,1,0,0,0|2,0,0]=4 2058 B11R0.118 CCN(CCC(C)C)C(C)OC 269982a_100000207693_100009879195 [0,1,1,0,0,0|2,0,0]=4 2059 B11R0.118 CCN(CCC(C)C)[C@H](C)CO 269982a_100000207693_100016084084 [0,1,1,0,0,0|2,0,0]=4 2060 B11R0.118 CC[C@H](C)[C@@H](CO)NCC(C)C 2230a_100011827617_100000210760 [0,1,1,0,0,0|1,0,0]=3 2061 B11R0.118 CC[C@H](C)[C@@H](CO)NCC(C)C 270004a_100011827617_100000210432 [0,1,1,0,0,0|1,0,0]=3 2062 B11R0.118 CC[C@H](C)[C@@H](CO)NCC(C)O 2230a_100011827617_100011218427 [0,1,1,0,0,0|2,0,0]=4 2063 B11R0.118 CC[C@H](C)[C@@H](CO)NC[C@@H](C)O 2230a_100011827617_100009817552 [0,1,1,0,0,0|2,0,0]=4 2064 B11R0.146 C=CCC(OCC(C)C)C(C)C 34a_200011216146_100000210624 [0,1,1,0,0,0|2,0,0]=4 2065 B11R0.146 C=CCC(OCC(C)C)C(C)C 7a_200011216146_100000210760 [0,1,1,0,0,0|2,0,0]=4 2066 B11R0.146 C=CCN(CCC(C)C)C(C)C 2230a_100000742772_100000210312 [0,1,1,0,0,0|2,0,0]=4 2067 B11R0.146 C=CCN(CCC(C)C)C(C)C 269982a_100000742772_100000210312 [0,1,1,0,0,0|2,0,0]=4 2068 B11R0.146 CC(C)C(CCO)NC[C@@H](C)O 2230a_100161115045_100009817552 [0,1,1,0,0,0|2,0,0]=4 2069 B11R0.146 CC(C)C(CCO)NC[C@@H](C)O 34a_100161115045_100009817552 [0,1,1,0,0,0|2,0,0]=4 2070 B11R0.146 CC(C)CCN(CCO)C(C)C 2230a_100000224655_100000210312 [0,1,1,0,0,0|1,0,0]=3 2071 B11R0.146 CC(C)CCN(CCO)C(C)C 269982a_100000224655_100000210312 [0,1,1,0,0,0|1,0,0]=3 2072 B11R0.146 CC(C)CNC(CCO)C(C)C 2230a_100161115045_100000210760 [0,1,1,0,0,0|1,0,0]=3 2073 B11R0.146 CC(C)CNC(CCO)C(C)C 270004a_100161115045_100000210432 [0,1,1,0,0,0|1,0,0]=3 2074 B11R0.146 CC(C)CNC(CCO)C(C)C 34a_100161115045_100000210624 [0,1,1,0,0,0|1,0,0]=3 2075 B11R0.146 CC(C)N(CCO)CCN(C)C 269982a_100000224655_100000755713 [0,1,1,0,0,0|2,0,0]=4 2076 B11R0.146 CC(C)OCN(CCO)C(C)C 2230a_100000224655_100000709892 [0,1,1,0,0,0|2,0,0]=4 2077 B11R0.146 CC(C)OCN(CCO)C(C)C 269982a_100000224655_100000709892 [0,1,1,0,0,0|2,0,0]=4 2078 B11R0.146 CC(O)CCN(CCO)C(C)C 2230a_100000224655_100012276601 [0,1,1,0,0,0|2,0,0]=4 2079 B11R0.146 CC(O)CCN(CCO)C(C)C 269982a_100000224655_100012276601 [0,1,1,0,0,0|2,0,0]=4 2080 B11R0.146 CC(O)CNC(CCO)C(C)C 2230a_100161115045_100011218427 [0,1,1,0,0,0|2,0,0]=4 2081 B11R0.146 CC(O)CNC(CCO)C(C)C 34a_100161115045_100011218427 [0,1,1,0,0,0|2,0,0]=4 2082 B11R0.146 CCCC(OCC(C)C)C(C)C 34a_200011215069_100000210624 [0,1,1,0,0,0|2,0,0]=4 2083 B11R0.146 CCCC(OCC(C)C)C(C)C 7a_200011215069_100000210760 [0,1,1,0,0,0|2,0,0]=4 2084 B11R0.146 CCCN(CCC(C)C)C(C)C 2230a_106256033942_100000210312 [0,1,1,0,0,0|2,0,0]=4 2085 B11R0.146 CCCN(CCC(C)C)C(C)C 269982a_106256033942_100000210312 [0,1,1,0,0,0|2,0,0]=4 2086 B11R0.146 COCC(NCC(C)C)C(C)C 2230a_100000760233_100000210760 [0,1,1,0,0,0|1,0,0]=3 2087 B11R0.146 COCC(NCC(C)C)C(C)C 270004a_100000760233_100000210432 [0,1,1,0,0,0|1,0,0]=3 2088 B11R0.146 COCC(NCC(C)O)C(C)C 2230a_100000760233_100011218427 [0,1,1,0,0,0|2,0,0]=4 2089 B11R0.146 COCC(NC[C@@H](C)O)C(C)C 2230a_100000760233_100009817552 [0,1,1,0,0,0|2,0,0]=4 2090 B11R0.275 CC(C)C(=O)N[C@@H](CO)C(C)C 240690a_100011830312_100000210198 [0,1,1,0,0,0|1,0,1]=4 2091 B11R0.275 CC(C)C(=O)N[C@@H](CO)C(C)C 527a_100011830312_100000210198 [0,1,1,0,0,0|1,0,1]=4 2092 B11R0.275 CCC(NC(C)C(C)C)C(C)C 270004a_100000211541_100000210600 [0,1,1,0,0,0|2,0,0]=4 2093 B11R0.276 CC(C)CN[C@H](CO)C(C)(C)C 2230a_100000763378_100000210760 [0,1,1,0,0,0|1,0,0]=3 2094 B11R0.276 CC(C)CN[C@H](CO)C(C)(C)C 270004a_100000763378_100000210432 [0,1,1,0,0,0|1,0,0]=3 2095 B11R0.276 CC(O)CN[C@H](CO)C(C)(C)C 2230a_100000763378_100011218427 [0,1,1,0,0,0|2,0,0]=4 2096 B11R0.276 CCC(OCC(C)C)C(C)(C)C 7a_100011215073_100000210760 [0,1,1,0,0,0|2,0,0]=4 2097 B11R0.276 CCN(CCC(C)C)C(C)(C)C 2230a_100011200764_100000210312 [0,1,1,0,0,0|2,0,0]=4 2098 B11R0.276 CCN(CCC(C)C)C(C)(C)C 269982a_100000207693_100000210625 [0,1,1,0,0,0|2,0,0]=4 2099 B11R0.276 CCN(CCC(C)C)C(C)(C)C 269982a_100011200764_100000210312 [0,1,1,0,0,0|2,0,0]=4 2100 B11R0.276 C[C@@H](O)CN[C@H](CO)C(C)(C)C 2230a_100000763378_100009817552 [0,1,1,0,0,0|2,0,0]=4 2101 B11R0.313 CC(C)C(CN)COC(C)(C)C 34a_100000692819_100000210625 [0,1,1,0,0,0|2,0,0]=4 2102 B11R0.313 CC(C)C(CN)OCC(C)(C)C 34a_100000759067_100011219605 [0,1,1,0,0,0|2,0,0]=4 2103 B11R0.313 CC(C)C(CN)OCC(C)(C)F 34a_100000759067_100011997219 [0,1,1,0,0,0|2,0,0]=4 2104 B11R0.313 CC(C)C(CN)OCC(C)(C)O 34a_100000759067_100000764493 [0,1,1,0,0,0|2,0,0]=4 2105 B11R0.313 CC(C)C(CO)CNC(C)(C)C 34a_100000692819_100000210625 [0,1,1,0,0,0|1,0,0]=3 2106 B11R0.313 CC(C)[C@H](CO)NCC(C)(C)C 270004a_100011830312_100011204126 [0,1,1,0,0,0|1,0,0]=3 2107 B11R0.313 CC(C)[C@H](CO)NCC(C)(C)C 34a_100011830312_100011219605 [0,1,1,0,0,0|1,0,0]=3 2108 B11R0.313 CC(C)[C@H](CO)NCC(C)(C)F 34a_100011830312_100011997219 [0,1,1,0,0,0|1,0,0]=3 2109 B11R0.313 CC(C)[C@H](CO)NCC(C)(C)O 34a_100011830312_100000764493 [0,1,1,0,0,0|1,0,0]=3 2110 B11R0.313 CC(C)[C@H](CO)NC[Si](C)(C)C 2230a_100011830312_100000037933 [0,1,1,0,0,0|1,1,0]=4 2111 B11R0.313 CCC(COC(C)(C)C)C(C)C 34a_100011995916_100000210625 [0,1,1,0,0,0|2,0,0]=4 2112 B11R0.313 CCC(NCC(C)(C)C)C(C)C 270004a_100000743828_100000210600 [0,1,1,0,0,0|2,0,0]=4 2113 B11R0.313 CCC(NCC(C)(C)C)C(C)C 270004a_100000745074_100011204126 [0,1,1,0,0,0|2,0,0]=4 2114 B11R0.313 CCC(NCC(C)(C)F)C(C)C 270004a_100020643315_100000210600 [0,1,1,0,0,0|2,0,0]=4 2115 B11R0.313 CCC(NCC(C)(C)O)C(C)C 270004a_100000751335_100000210600 [0,1,1,0,0,0|2,0,0]=4 2116 B11R0.313 CCC(OCC(C)(C)C)C(C)C 34a_100011218073_100011219605 [0,1,1,0,0,0|2,0,0]=4 2117 B11R0.313 CCC(OCC(C)(C)F)C(C)C 34a_100011218073_100011997219 [0,1,1,0,0,0|2,0,0]=4 2118 B11R0.313 CCC(OCC(C)(C)O)C(C)C 34a_100011218073_100000764493 [0,1,1,0,0,0|2,0,0]=4 2119 B11R0.313 CCC(OCC(C)(C)O)C(C)C 7a_100011218073_100000764493 [0,1,1,0,0,0|2,0,0]=4 2120 B11R0.313 CCN(CCC(C)(C)C)C(C)C 2230a_100000223864_100000755188 [0,1,1,0,0,0|2,0,0]=4 2121 B11R0.313 CCN(CCC(C)(C)C)C(C)C 269982a_100000223864_100000755188 [0,1,1,0,0,0|2,0,0]=4 2122 B11R0.313 CCN(CCC(C)(C)O)C(C)C 2230a_100000223864_100000702414 [0,1,1,0,0,0|2,0,0]=4 2123 B11R0.313 C[C@@H](O)[C@@H](CO)NCC(C)(C)C 34a_100015196842_100011219605 [0,1,1,0,0,0|2,0,0]=4 2124 B11R0.313 C[C@@H](O)[C@@H](CO)NCC(C)(C)F 34a_100015196842_100011997219 [0,1,1,0,0,0|2,0,0]=4 2125 B11R0.313 C[C@@H](O)[C@@H](CO)NCC(C)(C)O 34a_100015196842_100000764493 [0,1,1,0,0,0|2,0,0]=4 2126 B11R0.7 CCCC(C)N(CC)C(C)(C)C 2230a_100011200764_100000766640 [0,1,1,0,0,0|2,0,0]=4 2127 B11R0.7 CCCC(C)N(CC)C(C)(C)C 269982a_100011200764_100000766640 [0,1,1,0,0,0|2,0,0]=4 2128 B11R0.15 CCCC(CC)N(CC)C(C)C 269982a_100000223864_100011219200 [0,1,1,0,0,0|2,0,0]=4 2129 B11R0.15 CCCC(CC)N(CC)C(C)C 270004a_100000223864_100000687865 [0,1,1,0,0,0|2,0,0]=4 2130 B11R0.15 CCCN(CC)C(CC)C(C)C 270004a_100000226822_100000210600 [0,1,1,0,0,0|2,0,0]=4 2131 B11R0.53 CCCC(C)N(CC)C(C)CC 2230a_100000732650_100000766640 [0,1,1,0,0,0|2,0,0]=4 2132 B11R0.53 CCCC(C)N(CC)C(C)CC 269982a_100000732650_100000766640 [0,1,1,0,0,0|2,0,0]=4 2133 B11R0.53 CCCC(C)N(CC)C(C)CC 270004a_100000732650_100000211909 [0,1,1,0,0,0|2,0,0]=4 2134 B11R0.53 CCCC(C)N(CC)C(C)CO 2230a_100000731049_100000766640 [0,1,1,0,0,0|2,0,0]=4 2135 B11R0.53 CCCC(C)N(CC)C(C)CO 269982a_100000731049_100000766640 [0,1,1,0,0,0|2,0,0]=4 2136 B11R0.53 CCCC(C)N(CC)C(C)CO 270004a_100000731049_100000211909 [0,1,1,0,0,0|2,0,0]=4 2137 B11R0.57 CCCC(=O)C(SCC)C(C)C 1458a_100000750736_100000210303 [0,1,1,0,0,0|0,0,2]=4 2138 B11R0.57 CCCC(C)C(OCC)C(C)C 34a_200011290769_100000210202 [0,1,1,0,0,0|1,0,0]=3 2139 B11R0.57 CCCC(C)C(OCC)C(C)C 7a_200011290769_100000210202 [0,1,1,0,0,0|1,0,0]=3 2140 B11R0.57 CCCC(C)C(OCF)C(C)C 34a_200011290769_100015361967 [0,1,1,0,0,0|2,0,0]=4 2141 B11R0.57 CCCC(C)C(OCF)C(C)C 7a_200011290769_100015361967 [0,1,1,0,0,0|2,0,0]=4 2142 B11R0.57 CCCC(C)N(CCC)C(C)C 2230a_106256033942_100000766640 [0,1,1,0,0,0|2,0,0]=4 2143 B11R0.57 CCCC(C)N(CCC)C(C)C 269982a_106256033942_100000766640 [0,1,1,0,0,0|2,0,0]=4 2144 B11R0.57 CCCC(C)N(CCC)C(C)C 270004a_106256033942_100000211909 [0,1,1,0,0,0|2,0,0]=4 2145 B11R0.57 CCCC(C)N(CCO)C(C)C 2230a_100000224655_100000766640 [0,1,1,0,0,0|2,0,0]=4 2146 B11R0.57 CCCC(C)N(CCO)C(C)C 269982a_100000224655_100000766640 [0,1,1,0,0,0|2,0,0]=4 2147 B11R0.57 CCCC(C)N(CCO)C(C)C 270004a_100000224655_100000211909 [0,1,1,0,0,0|2,0,0]=4 2148 B11R0.238 CCC(C(C)C)N(C)CCCO 270004a_100000213112_100000210600 [0,1,1,0,0,0|2,0,0]=4 2149 B11R0.238 CCC(C(C)C)N(C)CCOC 270004a_100000743101_100000210600 [0,1,1,0,0,0|2,0,0]=4 2150 B11R0.238 CCC(C(C)C)N(C)CCSC 270004a_100000686725_100000210600 [0,1,1,0,0,0|2,0,0]=4 2151 B11R0.238 CCCCC(C)N(CC)C(C)C 2230a_100000223864_200011215066 [0,1,1,0,0,0|2,0,0]=4 2152 B11R0.238 CCCCC(C)N(CC)C(C)C 269982a_100000223864_200011215066 [0,1,1,0,0,0|2,0,0]=4 2153 B11R0.238 CCCCC(C)N(CC)C(C)C 270004a_100000223864_100000210087 [0,1,1,0,0,0|2,0,0]=4 2154 B11R0.238 CCCCN(C)C(CC)C(C)C 270004a_100000207549_100000210600 [0,1,1,0,0,0|2,0,0]=4 2155 B11R0.238 CCN(C(C)C)C(C)CCOC 270004a_100000223864_100000742357 [0,1,1,0,0,0|2,0,0]=4 2156 B11R0.238 CCN(C(C)C)C(C)CCSC 270004a_100000223864_100011217047 [0,1,1,0,0,0|2,0,0]=4 2157 B11R0.238 CCSCC(C)N(CC)C(C)C 270004a_100000223864_200011216171 [0,1,1,0,0,0|2,0,0]=4 2158 B11R0.278 CCC(C)C(C)N(CC)C(C)C 270004a_100000223864_100000210599 [0,1,1,0,0,0|2,0,0]=4 2159 B11R0.278 CCC(C)N(C)C(CC)C(C)C 270004a_100000741768_100000210600 [0,1,1,0,0,0|2,0,0]=4 2160 B11R1.3 C#CC1CCC(CC1)N(C)C 270004a_100102631434_100000722563 [1,1,0,0,0,0|1,0,1]=4 2161 B11R1.3 C#CC1CCN(CC1)C(C)C 2230a_100016991398_100000210206 [1,1,0,0,0,0|1,0,1]=4 2162 B11R1.3 C#CC1CCN(CC1)C(C)C 269982a_100016991398_100000210206 [1,1,0,0,0,0|1,0,1]=4 2163 B11R1.3 C#CC1CCN(CC1)C(C)C 34a_100016991398_100000210206 [1,1,0,0,0,0|1,0,1]=4 2164 B11R1.3 CC(=O)C1CCC(CC1)CO 1458a_100011217856_200000210301 [1,1,0,0,0,0|1,0,1]=4 2165 B11R1.3 CC(C)C1CCC(CC1)N[13CH3] 2230a_100011734324_200025704644 [1,1,0,0,0,0|0,0,0]=2 2166 B11R1.3 CC(C)C1CCC(CC1)N[13CH3] 34a_100011734324_200025704644 [1,1,0,0,0,0|0,0,0]=2 2167 B11R1.3 CC(C)C1CCC(CC1)O[13CH3] 34a_100011734483_200025704644 [1,1,0,0,0,0|0,0,0]=2 2168 B11R1.3 CC(C)C1CCC(CC1)O[13CH3] 7a_100011734483_200025704644 [1,1,0,0,0,0|0,0,0]=2 2169 B11R1.3 CC(C)C1CCN(CC1)CF 269982a_100000762885_100015361967 [1,1,0,0,0,0|1,0,0]=3 2170 B11R1.3 CC(C)C1CCN(CC1)CF 34a_100000762885_100015361967 [1,1,0,0,0,0|1,0,0]=3 2171 B11R1.3 CC(C)N1CCC(CC1)C#N 2230a_100000747632_100000210206 [1,1,0,0,0,0|1,0,1]=4 2172 B11R1.3 CC(C)N1CCC(CC1)CF 2230a_100015203933_100000210206 [1,1,0,0,0,0|1,0,0]=3 2173 B11R1.3 CC(C)N1CCC(CC1)CF 269982a_100015203933_100000210206 [1,1,0,0,0,0|1,0,0]=3 2174 B11R1.3 CC(C)N1CCC(CC1)CF 34a_100015203933_100000210206 [1,1,0,0,0,0|1,0,0]=3 2175 B11R1.3 CC(C)N1CCC(CC1)CO 2230a_100000738675_100000210206 [1,1,0,0,0,0|1,0,0]=3 2176 B11R1.3 CC(C)N1CCC(CC1)CO 269982a_100000738675_100000210206 [1,1,0,0,0,0|1,0,0]=3 2177 B11R1.3 CC(C)N1CCC(CC1)CO 34a_100000738675_100000210206 [1,1,0,0,0,0|1,0,0]=3 2178 B11R1.3 CC(C)N1CCC(CC1)N[13CH3] 2230a_100000198580_200025704644 [1,1,0,0,0,0|1,0,0]=3 2179 B11R1.3 CC(C)N1CCC(CC1)O[13CH3] 34a_100000209593_200025704644 [1,1,0,0,0,0|1,0,0]=3 2180 B11R1.3 CC(C)N1CCC(CC1)O[13CH3] 7a_100000209593_200025704644 [1,1,0,0,0,0|1,0,0]=3 2181 B11R1.3 CC(C)N1CCN(CC1)CF 269982a_100000246833_100015361967 [1,1,0,0,0,0|2,0,0]=4 2182 B11R1.3 CC(O)C1CCN(CC1)CF 269982a_100011728446_100015361967 [1,1,0,0,0,0|2,0,0]=4 2183 B11R1.3 CC(O)C1CCN(CC1)CF 34a_100011728446_100015361967 [1,1,0,0,0,0|2,0,0]=4 2184 B11R1.3 CCC1CCC(CC1)N(C)C 2230a_100000207529_200000210301 [1,1,0,0,0,0|1,0,0]=3 2185 B11R1.3 CCC1CCC(CC1)N(C)C 269982a_100000207529_200000210301 [1,1,0,0,0,0|1,0,0]=3 2186 B11R1.3 CCC1CCC(CC1)N(C)C 270004a_100102631434_100000210631 [1,1,0,0,0,0|1,0,0]=3 2187 B11R1.3 CCC1CCC(CC1)N(C)C 34a_100000207529_200000210301 [1,1,0,0,0,0|1,0,0]=3 2188 B11R1.3 CCC1CCC(CC1)N(C)[13CH3] 2230a_100000207529_200025704644 [1,1,0,0,0,0|1,0,0]=3 2189 B11R1.3 CCC1CCC(CC1)N(C)[13CH3] 269982a_100000207529_200025704644 [1,1,0,0,0,0|1,0,0]=3 2190 B11R1.3 CCC1CCC(CC1)N(C)[13CH3] 34a_100000207529_200025704644 [1,1,0,0,0,0|1,0,0]=3 2191 B11R1.3 CCC1CCN(CC1)C(C)C 2230a_100000754474_100000210206 [1,1,0,0,0,0|1,0,0]=3 2192 B11R1.3 CCC1CCN(CC1)C(C)C 269982a_100000754474_100000210206 [1,1,0,0,0,0|1,0,0]=3 2193 B11R1.3 CCC1CCN(CC1)C(C)C 34a_100000754474_100000210206 [1,1,0,0,0,0|1,0,0]=3 2194 B11R1.3 CCN1CCC(CC1)C(C)C 2230a_100000762885_100000210202 [1,1,0,0,0,0|1,0,0]=3 2195 B11R1.3 CCN1CCC(CC1)C(C)C 269982a_100000762885_100000204670 [1,1,0,0,0,0|1,0,0]=3 2196 B11R1.3 CCN1CCC(CC1)C(C)C 34a_100000762885_100000210202 [1,1,0,0,0,0|1,0,0]=3 2197 B11R1.3 CCN1CCC(CC1)C(C)O 2230a_100011728446_100000210202 [1,1,0,0,0,0|2,0,0]=4 2198 B11R1.3 CCN1CCC(CC1)C(C)O 269982a_100011728446_100000204670 [1,1,0,0,0,0|2,0,0]=4 2199 B11R1.3 CCN1CCC(CC1)C(C)O 34a_100011728446_100000210202 [1,1,0,0,0,0|2,0,0]=4 2200 B11R1.3 CCN1CCC(CC1)N(C)C 2230a_100000207535_200000210301 [1,1,0,0,0,0|2,0,0]=4 2201 B11R1.3 CCN1CCC(CC1)N(C)C 2230a_100011226131_100000210202 [1,1,0,0,0,0|2,0,0]=4 2202 B11R1.3 CCN1CCC(CC1)N(C)C 269982a_100000207535_200000210301 [1,1,0,0,0,0|2,0,0]=4 2203 B11R1.3 CCN1CCC(CC1)N(C)C 269982a_100011226131_100000204670 [1,1,0,0,0,0|2,0,0]=4 2204 B11R1.3 CCN1CCC(CC1)N(C)C 270004a_100102631434_100000211075 [1,1,0,0,0,0|2,0,0]=4 2205 B11R1.3 CCN1CCC(CC1)N(C)[13CH3] 2230a_100000207535_200025704644 [1,1,0,0,0,0|2,0,0]=4 2206 B11R1.3 CCN1CCC(CC1)N(C)[13CH3] 269982a_100000207535_200025704644 [1,1,0,0,0,0|2,0,0]=4 2207 B11R1.3 CCN1CCN(CC1)C(C)C 2230a_100000210033_100000210206 [1,1,0,0,0,0|2,0,0]=4 2208 B11R1.3 CCN1CCN(CC1)C(C)C 2230a_100000246833_100000210202 [1,1,0,0,0,0|2,0,0]=4 2209 B11R1.3 CCN1CCN(CC1)C(C)C 269982a_100000210033_100000210206 [1,1,0,0,0,0|2,0,0]=4 2210 B11R1.3 CCN1CCN(CC1)C(C)C 269982a_100000246833_100000204670 [1,1,0,0,0,0|2,0,0]=4 2211 B11R1.3 CC[C@H]1CC[C@@H](CC1)C(=O)C 1458a_100000709782_200000210301 [1,1,0,0,0,0|1,0,1]=4 2212 B11R1.3 CC[C@H]1CC[C@@H](CC1)C(=O)[13CH3] 1458a_100000709782_200025704644 [1,1,0,0,0,0|1,0,1]=4 2213 B11R1.3 CN(C)C1CCC(CC1)C#N 270004a_100102631434_100009880307 [1,1,0,0,0,0|1,0,1]=4 2214 B11R1.3 CN(C)C1CCC(CC1)CO 270004a_100102631434_100000062911 [1,1,0,0,0,0|1,0,0]=3 2215 B11R1.3 CN(C)C1CCN(CC1)CF 269982a_100011226131_100015361967 [1,1,0,0,0,0|2,0,0]=4 2216 B11R1.3 CN(C)[C@H]1CC[C@@H](CC1)CO 2230a_100009831571_200000210301 [1,1,0,0,0,0|1,0,0]=3 2217 B11R1.3 CN(C)[C@H]1CC[C@@H](CC1)CO 269982a_100009831571_200000210301 [1,1,0,0,0,0|1,0,0]=3 2218 B11R1.3 CN(C)[C@H]1CC[C@@H](CC1)CO 34a_100009831571_200000210301 [1,1,0,0,0,0|1,0,0]=3 2219 B11R1.3 CN([13CH3])[C@H]1CC[C@@H](CC1)CO 2230a_100009831571_200025704644 [1,1,0,0,0,0|1,0,0]=3 2220 B11R1.3 CN([13CH3])[C@H]1CC[C@@H](CC1)CO 269982a_100009831571_200025704644 [1,1,0,0,0,0|1,0,0]=3 2221 B11R1.3 CN([13CH3])[C@H]1CC[C@@H](CC1)CO 34a_100009831571_200025704644 [1,1,0,0,0,0|1,0,0]=3 2222 B11R1.3 CNC1CCC(CC1)C(C)C 2230a_100011734324_200000210301 [1,1,0,0,0,0|0,0,0]=2 2223 B11R1.3 CNC1CCC(CC1)C(C)C 270004a_106832991635_100000748182 [1,1,0,0,0,0|0,0,0]=2 2224 B11R1.3 CNC1CCC(CC1)C(C)C 34a_100011734324_200000210301 [1,1,0,0,0,0|0,0,0]=2 2225 B11R1.3 CNC1CCC(CC1)N(C)C 270004a_100102631434_200016988011 [1,1,0,0,0,0|1,0,0]=3 2226 B11R1.3 CNC1CCC(CC1)N(C)C 270004a_106832991635_100020631289 [1,1,0,0,0,0|1,0,0]=3 2227 B11R1.3 CNC1CCN(CC1)C(C)C 2230a_100000198580_200000210301 [1,1,0,0,0,0|1,0,0]=3 2228 B11R1.3 CNC1CCN(CC1)C(C)C 270004a_106832991635_100000210694 [1,1,0,0,0,0|1,0,0]=3 2229 B11R1.3 CNC1CCN(CC1)N(C)C 270004a_106832991635_100009989500 [1,1,0,0,0,0|2,0,0]=4 2230 B11R1.3 COC1CCC(CC1)C(=O)C 1458a_100011215563_200000210301 [1,1,0,0,0,0|1,0,1]=4 2231 B11R1.3 COC1CCC(CC1)C(=O)[13CH3] 1458a_100011215563_200025704644 [1,1,0,0,0,0|1,0,1]=4 2232 B11R1.3 COC1CCC(CC1)C(C)C 34a_100011734483_200000210301 [1,1,0,0,0,0|0,0,0]=2 2233 B11R1.3 COC1CCC(CC1)C(C)C 7a_100011734483_200000210301 [1,1,0,0,0,0|0,0,0]=2 2234 B11R1.3 COC1CCC(CC1)N(C)C 270004a_100102631434_100000747084 [1,1,0,0,0,0|1,0,0]=3 2235 B11R1.3 COC1CCN(CC1)C(C)C 2230a_100000234800_100000210206 [1,1,0,0,0,0|1,0,0]=3 2236 B11R1.3 COC1CCN(CC1)C(C)C 269982a_100000234800_100000210206 [1,1,0,0,0,0|1,0,0]=3 2237 B11R1.3 COC1CCN(CC1)C(C)C 34a_100000209593_200000210301 [1,1,0,0,0,0|1,0,0]=3 2238 B11R1.3 COC1CCN(CC1)C(C)C 34a_100000234800_100000210206 [1,1,0,0,0,0|1,0,0]=3 2239 B11R1.3 COC1CCN(CC1)C(C)C 7a_100000209593_200000210301 [1,1,0,0,0,0|1,0,0]=3 2240 B11R1.3 CSC1CCN(CC1)C(C)C 2230a_100015202541_100000210206 [1,1,0,0,0,0|1,0,0]=3 2241 B11R1.3 CSC1CCN(CC1)C(C)C 269982a_100015202541_100000210206 [1,1,0,0,0,0|1,0,0]=3 2242 B11R1.3 CSC1CCN(CC1)C(C)C 34a_100015202541_100000210206 [1,1,0,0,0,0|1,0,0]=3 2243 B11R1.3 [13CH3]C(=O)C1CCC(CC1)CO 1458a_100011217856_200025704644 [1,1,0,0,0,0|1,0,1]=4 2244 B11R1.19 CC(C)(C)C1CCN(CC1)[13CH3] 2230a_100000717223_200025704644 [1,1,0,0,0,0|1,0,0]=3 2245 B11R1.19 CC(C)(C)C1CCN(CC1)[13CH3] 269982a_100000717223_200025704644 [1,1,0,0,0,0|1,0,0]=3 2246 B11R1.19 CC(C)(C)C1CCN(CC1)[13CH3] 34a_100000717223_200025704644 [1,1,0,0,0,0|1,0,0]=3 2247 B11R1.19 CC(C)(C)N1CCC(CC1)F 269982a_100015193889_100000210625 [1,1,0,0,0,0|2,0,0]=4 2248 B11R1.19 CC(C)(C)N1CCC(CC1)F 34a_100015193889_100000210625 [1,1,0,0,0,0|2,0,0]=4 2249 B11R1.19 CC(C)(C)N1CCC(CC1)O 269982a_100025773856_100000210625 [1,1,0,0,0,0|2,0,0]=4 2250 B11R1.19 CC(C)(C)N1CCN(CC1)[13CH3] 2230a_100000743320_200025704644 [1,1,0,0,0,0|2,0,0]=4 2251 B11R1.19 CC(C)(C)N1CCN(CC1)[13CH3] 269982a_100000743320_200025704644 [1,1,0,0,0,0|2,0,0]=4 2252 B11R1.19 CC(C)(O)C1CCN(CC1)[13CH3] 2230a_100025784243_200025704644 [1,1,0,0,0,0|1,0,0]=3 2253 B11R1.19 CC(C)(O)C1CCN(CC1)[13CH3] 269982a_100025784243_200025704644 [1,1,0,0,0,0|1,0,0]=3 2254 B11R1.19 CC(C)(O)C1CCN(CC1)[13CH3] 34a_100025784243_200025704644 [1,1,0,0,0,0|1,0,0]=3 2255 B11R1.19 CC1CCN(CC1)C(C)(C)C 269982a_100000188429_100000210625 [1,1,0,0,0,0|1,0,0]=3 2256 B11R1.19 CC1CCN(CC1)C(C)(C)C 34a_100000188429_100000210625 [1,1,0,0,0,0|1,0,0]=3 2257 B11R1.19 CN1CCC(CC1)C(C)(C)C 2230a_100000717223_200000210301 [1,1,0,0,0,0|1,0,0]=3 2258 B11R1.19 CN1CCC(CC1)C(C)(C)C 269982a_100000717223_200000210301 [1,1,0,0,0,0|1,0,0]=3 2259 B11R1.19 CN1CCC(CC1)C(C)(C)C 34a_100000717223_200000210301 [1,1,0,0,0,0|1,0,0]=3 2260 B11R1.19 CN1CCC(CC1)C(C)(C)O 2230a_100025784243_200000210301 [1,1,0,0,0,0|1,0,0]=3 2261 B11R1.19 CN1CCC(CC1)C(C)(C)O 269982a_100025784243_200000210301 [1,1,0,0,0,0|1,0,0]=3 2262 B11R1.19 CN1CCC(CC1)C(C)(C)O 34a_100025784243_200000210301 [1,1,0,0,0,0|1,0,0]=3 2263 B11R1.19 CN1CCN(CC1)C(C)(C)C 2230a_100000743320_200000210301 [1,1,0,0,0,0|2,0,0]=4 2264 B11R1.19 CN1CCN(CC1)C(C)(C)C 269982a_100000188432_100000210625 [1,1,0,0,0,0|2,0,0]=4 2265 B11R1.19 CN1CCN(CC1)C(C)(C)C 269982a_100000743320_200000210301 [1,1,0,0,0,0|2,0,0]=4 2266 B11R1.21 CC(C)N1CCN([C@H](C1)C)C 2230a_100020603432_100000210206 [1,1,0,0,0,0|2,0,0]=4 2267 B11R1.21 CC(C)N1CCN([C@H](C1)C)C 2230a_100102564438_200000210301 [1,1,0,0,0,0|2,0,0]=4 2268 B11R1.21 CC(C)N1CCN([C@H](C1)C)C 269982a_100020603432_100000210206 [1,1,0,0,0,0|2,0,0]=4 2269 B11R1.21 CC(C)N1CCN([C@H](C1)C)C 269982a_100102564438_200000210301 [1,1,0,0,0,0|2,0,0]=4 2270 B11R1.21 CC(C)N1CCN([C@H](C1)C)C 34a_100102564438_200000210301 [1,1,0,0,0,0|2,0,0]=4 2271 B11R1.21 CC(C)N1CCN([C@H](C1)C)[13CH3] 2230a_100102564438_200025704644 [1,1,0,0,0,0|2,0,0]=4 2272 B11R1.21 CC(C)N1CCN([C@H](C1)C)[13CH3] 269982a_100102564438_200025704644 [1,1,0,0,0,0|2,0,0]=4 2273 B11R1.21 CC(C)N1CCN([C@H](C1)C)[13CH3] 34a_100102564438_200025704644 [1,1,0,0,0,0|2,0,0]=4 2274 B11R1.21 CC(C)N1CC[C@H]([C@H](C1)F)O 2230a_200016994291_100000210206 [1,1,0,0,0,0|2,0,0]=4 2275 B11R1.21 CC(C)N1CC[C@H]([C@H](C1)F)O 269982a_200016994291_100000210206 [1,1,0,0,0,0|2,0,0]=4 2276 B11R1.21 CC(C)N1CC[C@H]([C@H](C1)O)O 2230a_100000690696_100000210206 [1,1,0,0,0,0|2,0,0]=4 2277 B11R1.21 CC(C)N1CC[C@H]([C@H](C1)O)O 269982a_100000690696_100000210206 [1,1,0,0,0,0|2,0,0]=4 2278 B11R1.21 CC1CC(CCN1C)N(C)C 2230a_206256037340_200000210301 [1,1,0,0,0,0|2,0,0]=4 2279 B11R1.21 CC1CC(CCN1C)N(C)C 269982a_206256037340_200000210301 [1,1,0,0,0,0|2,0,0]=4 2280 B11R1.21 CC1CC(CCN1[13CH3])N(C)C 2230a_206256037340_200025704644 [1,1,0,0,0,0|2,0,0]=4 2281 B11R1.21 CC1CC(CCN1[13CH3])N(C)C 269982a_206256037340_200025704644 [1,1,0,0,0,0|2,0,0]=4 2282 B11R1.21 CC1CCC(CC1C)N(C)C 270004a_100102631434_100000759390 [1,1,0,0,0,0|1,0,0]=3 2283 B11R1.21 CC1CCN(CC1O)C(C)C 2230a_100000696640_100000210206 [1,1,0,0,0,0|1,0,0]=3 2284 B11R1.21 CC1CCN(CC1O)C(C)C 269982a_100000696640_100000210206 [1,1,0,0,0,0|1,0,0]=3 2285 B11R1.21 CC1CN(CCC1O)C(C)C 2230a_100011998114_100000210206 [1,1,0,0,0,0|2,0,0]=4 2286 B11R1.21 CC1CN(CCC1O)C(C)C 269982a_100011998114_100000210206 [1,1,0,0,0,0|2,0,0]=4 2287 B11R1.22 C#CC(C)N1CCC(CC1)C 34a_100000188429_200000035995 [1,1,0,0,0,0|1,0,1]=4 2288 B11R1.22 C=CC(C)N1CCC(CC1)C 269982a_100000188429_100011215867 [1,1,0,0,0,0|1,0,1]=4 2289 B11R1.22 CC(CO)N1CCC(CC1)F 2230a_100015193889_100012180447 [1,1,0,0,0,0|2,0,0]=4 2290 B11R1.22 CC(CO)N1CCC(CC1)F 34a_100015193889_100012180447 [1,1,0,0,0,0|2,0,0]=4 2291 B11R1.22 CC(CO)N1CCC(CC1)O 2230a_100025773856_100012180447 [1,1,0,0,0,0|2,0,0]=4 2292 B11R1.22 CC(CO)N1CCN(CC1)C 2230a_100000188432_100012180447 [1,1,0,0,0,0|2,0,0]=4 2293 B11R1.22 CC(CO)N1CCN(CC1)C 2230a_100000751876_200000210301 [1,1,0,0,0,0|2,0,0]=4 2294 B11R1.22 CC(CO)N1CCN(CC1)C 269982a_100000751876_200000210301 [1,1,0,0,0,0|2,0,0]=4 2295 B11R1.22 CC(CO)N1CCN(CC1)[13CH3] 2230a_100000751876_200025704644 [1,1,0,0,0,0|2,0,0]=4 2296 B11R1.22 CC(CO)N1CCN(CC1)[13CH3] 269982a_100000751876_200025704644 [1,1,0,0,0,0|2,0,0]=4 2297 B11R1.22 CC1CCC(CC1)C(=O)CO 1458a_100000210174_200011216234 [1,1,0,0,0,0|1,0,1]=4 2298 B11R1.22 CC1CCN(CC1)C(C)C#N 2230a_100000188429_100000184139 [1,1,0,0,0,0|1,0,1]=4 2299 B11R1.22 CC1CCN(CC1)C(C)C#N 269982a_100000188429_100000703298 [1,1,0,0,0,0|1,0,1]=4 2300 B11R1.22 CC1CCN(CC1)C(C)CO 2230a_100000188429_100012180447 [1,1,0,0,0,0|1,0,0]=3 2301 B11R1.22 CC1CCN(CC1)C(C)CO 34a_100000188429_100012180447 [1,1,0,0,0,0|1,0,0]=3 2302 B11R1.22 CC1CCN(CC1)[C@H](C)CO 269982a_100000188429_100016084084 [1,1,0,0,0,0|1,0,0]=3 2303 B11R1.22 CCC(=O)C1CCC(CC1)C 1458a_100000210414_200011216234 [1,1,0,0,0,0|1,0,1]=4 2304 B11R1.22 CCC(=O)[C@H]1CC[C@@H](CC1)C 1458a_100009815934_100000210202 [1,1,0,0,0,0|1,0,1]=4 2305 B11R1.22 CCC(C)N1CCC(CC1)C 2230a_100000188429_100000758301 [1,1,0,0,0,0|1,0,0]=3 2306 B11R1.22 CCC(C)N1CCC(CC1)C 269982a_100000188429_100000758301 [1,1,0,0,0,0|1,0,0]=3 2307 B11R1.22 CCC(C)N1CCC(CC1)C 34a_100000188429_100011215416 [1,1,0,0,0,0|1,0,0]=3 2308 B11R1.22 CCC(C)N1CCC(CC1)F 2230a_100015193889_100000758301 [1,1,0,0,0,0|2,0,0]=4 2309 B11R1.22 CCC(C)N1CCC(CC1)F 269982a_100015193889_100000758301 [1,1,0,0,0,0|2,0,0]=4 2310 B11R1.22 CCC(C)N1CCC(CC1)F 34a_100015193889_100011215416 [1,1,0,0,0,0|2,0,0]=4 2311 B11R1.22 CCC(C)N1CCC(CC1)O 2230a_100025773856_100000758301 [1,1,0,0,0,0|2,0,0]=4 2312 B11R1.22 CCC(C)N1CCC(CC1)O 269982a_100025773856_100000758301 [1,1,0,0,0,0|2,0,0]=4 2313 B11R1.22 CCC(C)N1CCN(CC1)C 2230a_100000188432_100000758301 [1,1,0,0,0,0|2,0,0]=4 2314 B11R1.22 CCC(C)N1CCN(CC1)C 2230a_100011216463_200000210301 [1,1,0,0,0,0|2,0,0]=4 2315 B11R1.22 CCC(C)N1CCN(CC1)C 269982a_100000188432_100000758301 [1,1,0,0,0,0|2,0,0]=4 2316 B11R1.22 CCC(C)N1CCN(CC1)C 269982a_100011216463_200000210301 [1,1,0,0,0,0|2,0,0]=4 2317 B11R1.22 CCC(C)N1CCN(CC1)[13CH3] 2230a_100011216463_200025704644 [1,1,0,0,0,0|2,0,0]=4 2318 B11R1.22 CCC(C)N1CCN(CC1)[13CH3] 269982a_100011216463_200025704644 [1,1,0,0,0,0|2,0,0]=4 2319 B11R1.22 CCC(O)C1CCN(CC1)C 2230a_100011935121_200000210301 [1,1,0,0,0,0|2,0,0]=4 2320 B11R1.22 CCC(O)C1CCN(CC1)C 269982a_100011935121_200000210301 [1,1,0,0,0,0|2,0,0]=4 2321 B11R1.22 CCC(O)C1CCN(CC1)C 34a_100011935121_200000210301 [1,1,0,0,0,0|2,0,0]=4 2322 B11R1.22 CCC(O)C1CCN(CC1)[13CH3] 2230a_100011935121_200025704644 [1,1,0,0,0,0|2,0,0]=4 2323 B11R1.22 CCC(O)C1CCN(CC1)[13CH3] 269982a_100011935121_200025704644 [1,1,0,0,0,0|2,0,0]=4 2324 B11R1.22 CCC(O)C1CCN(CC1)[13CH3] 34a_100011935121_200025704644 [1,1,0,0,0,0|2,0,0]=4 2325 B11R1.22 CCN(C)C1CCC(CC1)C 269982a_100000225621_200011216234 [1,1,0,0,0,0|1,0,0]=3 2326 B11R1.22 CCN(C)C1CCN(CC1)C 2230a_100025768347_100000210202 [1,1,0,0,0,0|2,0,0]=4 2327 B11R1.22 CCN(C)C1CCN(CC1)C 2230a_100027639725_200000210301 [1,1,0,0,0,0|2,0,0]=4 2328 B11R1.22 CCN(C)C1CCN(CC1)C 269982a_100000225621_100011215917 [1,1,0,0,0,0|2,0,0]=4 2329 B11R1.22 CCN(C)C1CCN(CC1)C 269982a_100015204320_200000210301 [1,1,0,0,0,0|2,0,0]=4 2330 B11R1.22 CCN(C)C1CCN(CC1)C 269982a_100025768347_100000204670 [1,1,0,0,0,0|2,0,0]=4 2331 B11R1.22 CCN(C)C1CCN(CC1)C 269982a_100027639725_200000210301 [1,1,0,0,0,0|2,0,0]=4 2332 B11R1.22 CCN(C)C1CCN(CC1)[13CH3] 2230a_100027639725_200025704644 [1,1,0,0,0,0|2,0,0]=4 2333 B11R1.22 CCN(C)C1CCN(CC1)[13CH3] 269982a_100027639725_200025704644 [1,1,0,0,0,0|2,0,0]=4 2334 B11R1.22 CCN(C)[C@H]1CC[C@H](CC1)O 2230a_100020636401_100000210202 [1,1,0,0,0,0|2,0,0]=4 2335 B11R1.22 CCN(C)[C@H]1CC[C@H](CC1)O 269982a_100020636401_100000204670 [1,1,0,0,0,0|2,0,0]=4 2336 B11R1.22 CCN([13CH3])C1CCN(CC1)C 269982a_100015204320_200025704644 [1,1,0,0,0,0|2,0,0]=4 2337 B11R1.22 CN(CF)[C@H]1CC[C@H](CC1)O 269982a_100020636401_100015361967 [1,1,0,0,0,0|2,0,0]=4 2338 B11R1.22 CN1CCC(CC1)N(C)CF 269982a_100025768347_100015361967 [1,1,0,0,0,0|2,0,0]=4 2339 B11R1.22 CNC(=O)[C@H]1CC[C@@H](CC1)C 11a_106832991635_100009815934 [1,1,0,0,0,0|1,0,1]=4 2340 B11R1.22 CNC(=O)[C@H]1CC[C@@H](CC1)C 1626a_100102657272_100009815934 [1,1,0,0,0,0|1,0,1]=4 2341 B11R1.22 CNC(=O)[C@H]1CC[C@@H](CC1)C 240690a_100102657272_100009815934 [1,1,0,0,0,0|1,0,1]=4 2342 B11R1.22 CNC(=O)[C@H]1CC[C@@H](CC1)C 527a_100102657272_100009815934 [1,1,0,0,0,0|1,0,1]=4 2343 B11R1.22 CNC(C)C1CC=C(CC1)C 269862a_106832991636_100000073480 [1,1,0,0,0,0|0,0,2]=4 2344 B11R1.22 CNC(C)C1CC=C(CC1)C 270004a_106832991635_100000073480 [1,1,0,0,0,0|0,0,2]=4 2345 B11R1.22 CNC(C)C1CCN(CC1)C 269862a_106832991636_100000739861 [1,1,0,0,0,0|1,0,0]=3 2346 B11R1.22 COC(C)N1CCC(CC1)C 269982a_100000188429_100009879195 [1,1,0,0,0,0|1,0,0]=3 2347 B11R1.22 COC(C)N1CCC(CC1)F 269982a_100015193889_100009879195 [1,1,0,0,0,0|2,0,0]=4 2348 B11R1.22 COC(C)N1CCC(CC1)O 269982a_100025773856_100009879195 [1,1,0,0,0,0|2,0,0]=4 2349 B11R1.22 COC(C)N1CCN(CC1)C 269982a_100000188432_100009879195 [1,1,0,0,0,0|2,0,0]=4 2350 B11R1.22 C[C@H](CO)N1CCC(CC1)F 269982a_100015193889_100016084084 [1,1,0,0,0,0|2,0,0]=4 2351 B11R1.22 C[C@H](CO)N1CCC(CC1)O 269982a_100025773856_100016084084 [1,1,0,0,0,0|2,0,0]=4 2352 B11R1.22 C[C@H](CO)N1CCN(CC1)C 269982a_100000188432_100016084084 [1,1,0,0,0,0|2,0,0]=4 2353 B11R1.22 C[C@H]1CC[C@@H](CC1)C(=O)CF 1458a_100009815934_100015361967 [1,1,0,0,0,0|1,0,1]=4 2354 B11R1.727 CC(C)N1CCC(CC1)(C)C 2230a_100000750138_100000210206 [1,1,0,0,0,0|1,0,0]=3 2355 B11R1.727 CC(C)N1CCC(CC1)(C)C 269982a_100000750138_100000210206 [1,1,0,0,0,0|1,0,0]=3 2356 B11R1.727 CC(C)N1CCC(CC1)(C)O 2230a_100000690209_100000210206 [1,1,0,0,0,0|1,0,0]=3 2357 B11R1.727 CC(C)N1CCC(CC1)(C)O 269982a_100000690209_100000210206 [1,1,0,0,0,0|1,0,0]=3 2358 B11R1.727 CC(C)N1CCC(CC1)(F)F 2230a_100000724815_100000210206 [1,1,0,0,0,0|2,0,0]=4 2359 B11R1.727 CC(C)N1CCC(CC1)(F)F 269982a_100000724815_100000210206 [1,1,0,0,0,0|2,0,0]=4 2360 B11R1.727 CC(C)N1CCC(CC1)(F)F 34a_100000724815_100000210206 [1,1,0,0,0,0|2,0,0]=4 2361 B11R1.727 CC(C)N1CCC(CC1)(O)O 269982a_100016987284_100000210206 [1,1,0,0,0,0|2,0,0]=4 2362 B11R1.727 CC(C)N1CC[Si](CC1)(C)C 2230a_100025715224_100000210206 [1,1,0,0,0,0|1,1,0]=4 2363 B11R1.727 CC(C)N1CC[Si](CC1)(C)C 269982a_100025715224_100000210206 [1,1,0,0,0,0|1,1,0]=4 2364 B11R1.727 CN(C)C1CCC(CC1)(C)C 270004a_100102631434_100000061838 [1,1,0,0,0,0|1,0,0]=3 2365 B11R1.727 CN(C)C1CCC(CC1)(C)O 270004a_100102631434_100012184276 [1,1,0,0,0,0|1,0,0]=3 2366 B11R1.727 CN(C)C1CCC(CC1)(F)F 269982a_100102631434_100009865109 [1,1,0,0,0,0|2,0,0]=4 2367 B11R1.727 CN(C)C1CCC(CC1)(F)F 270004a_100102631434_100000052966 [1,1,0,0,0,0|2,0,0]=4 2368 B11R1.727 CN(C)C1CC[N+](CC1)(C)C 270004a_100102631434_100016991686 [1,1,0,0,0,0|2,0,0]=4 2369 B11R1.81 CC1CCC(C(C1)C)OCF 34a_100011539931_100015361967 [1,1,0,0,0,0|2,0,0]=4 2370 B11R1.81 CC1CCC(C(C1)C)OCF 7a_100011539931_100015361967 [1,1,0,0,0,0|2,0,0]=4 2371 B11R1.81 CCOC1CCC(CC1C)C 34a_100011539931_100000210202 [1,1,0,0,0,0|1,0,0]=3 2372 B11R1.81 CCOC1CCC(CC1C)C 7a_100011539931_100000210202 [1,1,0,0,0,0|1,0,0]=3 2373 B11R1.279 CCN1CC[C@H]([C@@H](C1)O)OC 2230a_200015396376_100000210202 [1,1,0,0,0,0|2,0,0]=4 2374 B11R1.279 CCN1CC[C@H]([C@@H](C1)O)OC 269982a_200015396376_100000204670 [1,1,0,0,0,0|2,0,0]=4 2375 B11R1.279 CO[C@@H]1CCN(C[C@H]1O)CF 269982a_200015396376_100015361967 [1,1,0,0,0,0|2,0,0]=4 2376 B11R1.53 C#CC1CCCCN1C(C)C 2230a_200020621307_100000210206 [1,1,0,0,0,0|2,0,0]=4 2377 B11R1.53 C#CC1CCCCN1C(C)C 269982a_200020621307_100000210206 [1,1,0,0,0,0|2,0,0]=4 2378 B11R1.53 C#CC1CCCCN1C(C)C 34a_200020621307_100000210206 [1,1,0,0,0,0|2,0,0]=4 2379 B11R1.53 CC(C)C1CCCCC1O[13CH3] 34a_100011709184_200025704644 [1,1,0,0,0,0|0,0,0]=2 2380 B11R1.53 CC(C)C1CCCCC1O[13CH3] 7a_100011709184_200025704644 [1,1,0,0,0,0|0,0,0]=2 2381 B11R1.53 CC(C)C1CCCCN1CF 269982a_100000757267_100015361967 [1,1,0,0,0,0|2,0,0]=4 2382 B11R1.53 CC(C)C1CCCCN1CF 34a_100000757267_100015361967 [1,1,0,0,0,0|2,0,0]=4 2383 B11R1.53 CC(C)N1CCCCC1C#N 34a_100016989756_100000210206 [1,1,0,0,0,0|2,0,0]=4 2384 B11R1.53 CC(C)N1CCCCC1CO 2230a_100000210821_100000210206 [1,1,0,0,0,0|1,0,0]=3 2385 B11R1.53 CC(C)N1CCCCC1CO 269982a_100000210821_100000210206 [1,1,0,0,0,0|1,0,0]=3 2386 B11R1.53 CC(C)N1CCCCC1CO 34a_100000210821_100000210206 [1,1,0,0,0,0|1,0,0]=3 2387 B11R1.53 CC(C)N1CCOC[C@H]1CO 2230a_100000717676_100000210206 [1,1,0,0,0,0|2,0,0]=4 2388 B11R1.53 CC(C)N1CCOC[C@H]1CO 269982a_100000717676_100000210206 [1,1,0,0,0,0|2,0,0]=4 2389 B11R1.53 CC(C)N1CCOC[C@H]1CO 34a_100000717676_100000210206 [1,1,0,0,0,0|2,0,0]=4 2390 B11R1.53 CCC1CCCCC1N(C)C 270004a_100102631434_100000757040 [1,1,0,0,0,0|2,0,0]=4 2391 B11R1.53 CCC1CCCCN1C(C)C 2230a_100000210034_100000210206 [1,1,0,0,0,0|2,0,0]=4 2392 B11R1.53 CCC1CCCCN1C(C)C 269982a_100000210034_100000210206 [1,1,0,0,0,0|2,0,0]=4 2393 B11R1.53 CCC1CCCCN1C(C)C 34a_100000210034_100000210206 [1,1,0,0,0,0|2,0,0]=4 2394 B11R1.53 CCN1CCCCC1C(C)C 2230a_100000757267_100000210202 [1,1,0,0,0,0|2,0,0]=4 2395 B11R1.53 CCN1CCCCC1C(C)C 269982a_100000757267_100000204670 [1,1,0,0,0,0|2,0,0]=4 2396 B11R1.53 CCN1CCCCC1C(C)C 34a_100000757267_100000210202 [1,1,0,0,0,0|2,0,0]=4 2397 B11R1.53 CN(C)C1CCCCC1CO 270004a_100102631434_100009861125 [1,1,0,0,0,0|1,0,0]=3 2398 B11R1.53 COC1CCCCC1C(C)C 34a_100011709184_200000210301 [1,1,0,0,0,0|0,0,0]=2 2399 B11R1.53 COC1CCCCC1C(C)C 7a_100011709184_200000210301 [1,1,0,0,0,0|0,0,0]=2 2400 B11R1.53 COC1CCCCC1N(C)C 270004a_100102631434_100000740605 [1,1,0,0,0,0|1,0,0]=3 2401 B11R1.53 COC1COCCC1N(C)C 270004a_100102631434_100000095984 [1,1,0,0,0,0|2,0,0]=4 2402 B11R1.87 CC1CCCCN1C(C)(C)C 269982a_100000211376_100000210625 [1,1,0,0,0,0|2,0,0]=4 2403 B11R1.87 CC1CCCCN1C(C)(C)C 34a_100000211376_100000210625 [1,1,0,0,0,0|2,0,0]=4 2404 B11R1.156 CC(C)N1C(CCCC1C)C 2230a_100000210447_100000210206 [1,1,0,0,0,0|2,0,0]=4 2405 B11R1.156 CC(C)N1C(CCCC1C)C 269982a_100000210447_100000210206 [1,1,0,0,0,0|2,0,0]=4 2406 B11R1.156 CC(C)N1C(CCCC1C)C 34a_100000210447_100000210206 [1,1,0,0,0,0|2,0,0]=4 2407 B11R1.156 CC1CCCC(C1N(C)C)C 2230a_200000753723_200000210301 [1,1,0,0,0,0|2,0,0]=4 2408 B11R1.156 CC1CCCC(C1N(C)C)C 269982a_200000753723_200000210301 [1,1,0,0,0,0|2,0,0]=4 2409 B11R1.156 CC1CCCC(C1N(C)C)C 34a_200000753723_200000210301 [1,1,0,0,0,0|2,0,0]=4 2410 B11R1.156 CC1CCCC(C1N(C)[13CH3])C 2230a_200000753723_200025704644 [1,1,0,0,0,0|2,0,0]=4 2411 B11R1.156 CC1CCCC(C1N(C)[13CH3])C 269982a_200000753723_200025704644 [1,1,0,0,0,0|2,0,0]=4 2412 B11R1.156 CC1CCCC(C1N(C)[13CH3])C 34a_200000753723_200025704644 [1,1,0,0,0,0|2,0,0]=4 2413 B11R1.167 CC1CCC(C(C1)N(C)C)C 270004a_100102631434_100000034887 [1,1,0,0,0,0|2,0,0]=4 2414 B11R1.177 CN(C)C1CCCCC1(F)F 269982a_100102631434_200009832135 [1,1,0,0,0,0|2,0,0]=4 2415 B11R1.222 CC(CO)N1CCCCC1C 2230a_100000211376_100012180447 [1,1,0,0,0,0|2,0,0]=4 2416 B11R1.222 CC(CO)N1CCCCC1C 34a_100000211376_100012180447 [1,1,0,0,0,0|2,0,0]=4 2417 B11R1.222 CC1CCCCN1[C@H](C)CO 269982a_100000211376_100016084084 [1,1,0,0,0,0|2,0,0]=4 2418 B11R1.222 CCC(=O)C1CCCCC1O 1458a_100011803323_100000210202 [1,1,0,0,0,0|1,0,1]=4 2419 B11R1.222 CCC(C)N1CCCCC1C 2230a_100000211376_100000758301 [1,1,0,0,0,0|2,0,0]=4 2420 B11R1.222 CCC(C)N1CCCCC1C 269982a_100000211376_100000758301 [1,1,0,0,0,0|2,0,0]=4 2421 B11R1.222 CCC(C)N1CCCCC1C 34a_100000211376_100011215416 [1,1,0,0,0,0|2,0,0]=4 2422 B11R1.222 CCN(C)C1CCCCC1F 269982a_100000225621_100015423560 [1,1,0,0,0,0|2,0,0]=4 2423 B11R1.222 CCN(C)C1CCCCC1O 269982a_100000225621_100000038908 [1,1,0,0,0,0|1,0,0]=3 2424 B11R1.222 CCN(C)[C@@H]1CCCC[C@H]1O 269982a_100000708425_100000204670 [1,1,0,0,0,0|1,0,0]=3 2425 B11R1.222 CN(CF)[C@@H]1CCCC[C@H]1O 269982a_100000708425_100015361967 [1,1,0,0,0,0|1,0,0]=3 2426 B11R1.222 COC(C)N1CCCCC1C 269982a_100000211376_100009879195 [1,1,0,0,0,0|2,0,0]=4 2427 B11R1.222 O=C(CF)C1CCCCC1O 1458a_100011803323_100015361967 [1,1,0,0,0,0|1,0,1]=4 2428 B11R1.49 CC(C)N1C[C@@H](C[C@H]1CO)O 2230a_100000707816_100000210206 [0,1,0,0,1,0|2,0,0]=4 2429 B11R1.49 CC(C)N1C[C@@H](C[C@H]1CO)O 269982a_100000707816_100000210206 [0,1,0,0,1,0|2,0,0]=4 2430 B11R1.49 CC(C)N1C[C@H](C[C@H]1CO)F 2230a_100015204000_100000210206 [0,1,0,0,1,0|2,0,0]=4 2431 B11R1.49 CC(C)N1C[C@H](C[C@H]1CO)F 269982a_100015204000_100000210206 [0,1,0,0,1,0|2,0,0]=4 2432 B11R1.49 CC(C)N1C[C@H](C[C@H]1CO)F 34a_100015204000_100000210206 [0,1,0,0,1,0|2,0,0]=4 2433 B11R1.488 CC1CC(CC1N(C)C)(C)C 270004a_100102631434_100000720090 [0,1,0,0,1,0|2,0,0]=4 2434 B11R1.315 CC(C)N1CCC(C1(C)C)C 2230a_102516457003_100000210206 [0,1,0,0,1,0|2,0,0]=4 2435 B11R1.315 CC(C)N1CCC(C1(C)C)C 269982a_102516457003_100000210206 [0,1,0,0,1,0|2,0,0]=4 2436 B11R1.315 CC(C)N1CCC(C1(C)C)C 34a_102516457003_100000210206 [0,1,0,0,1,0|2,0,0]=4 2437 B11R1.515 CC(C)N1CCC(C1C)(C)C 2230a_100102837566_100000210206 [0,1,0,0,1,0|2,0,0]=4 2438 B11R1.515 CC(C)N1CCC(C1C)(C)C 269982a_100102837566_100000210206 [0,1,0,0,1,0|2,0,0]=4 2439 B11R1.515 CC(C)N1CCC(C1C)(C)C 34a_100102837566_100000210206 [0,1,0,0,1,0|2,0,0]=4 2440 B13R1.883 CC1CCC(C(C1)C)OC(C)(C)C 34a_100011539931_100000210625 [0,1,0,0,0,1|1,0,0]=3 2441 B13R1.2679 C#CC(C)OC1CCC(CC1C)C 34a_100011539931_200000035995 [0,1,0,0,0,1|1,0,1]=4 2442 B13R1.2679 CC1CCC(C(C1)C)OC(C)C#N 7a_100011539931_100000703298 [0,1,0,0,0,1|1,0,1]=4 2443 B13R1.2679 CC1CCC(C(C1)C)OC(C)CO 34a_100011539931_100012180447 [0,1,0,0,0,1|1,0,0]=3 2444 B13R1.2679 CC1CCC(C(C1)C)OC(C)CO 7a_100011539931_100012180447 [0,1,0,0,0,1|1,0,0]=3 2445 B13R1.2679 CCC(C)OC1CCC(CC1C)C 34a_100011539931_100011215416 [0,1,0,0,0,1|1,0,0]=3 2446 B13R1.2679 CCC(C)OC1CCC(CC1C)C 7a_100011539931_100000758301 [0,1,0,0,0,1|1,0,0]=3 2447 B13R1.165 CC(=O)[C@@H]1C[C@@H](CC[C@H]1C(C)C)C 1458a_100009868045_200000210301 [0,2,0,0,0,0|0,0,1]=3 2448 B13R1.165 CC(=O)[C@H]1C[C@H](CC[C@@H]1C(C)C)C 1458a_100000070787_200009893639 [0,2,0,0,0,0|0,0,1]=3 2449 B13R1.165 CC(C)N1CCN(CC1C(=O)O)C 269956a_100020626280_100000210206 [0,2,0,0,0,0|2,0,0]=4 2450 B13R1.165 CC(C)N1CC[C@H](C[C@@H]1C(=O)O)C 269956a_100009817619_100000210206 [0,2,0,0,0,0|1,0,0]=3 2451 B13R1.165 CC(C)[C@@H]1CC[C@H](C[C@H]1C(=O)[13CH3])C 1458a_100009868045_200025704644 [0,2,0,0,0,0|0,0,1]=3 2452 B13R1.165 CC(C)[C@H]1CC[C@@H](C[C@@H]1N(C)C)C 269982a_100102631434_200009893639 [0,2,0,0,0,0|1,0,0]=3 2453 B13R1.356 C=C(C)[C@@H]1CC[C@H](C[C@H]1OCC)C 34a_100016197468_100000210202 [0,2,0,0,0,0|0,0,2]=4 2454 B13R1.356 C=C(C)[C@@H]1CC[C@H](C[C@H]1OCC)C 7a_100016197468_100000210202 [0,2,0,0,0,0|0,0,2]=4 2455 B13R1.356 C=C(C)[C@@H]1CC[C@H](C[C@H]1OCF)C 34a_100016197468_100015361967 [0,2,0,0,0,0|0,0,2]=4 2456 B13R1.356 C=C(C)[C@@H]1CC[C@H](C[C@H]1OCF)C 7a_100016197468_100015361967 [0,2,0,0,0,0|0,0,2]=4 2457 B13R1.356 CC(C)[C@@H]1CC[C@H](C[C@H]1NCF)C 34a_100025773825_100015361967 [0,2,0,0,0,0|1,0,0]=3 2458 B13R1.356 CC(C)[C@H]1CC[C@@H](C[C@@H]1OCF)C 34a_100000763588_100015361967 [0,2,0,0,0,0|0,0,0]=2 2459 B13R1.356 CC(C)[C@H]1CC[C@@H](C[C@@H]1OCF)C 7a_100000763588_100015361967 [0,2,0,0,0,0|0,0,0]=2 2460 B13R1.356 CC(C)[C@H]1CC[C@@H](C[C@@H]1SCF)C 62a_100015361967_200009893639 [0,2,0,0,0,0|0,1,0]=3 2461 B13R1.356 CC(C)[C@H]1CC[C@@H](C[C@@H]1SCF)C 62a_200009893639_100015361967 [0,2,0,0,0,0|0,1,0]=3 2462 B13R1.356 CCNC1C[C@@H](CC[C@H]1C(C)C)C 269862a_100015525214_100009815803 [0,2,0,0,0,0|1,0,0]=3 2463 B13R1.356 CCN[C@@H]1C[C@@H](CC[C@H]1C(C)C)C 2230a_100025773825_100000210202 [0,2,0,0,0,0|1,0,0]=3 2464 B13R1.356 CCN[C@@H]1C[C@@H](CC[C@H]1C(C)C)C 34a_100025773825_100000210202 [0,2,0,0,0,0|1,0,0]=3 2465 B13R1.356 CCO[C@H]1C[C@H](CC[C@@H]1C(C)C)C 34a_100000763588_100000210202 [0,2,0,0,0,0|0,0,0]=2 2466 B13R1.356 CCO[C@H]1C[C@H](CC[C@@H]1C(C)C)C 34a_100121572206_200009893639 [0,2,0,0,0,0|0,0,0]=2 2467 B13R1.356 CCO[C@H]1C[C@H](CC[C@@H]1C(C)C)C 7a_100000763588_100000210202 [0,2,0,0,0,0|0,0,0]=2 2468 B13R1.356 CCS[C@H]1C[C@H](CC[C@@H]1C(C)C)C 62a_100000210202_200009893639 [0,2,0,0,0,0|0,1,0]=3 2469 B13R1.356 CCS[C@H]1C[C@H](CC[C@@H]1C(C)C)C 62a_200009893639_100000210202 [0,2,0,0,0,0|0,1,0]=3 2470 B13R1.120 CC(C)N1CCC(CC1C)N(C)C 2230a_206256037340_100000210206 [0,2,0,0,0,0|2,0,0]=4 2471 B13R1.120 CC(C)N1CCC(CC1C)N(C)C 269982a_206256037340_100000210206 [0,2,0,0,0,0|2,0,0]=4 2472 B11R1.15 CC(CCO)N1CCC(C1)O 2230a_100011215560_100009893172 [0,0,1,1,0,0|2,0,0]=4 2473 B11R1.15 CC(CCO)N1CCC(C1)O 269982a_100011215560_100009893172 [0,0,1,1,0,0|2,0,0]=4 2474 B11R1.15 CC(CCO)N1CC[C@@H](C1)F 2230a_100015203821_100009893172 [0,0,1,1,0,0|2,0,0]=4 2475 B11R1.15 CC(CCO)N1CC[C@@H](C1)F 269982a_100015203821_100009893172 [0,0,1,1,0,0|2,0,0]=4 2476 B11R1.15 CC(CCO)N1CC[C@@H](C1)F 34a_100015203821_100009893172 [0,0,1,1,0,0|2,0,0]=4 2477 B11R1.15 CC(CCO)N1CC[C@H](C1)C 2230a_100016987628_100009893172 [0,0,1,1,0,0|1,0,0]=3 2478 B11R1.15 CC(CCO)N1CC[C@H](C1)C 269982a_100016987628_100009893172 [0,0,1,1,0,0|1,0,0]=3 2479 B11R1.15 CC(CCO)N1CC[C@H](C1)C 34a_100016987628_100009893172 [0,0,1,1,0,0|1,0,0]=3 2480 B11R1.15 CC1CCC(C1)N(C)CCO 270004a_100000210263_100011215218 [0,0,1,1,0,0|1,0,0]=3 2481 B11R1.15 CCCC(C)N1CC[C@H](C1)C 2230a_100016987628_100000766640 [0,0,1,1,0,0|2,0,0]=4 2482 B11R1.15 CCCC(C)N1CC[C@H](C1)C 269982a_100016987628_100000766640 [0,0,1,1,0,0|2,0,0]=4 2483 B11R1.15 CCCC(C)N1CC[C@H](C1)C 270004a_100016987628_100000211909 [0,0,1,1,0,0|2,0,0]=4 2484 B11R1.15 CCCC(C)N1CC[C@H](C1)C 34a_100016987628_100000766640 [0,0,1,1,0,0|2,0,0]=4 2485 B11R1.15 CCCN(C)C1CCC(C1)C 270004a_100000747261_100011215218 [0,0,1,1,0,0|2,0,0]=4 2486 B11R1.15 CN(CCO)C1CCC(C1)O 270004a_100000210263_100012614533 [0,0,1,1,0,0|2,0,0]=4 2487 B11R1.15 CN1CCC(C1)N(C)CCO 2230a_103436538152_100000211926 [0,0,1,1,0,0|2,0,0]=4 2488 B11R1.15 CN1CCC(C1)N(C)CCO 269982a_100000210263_200012183744 [0,0,1,1,0,0|2,0,0]=4 2489 B11R1.15 CN1CCC(C1)N(C)CCO 269982a_103436538152_100000211926 [0,0,1,1,0,0|2,0,0]=4 2490 B11R1.90 CC(C)CCN1CCC[C@@H]1C 2230a_100020605311_100000210312 [0,0,1,1,0,0|2,0,0]=4 2491 B11R1.90 CC(C)CCN1CCC[C@@H]1C 269982a_100020605311_100000210312 [0,0,1,1,0,0|2,0,0]=4 2492 B11R1.90 CC(C)CCN1CCC[C@H]1C 2230a_100015189458_100000210312 [0,0,1,1,0,0|2,0,0]=4 2493 B11R1.90 CC(C)CCN1CCC[C@H]1C 269982a_100015189458_100000210312 [0,0,1,1,0,0|2,0,0]=4 2494 B11R1.90 CC(C)CCN1CCC[C@H]1C 34a_100015189458_100000210312 [0,0,1,1,0,0|2,0,0]=4 2495 B11R1.90 CC(C)CNC1CCCC1C 269862a_100000210953_100000752053 [0,0,1,1,0,0|2,0,0]=4 2496 B11R1.90 CC(C)COC1CCCC1C 34a_100011216460_100000210624 [0,0,1,1,0,0|2,0,0]=4 2497 B11R1.90 CC(C)COC1CCCC1C 7a_100011216460_100000210760 [0,0,1,1,0,0|2,0,0]=4 2498 B11R1.120 CC(C)CC1CN(C1)CCF 2230a_214813039686_100011217306 [0,0,1,1,0,0|2,0,0]=4 2499 B11R1.120 CC(C)CC1CN(C1)CCF 269982a_214813039686_100011217306 [0,0,1,1,0,0|2,0,0]=4 2500 B11R1.120 CC(C)CC1CN(C1)CCF 34a_214813039686_100011217306 [0,0,1,1,0,0|2,0,0]=4 2501 B11R1.120 CC(C)CC1CN(C1)CCO 2230a_214813039686_100000211926 [0,0,1,1,0,0|1,0,0]=3 2502 B11R1.120 CC(C)CC1CN(C1)CCO 269982a_214813039686_100000211926 [0,0,1,1,0,0|1,0,0]=3 2503 B11R1.120 CC(C)CC1CN(C1)CCO 34a_214813039686_100000211926 [0,0,1,1,0,0|1,0,0]=3 2504 B11R1.120 CC(C)OC1CN(C1)CCO 2230a_100000698322_100000211926 [0,0,1,1,0,0|2,0,0]=4 2505 B11R1.120 CC(C)OC1CN(C1)CCO 269982a_100000698322_100000211926 [0,0,1,1,0,0|2,0,0]=4 2506 B11R1.120 CC(C)OC1CN(C1)CCO 34a_100000698322_100000211926 [0,0,1,1,0,0|2,0,0]=4 2507 B11R1.120 CCCN1CC(C1)CC(C)C 2230a_214813039686_100000210303 [0,0,1,1,0,0|2,0,0]=4 2508 B11R1.120 CCCN1CC(C1)CC(C)C 269982a_214813039686_100000210303 [0,0,1,1,0,0|2,0,0]=4 2509 B11R1.120 CCCN1CC(C1)CC(C)C 34a_214813039686_100000210303 [0,0,1,1,0,0|2,0,0]=4 2510 B11R1.120 CN(C)CC1CN(C1)CCO 269982a_100015199603_100000211926 [0,0,1,1,0,0|2,0,0]=4 2511 B11R1.124 CC(C)N1CCC(C1)CCO 2230a_100016987287_100000210206 [0,0,1,1,0,0|1,0,0]=3 2512 B11R1.124 CC(C)N1CCC(C1)CCO 269982a_100016987287_100000210206 [0,0,1,1,0,0|1,0,0]=3 2513 B11R1.124 CC(C)N1CCC(C1)CCO 34a_100016987287_100000210206 [0,0,1,1,0,0|1,0,0]=3 2514 B11R1.124 CCCC1CCC(C1)N(C)C 270004a_100102631434_200012087856 [0,0,1,1,0,0|2,0,0]=4 2515 B11R1.124 CN(C)[C@H]1CCN(C1)CCO 2230a_100016988096_100000211926 [0,0,1,1,0,0|2,0,0]=4 2516 B11R1.124 CN(C)[C@H]1CCN(C1)CCO 269982a_100016988096_100000211926 [0,0,1,1,0,0|2,0,0]=4 2517 B11R1.135 CC1CCCN(CC1)CCF 2230a_100025706717_100011217306 [0,0,1,1,0,0|2,0,0]=4 2518 B11R1.135 CC1CCCN(CC1)CCF 269982a_100025706717_100011217306 [0,0,1,1,0,0|2,0,0]=4 2519 B11R1.135 CC1CCCN(CC1)CCF 34a_100025706717_100011217306 [0,0,1,1,0,0|2,0,0]=4 2520 B11R1.135 CC1CCCN(CC1)CCO 2230a_100025706717_100000211926 [0,0,1,1,0,0|1,0,0]=3 2521 B11R1.135 CC1CCCN(CC1)CCO 269982a_100025706717_100000211926 [0,0,1,1,0,0|1,0,0]=3 2522 B11R1.135 CC1CCCN(CC1)CCO 34a_100025706717_100000211926 [0,0,1,1,0,0|1,0,0]=3 2523 B11R1.135 CCCN1CCCC(CC1)C 2230a_100025706717_100000210303 [0,0,1,1,0,0|2,0,0]=4 2524 B11R1.135 CCCN1CCCC(CC1)C 269982a_100025706717_100000210303 [0,0,1,1,0,0|2,0,0]=4 2525 B11R1.135 CCCN1CCCC(CC1)C 34a_100025706717_100000210303 [0,0,1,1,0,0|2,0,0]=4 2526 B11R1.135 CN1CCCN(CC1)CCO 2230a_100000211313_100000211926 [0,0,1,1,0,0|2,0,0]=4 2527 B11R1.135 CN1CCCN(CC1)CCO 269982a_100000211313_100000211926 [0,0,1,1,0,0|2,0,0]=4 2528 B11R1.135 CN1CCCN(CC1)CCO 269982a_100000752306_200000210301 [0,0,1,1,0,0|2,0,0]=4 2529 B11R1.135 OCCN1CCCC(CC1)O 2230a_100015186869_100000211926 [0,0,1,1,0,0|2,0,0]=4 2530 B11R1.135 OCCN1CCCC(CC1)O 269982a_100015186869_100000211926 [0,0,1,1,0,0|2,0,0]=4 2531 B11R1.135 [13CH3]N1CCCN(CC1)CCO 269982a_100000752306_200025704644 [0,0,1,1,0,0|2,0,0]=4 2532 B11R1.154 CC(C)CCCN1CC(C1)C 2230a_100000702820_100011214892 [0,0,1,1,0,0|2,0,0]=4 2533 B11R1.154 CC(C)CCCN1CC(C1)C 269982a_100000702820_100011214892 [0,0,1,1,0,0|2,0,0]=4 2534 B11R1.154 CC(C)CCCN1CC(C1)C 34a_100000702820_100011214892 [0,0,1,1,0,0|2,0,0]=4 2535 B11R1.154 CC(C)CCCN1CC(C1)F 2230a_100000690557_100011214892 [0,0,1,1,0,0|2,0,0]=4 2536 B11R1.154 CC(C)CCCN1CC(C1)F 269982a_100000690557_100011214892 [0,0,1,1,0,0|2,0,0]=4 2537 B11R1.154 CC(C)CCCN1CC(C1)F 34a_100000690557_100011214892 [0,0,1,1,0,0|2,0,0]=4 2538 B11R1.154 CC(C)CCCN1CC(C1)O 269982a_100000749847_100011214892 [0,0,1,1,0,0|1,0,0]=3 2539 B11R1.154 CC(C)CCNC1CC(C1)F 2230a_100016993743_100000210312 [0,0,1,1,0,0|2,0,0]=4 2540 B11R1.154 CC(C)CCN[C@H]1C[C@@H](C1)O 2230a_100020629032_100000210312 [0,0,1,1,0,0|1,0,0]=3 2541 B11R1.154 CC(C)CCN[C@H]1C[C@@H](C1)O 269862a_100020629032_100000185833 [0,0,1,1,0,0|1,0,0]=3 2542 B11R1.154 CC(C)CNCC1CC(C1)O 2230a_100016992100_100000210760 [0,0,1,1,0,0|1,0,0]=3 2543 B11R1.154 CC(C)CNCC1CC(C1)O 270004a_100016992100_100000210432 [0,0,1,1,0,0|1,0,0]=3 2544 B11R1.154 CC(C)COCC1CC(C1)Cl 34a_100009874164_100000210624 [0,0,1,1,0,0|2,0,0]=4 2545 B11R1.154 CC(C)OCCN1CC(C1)O 269982a_100000749847_100000211751 [0,0,1,1,0,0|2,0,0]=4 2546 B11R1.154 CC(C)OCN[C@H]1C[C@@H](C1)O 2230a_100020629032_100000709892 [0,0,1,1,0,0|2,0,0]=4 2547 B11R1.154 CC(C)SCCN1CC(C1)O 269982a_100000749847_100000730970 [0,0,1,1,0,0|2,0,0]=4 2548 B11R1.154 CC(O)CCCN1CC(C1)O 269982a_100000749847_200000718107 [0,0,1,1,0,0|2,0,0]=4 2549 B11R1.154 CC(O)CCN[C@H]1C[C@@H](C1)O 2230a_100020629032_100012276601 [0,0,1,1,0,0|2,0,0]=4 2550 B11R1.154 CC(O)CNCC1CC(C1)O 2230a_100016992100_100011218427 [0,0,1,1,0,0|2,0,0]=4 2551 B11R1.154 CN(C)CCCN1CC(C1)O 269982a_100000749847_100000757444 [0,0,1,1,0,0|2,0,0]=4 2552 B11R1.154 C[C@@H](O)CNCC1CC(C1)O 2230a_100016992100_100009817552 [0,0,1,1,0,0|2,0,0]=4 2553 B11R1.157 CC(C)CN1CCC[C@@H](C1)C 2230a_100000717927_100000210760 [0,0,1,1,0,0|2,0,0]=4 2554 B11R1.157 CC(C)CN1CCC[C@@H](C1)C 269982a_100000717927_100000210624 [0,0,1,1,0,0|2,0,0]=4 2555 B11R1.157 CC(C)CN1CCC[C@@H](C1)C 270004a_100000717927_100000210432 [0,0,1,1,0,0|2,0,0]=4 2556 B11R1.157 CC(C)CN1CCC[C@@H](C1)C 34a_100000717927_100000210624 [0,0,1,1,0,0|2,0,0]=4 2557 B11R1.157 CC1CCCC(C1)NC(C)C 2230a_100011194320_100000210206 [0,0,1,1,0,0|2,0,0]=4 2558 B11R1.157 CC1CCCC(C1)NC(C)C 34a_100011194320_100000210206 [0,0,1,1,0,0|2,0,0]=4 2559 B11R1.157 CC1CCCC(C1)OC(C)C 34a_100000211399_100000210206 [0,0,1,1,0,0|2,0,0]=4 2560 B11R1.157 CN(C)CC1CN(CCO1)C 2230a_100000752868_200000210301 [0,0,1,1,0,0|2,0,0]=4 2561 B11R1.157 CN(C)CC1CN(CCO1)C 269982a_100000752868_200000210301 [0,0,1,1,0,0|2,0,0]=4 2562 B11R1.157 CN(C)CC1CN(CCO1)[13CH3] 2230a_100000752868_200025704644 [0,0,1,1,0,0|2,0,0]=4 2563 B11R1.157 CN(C)CC1CN(CCO1)[13CH3] 269982a_100000752868_200025704644 [0,0,1,1,0,0|2,0,0]=4 2564 B11R1.172 CC(Br)CCOC1CCOC1 34a_100009893172_100000690089 [0,0,1,1,0,0|2,0,0]=4 2565 B11R1.172 CC(Br)COCC1CCOC1 34a_100012180447_100011261433 [0,0,1,1,0,0|2,0,0]=4 2566 B11R1.172 CC(C)CCCN1CCCC1 2230a_100000188435_100011214892 [0,0,1,1,0,0|2,0,0]=4 2567 B11R1.172 CC(C)CCCN1CCCC1 269982a_100000188435_100011214892 [0,0,1,1,0,0|2,0,0]=4 2568 B11R1.172 CC(C)CCCN1CCSC1 2230a_100011215254_100011214892 [0,0,1,1,0,0|1,1,0]=4 2569 B11R1.172 CC(C)CCCN1CCSC1 269982a_100011215254_100011214892 [0,0,1,1,0,0|1,1,0]=4 2570 B11R1.172 CC(C)CCNC1CCCC1 2230a_100000211070_100000210312 [0,0,1,1,0,0|2,0,0]=4 2571 B11R1.172 CC(C)CCNC1CCCC1 269862a_100000211070_100000185833 [0,0,1,1,0,0|2,0,0]=4 2572 B11R1.172 CC(C)CCNC1CCCC1 270004a_100000210545_100000210133 [0,0,1,1,0,0|2,0,0]=4 2573 B11R1.172 CC(C)CCNC1CCCC1 34a_100000211070_100000210312 [0,0,1,1,0,0|2,0,0]=4 2574 B11R1.172 CC(C)CCNC1CCOC1 270004a_100000210545_100000752484 [0,0,1,1,0,0|1,0,0]=3 2575 B11R1.172 CC(C)CCNC1CCSC1 270004a_100000210545_100000212027 [0,0,1,1,0,0|1,1,0]=4 2576 B11R1.172 CC(C)CCN[C@@H]1CCOC1 2230a_200015188469_100000210312 [0,0,1,1,0,0|1,0,0]=3 2577 B11R1.172 CC(C)CCN[C@@H]1CCOC1 269862a_200015188469_100000185833 [0,0,1,1,0,0|1,0,0]=3 2578 B11R1.172 CC(C)CCN[C@H]1CCOC1 2230a_100015188467_100000210312 [0,0,1,1,0,0|1,0,0]=3 2579 B11R1.172 CC(C)CCN[C@H]1CCOC1 269862a_100015188467_100000185833 [0,0,1,1,0,0|1,0,0]=3 2580 B11R1.172 CC(C)CCN[C@H]1CCOC1 34a_100015188467_100000210312 [0,0,1,1,0,0|1,0,0]=3 2581 B11R1.172 CC(C)CCOC1CCCC1 34a_100000210254_100000179811 [0,0,1,1,0,0|2,0,0]=4 2582 B11R1.172 CC(C)CCOC1CCCC1 34a_100000210269_100000210312 [0,0,1,1,0,0|2,0,0]=4 2583 B11R1.172 CC(C)CCOC1CCCC1 7a_100000210254_100000179811 [0,0,1,1,0,0|2,0,0]=4 2584 B11R1.172 CC(C)CCOC1CCCC1 7a_100000210269_100000210626 [0,0,1,1,0,0|2,0,0]=4 2585 B11R1.172 CC(C)CCOC1CCOC1 34a_100000210254_100000690089 [0,0,1,1,0,0|1,0,0]=3 2586 B11R1.172 CC(C)CCOC1CCOC1 7a_100000210254_100000731011 [0,0,1,1,0,0|1,0,0]=3 2587 B11R1.172 CC(C)CCOC1CCSC1 7a_100011232664_100000210626 [0,0,1,1,0,0|1,1,0]=4 2588 B11R1.172 CC(C)CCO[C@H]1CCOC1 34a_100000717292_100000210312 [0,0,1,1,0,0|1,0,0]=3 2589 B11R1.172 CC(C)CCSC1CCCC1 62a_100000210312_100000179811 [0,0,1,1,0,0|2,0,0]=4 2590 B11R1.172 CC(C)CCSC1CCCC1 62a_100011217020_100000210312 [0,0,1,1,0,0|2,0,0]=4 2591 B11R1.172 CC(C)CCSC1CCOC1 62a_100000210312_100000690089 [0,0,1,1,0,0|1,0,0]=3 2592 B11R1.172 CC(C)CNCC1CCCC1 2230a_100000210953_100000740388 [0,0,1,1,0,0|2,0,0]=4 2593 B11R1.172 CC(C)CNCC1CCCC1 2230a_100000737975_100000210760 [0,0,1,1,0,0|2,0,0]=4 2594 B11R1.172 CC(C)CNCC1CCCC1 269862a_100000210953_100000746403 [0,0,1,1,0,0|2,0,0]=4 2595 B11R1.172 CC(C)CNCC1CCCC1 270004a_100000737975_100000210432 [0,0,1,1,0,0|2,0,0]=4 2596 B11R1.172 CC(C)CNCC1CCCC1 34a_100000210953_100000740388 [0,0,1,1,0,0|2,0,0]=4 2597 B11R1.172 CC(C)CNCC1CCCC1 34a_100000737975_100000210624 [0,0,1,1,0,0|2,0,0]=4 2598 B11R1.172 CC(C)CNCC1CCOC1 2230a_100000210953_100000702531 [0,0,1,1,0,0|1,0,0]=3 2599 B11R1.172 CC(C)CNCC1CCOC1 2230a_100000737293_100000210760 [0,0,1,1,0,0|1,0,0]=3 2600 B11R1.172 CC(C)CNCC1CCOC1 270004a_100000737293_100000210432 [0,0,1,1,0,0|1,0,0]=3 2601 B11R1.172 CC(C)CNCC1CCOC1 34a_100000210953_100011261433 [0,0,1,1,0,0|1,0,0]=3 2602 B11R1.172 CC(C)CNCC1CCOC1 34a_100000737293_100000210624 [0,0,1,1,0,0|1,0,0]=3 2603 B11R1.172 CC(C)COCC1CCCC1 34a_100000210257_100000740388 [0,0,1,1,0,0|2,0,0]=4 2604 B11R1.172 CC(C)COCC1CCCC1 34a_100000742336_100000210624 [0,0,1,1,0,0|2,0,0]=4 2605 B11R1.172 CC(C)COCC1CCCC1 7a_100000742336_100000210760 [0,0,1,1,0,0|2,0,0]=4 2606 B11R1.172 CC(C)COCC1CCNC1 34a_100000748654_100000210624 [0,0,1,1,0,0|2,0,0]=4 2607 B11R1.172 CC(C)COCC1CCOC1 34a_100000210257_100011261433 [0,0,1,1,0,0|1,0,0]=3 2608 B11R1.172 CC(C)COCC1CCOC1 34a_100000740260_100000210624 [0,0,1,1,0,0|1,0,0]=3 2609 B11R1.172 CC(C)COCC1COCO1 34a_100011216627_100000210624 [0,0,1,1,0,0|2,0,0]=4 2610 B11R1.172 CC(C)CSCC1CCCC1 62a_100000210624_100000740388 [0,0,1,1,0,0|2,0,0]=4 2611 B11R1.172 CC(C)CSCC1CCCC1 62a_100000740388_100000210760 [0,0,1,1,0,0|2,0,0]=4 2612 B11R1.172 CC(C)CSCC1CCOC1 62a_100000210624_100000702531 [0,0,1,1,0,0|1,0,0]=3 2613 B11R1.172 CC(C)CSCC1CCOC1 62a_100000702531_100000210760 [0,0,1,1,0,0|1,0,0]=3 2614 B11R1.172 CC(C)NCCC1CCCC1 2230a_100000739158_100000210206 [0,0,1,1,0,0|2,0,0]=4 2615 B11R1.172 CC(C)NCCC1CCCC1 2230a_100138425928_100000760354 [0,0,1,1,0,0|2,0,0]=4 2616 B11R1.172 CC(C)NCCC1CCCC1 34a_100000739158_100000210206 [0,0,1,1,0,0|2,0,0]=4 2617 B11R1.172 CC(C)NCCC1CCCC1 34a_100138425928_100000760354 [0,0,1,1,0,0|2,0,0]=4 2618 B11R1.172 CC(C)OCCC1CCCC1 34a_100000212225_100000760354 [0,0,1,1,0,0|2,0,0]=4 2619 B11R1.172 CC(C)OCCC1CCCC1 34a_100000749090_100000210206 [0,0,1,1,0,0|2,0,0]=4 2620 B11R1.172 CC(C)OCCC1CCCC1 7a_100000749090_100000210206 [0,0,1,1,0,0|2,0,0]=4 2621 B11R1.172 CC(C)OCCC1CCNC1 34a_100016987287_100000210206 [0,0,1,1,0,0|2,0,0]=4 2622 B11R1.172 CC(C)OCCC1CCOC1 34a_100011879284_100000210206 [0,0,1,1,0,0|1,0,0]=3 2623 B11R1.172 CC(C)OCN[C@@H]1CCOC1 2230a_200015188469_100000709892 [0,0,1,1,0,0|2,0,0]=4 2624 B11R1.172 CC(C)OCN[C@H]1CCOC1 2230a_100015188467_100000709892 [0,0,1,1,0,0|2,0,0]=4 2625 B11R1.172 CC(C)OCN[C@H]1CCOC1 34a_100015188467_100000709892 [0,0,1,1,0,0|2,0,0]=4 2626 B11R1.172 CC(C)OCO[C@H]1CCOC1 34a_100000717292_100000709892 [0,0,1,1,0,0|2,0,0]=4 2627 B11R1.172 CC(C)OCSC1CCOC1 62a_100000709892_100000690089 [0,0,1,1,0,0|2,0,0]=4 2628 B11R1.172 CC(C)SCCC1CCCC1 62a_100000210206_100000760354 [0,0,1,1,0,0|2,0,0]=4 2629 B11R1.172 CC(C)SCCC1CCCC1 62a_100000760354_100000210206 [0,0,1,1,0,0|2,0,0]=4 2630 B11R1.172 CC(F)COCC1CCOC1 34a_100015925927_100011261433 [0,0,1,1,0,0|2,0,0]=4 2631 B11R1.172 CC(O)CCNC1CCOC1 2230a_200000755665_100000731011 [0,0,1,1,0,0|2,0,0]=4 2632 B11R1.172 CC(O)CCNC1CCOC1 270004a_200000755665_100000752484 [0,0,1,1,0,0|2,0,0]=4 2633 B11R1.172 CC(O)CCN[C@@H]1CCOC1 2230a_200015188469_100012276601 [0,0,1,1,0,0|2,0,0]=4 2634 B11R1.172 CC(O)CCN[C@H]1CCOC1 2230a_100015188467_100012276601 [0,0,1,1,0,0|2,0,0]=4 2635 B11R1.172 CC(O)CCN[C@H]1CCOC1 34a_100015188467_100012276601 [0,0,1,1,0,0|2,0,0]=4 2636 B11R1.172 CC(O)CCO[C@H]1CCOC1 34a_100000717292_100012276601 [0,0,1,1,0,0|2,0,0]=4 2637 B11R1.172 CC(O)CCSC1CCOC1 62a_100012276601_100000690089 [0,0,1,1,0,0|2,0,0]=4 2638 B11R1.172 CC(O)CNCC1CCOC1 2230a_100000210904_100000702531 [0,0,1,1,0,0|2,0,0]=4 2639 B11R1.172 CC(O)CNCC1CCOC1 2230a_100000737293_100011218427 [0,0,1,1,0,0|2,0,0]=4 2640 B11R1.172 CC(O)CNCC1CCOC1 34a_100000210904_100011261433 [0,0,1,1,0,0|2,0,0]=4 2641 B11R1.172 CC(O)CNCC1CCOC1 34a_100000737293_100011218427 [0,0,1,1,0,0|2,0,0]=4 2642 B11R1.172 CC(O)COCC1CCOC1 34a_100000740260_100011218427 [0,0,1,1,0,0|2,0,0]=4 2643 B11R1.172 CC(O)CSCC1CCOC1 62a_100000702531_100011218427 [0,0,1,1,0,0|2,0,0]=4 2644 B11R1.172 CC(O)CSCC1CCOC1 62a_100011218427_100000702531 [0,0,1,1,0,0|2,0,0]=4 2645 B11R1.172 CN(C)CCCC1CCCC1 2230a_100015186261_200000210301 [0,0,1,1,0,0|2,0,0]=4 2646 B11R1.172 CN(C)CCCC1CCCC1 2230a_100102631434_100011713738 [0,0,1,1,0,0|2,0,0]=4 2647 B11R1.172 CN(C)CCCC1CCCC1 269982a_100015186261_200000210301 [0,0,1,1,0,0|2,0,0]=4 2648 B11R1.172 CN(C)CCCC1CCCC1 269982a_100102631434_100011713738 [0,0,1,1,0,0|2,0,0]=4 2649 B11R1.172 CN(C)CCCC1CCCC1 34a_100015186261_200000210301 [0,0,1,1,0,0|2,0,0]=4 2650 B11R1.172 CN(C)CCNC1CCOC1 270004a_100000210585_100000752484 [0,0,1,1,0,0|2,0,0]=4 2651 B11R1.172 CN([13CH3])CCCC1CCCC1 2230a_100015186261_200025704644 [0,0,1,1,0,0|2,0,0]=4 2652 B11R1.172 CN([13CH3])CCCC1CCCC1 269982a_100015186261_200025704644 [0,0,1,1,0,0|2,0,0]=4 2653 B11R1.172 CN([13CH3])CCCC1CCCC1 34a_100015186261_200025704644 [0,0,1,1,0,0|2,0,0]=4 2654 B11R1.172 C[C@@H](Cl)COCC1CCOC1 34a_100016084084_100011261433 [0,0,1,1,0,0|2,0,0]=4 2655 B11R1.172 C[C@@H](N)CCOC1CCOC1 34a_100000706166_100000690089 [0,0,1,1,0,0|2,0,0]=4 2656 B11R1.172 C[C@@H](N)COCC1CCOC1 34a_100000737577_100011261433 [0,0,1,1,0,0|2,0,0]=4 2657 B11R1.172 C[C@@H](O)CNCC1CCOC1 2230a_100000737293_100009817552 [0,0,1,1,0,0|2,0,0]=4 2658 B11R1.172 C[C@@H](O)CNCC1CCOC1 34a_100000737293_100009817552 [0,0,1,1,0,0|2,0,0]=4 2659 B11R1.172 C[C@@H](O)COCC1CCOC1 34a_100000740260_100009817552 [0,0,1,1,0,0|2,0,0]=4 2660 B11R1.172 C[C@@H](O)CSCC1CCOC1 62a_100000702531_100009817552 [0,0,1,1,0,0|2,0,0]=4 2661 B11R1.172 C[C@@H](O)CSCC1CCOC1 62a_100009817552_100000702531 [0,0,1,1,0,0|2,0,0]=4 2662 B11R1.201 CC(CCO)NC1CC(C1)F 2230a_100016993743_100009893172 [0,0,1,1,0,0|2,0,0]=4 2663 B11R1.201 CC(CCO)N[C@H]1C[C@@H](C1)O 2230a_100020629032_100009893172 [0,0,1,1,0,0|2,0,0]=4 2664 B11R1.201 CCCC(C)CN1CC(C1)C 2230a_100000702820_100011216630 [0,0,1,1,0,0|2,0,0]=4 2665 B11R1.201 CCCC(C)CN1CC(C1)C 269982a_100000702820_100011216630 [0,0,1,1,0,0|2,0,0]=4 2666 B11R1.201 CCCC(C)CN1CC(C1)C 270004a_100000702820_100000243154 [0,0,1,1,0,0|2,0,0]=4 2667 B11R1.201 CCCC(C)CN1CC(C1)C 34a_100000702820_100011216630 [0,0,1,1,0,0|2,0,0]=4 2668 B11R1.288 CC(CCO)OCC1CC1C 34a_100000744939_100009893172 [0,0,1,1,0,0|1,0,0]=3 2669 B11R1.288 CC(CCO)OCC1CC1C 7a_100000744939_100009893172 [0,0,1,1,0,0|1,0,0]=3 2670 B11R1.288 CCCC(C)OCC1CC1C 34a_100000744939_100000766640 [0,0,1,1,0,0|2,0,0]=4 2671 B11R1.288 CCCC(C)OCC1CC1C 7a_100000744939_100000766640 [0,0,1,1,0,0|2,0,0]=4 2672 B11R1.290 CC(CCBr)OCCC1CC1 34a_100012276601_100000694398 [0,0,1,1,0,0|2,0,0]=4 2673 B11R1.290 CC(CCN)COCC1CC1 34a_106354213184_100000742324 [0,0,1,1,0,0|2,0,0]=4 2674 B11R1.290 CC(CCO)NCCC1CC1 34a_100000764129_100009893172 [0,0,1,1,0,0|1,0,0]=3 2675 B11R1.290 CC(CCO)OCCC1CC1 34a_100000754188_100009893172 [0,0,1,1,0,0|1,0,0]=3 2676 B11R1.290 CC(CCO)OCCC1CC1 7a_100000754188_100009893172 [0,0,1,1,0,0|1,0,0]=3 2677 B11R1.290 CC(CCO)OCC[C@@H]1CO1 34a_100009820653_100009893172 [0,0,1,1,0,0|2,0,0]=4 2678 B11R1.290 CC(CCO)SCCC1CC1 62a_100000764125_100009893172 [0,0,1,1,0,0|1,0,0]=3 2679 B11R1.290 CC(CCO)SCCC1CC1 62a_100009893172_100000764125 [0,0,1,1,0,0|1,0,0]=3 2680 B11R1.290 CC(CCO)SCCC1CO1 62a_100000732470_100009893172 [0,0,1,1,0,0|2,0,0]=4 2681 B11R1.290 CC(CCO)SCCC1CO1 62a_100009893172_100000732470 [0,0,1,1,0,0|2,0,0]=4 2682 B11R1.290 CCCC(C)CCOC1CC1 34a_100011217855_100000211595 [0,0,1,1,0,0|2,0,0]=4 2683 B11R1.290 CCCC(C)CNCC1CC1 2230a_100000735609_100011216630 [0,0,1,1,0,0|2,0,0]=4 2684 B11R1.290 CCCC(C)CNCC1CC1 270004a_100000735609_100000243154 [0,0,1,1,0,0|2,0,0]=4 2685 B11R1.290 CCCC(C)CNCC1CC1 34a_100000735609_100011216630 [0,0,1,1,0,0|2,0,0]=4 2686 B11R1.290 CCCC(C)COCC1CC1 34a_100000211283_100011216630 [0,0,1,1,0,0|2,0,0]=4 2687 B11R1.290 CCCC(C)COCC1CC1 34a_100000688023_100000742324 [0,0,1,1,0,0|2,0,0]=4 2688 B11R1.290 CCCC(C)COCC1CC1 7a_100000688023_100000742324 [0,0,1,1,0,0|2,0,0]=4 2689 B11R1.290 CCCC(C)CSCC1CC1 62a_100000756562_100011216630 [0,0,1,1,0,0|2,0,0]=4 2690 B11R1.290 CCCC(C)CSCC1CC1 62a_100011216630_100000742324 [0,0,1,1,0,0|2,0,0]=4 2691 B11R1.290 CCCC(C)NCCC1CC1 2230a_100000741246_100000694398 [0,0,1,1,0,0|2,0,0]=4 2692 B11R1.290 CCCC(C)NCCC1CC1 270004a_100000764129_100000211909 [0,0,1,1,0,0|2,0,0]=4 2693 B11R1.290 CCCC(C)NCCC1CC1 34a_100000764129_100000766640 [0,0,1,1,0,0|2,0,0]=4 2694 B11R1.290 CCCC(C)OCCC1CC1 34a_100000754188_100000766640 [0,0,1,1,0,0|2,0,0]=4 2695 B11R1.290 CCCC(C)OCCC1CC1 34a_100000764384_100000694398 [0,0,1,1,0,0|2,0,0]=4 2696 B11R1.290 CCCC(C)OCCC1CC1 7a_100000754188_100000766640 [0,0,1,1,0,0|2,0,0]=4 2697 B11R1.290 CCCC(C)OCCC1CC1 7a_100000764384_100000764125 [0,0,1,1,0,0|2,0,0]=4 2698 B11R1.290 CCCC(C)SCCC1CC1 62a_100000764125_100000766640 [0,0,1,1,0,0|2,0,0]=4 2699 B11R1.290 CCCC(C)SCCC1CC1 62a_100000766640_100000764125 [0,0,1,1,0,0|2,0,0]=4 2700 B11R1.290 CN(CCO)CCCC1CO1 2230a_100000210263_100000733510 [0,0,1,1,0,0|2,0,0]=4 2701 B11R1.290 CN(CCO)CCCC1CO1 269982a_100000210263_100000733510 [0,0,1,1,0,0|2,0,0]=4 2702 B11R1.290 C[C@H](CCO)NCCC1CC1 2230a_100000706166_100000694398 [0,0,1,1,0,0|1,0,0]=3 2703 B11R1.290 C[C@H](CCO)NCCC1CC1 34a_100000706166_100000694398 [0,0,1,1,0,0|1,0,0]=3 2704 B11R1.290 C[C@H](CCO)NCCC1CO1 2230a_100000706166_100000732470 [0,0,1,1,0,0|2,0,0]=4 2705 B11R1.290 C[C@H](CCO)NCCC1CO1 34a_100000706166_100000732470 [0,0,1,1,0,0|2,0,0]=4 2706 B11R1.342 CC1(CCCC(C1)OCF)C 7a_100011995757_100015361967 [0,0,1,1,0,0|2,0,0]=4 2707 B11R1.342 CC1(CCCN(C1)CCF)C 2230a_100000716857_100011217306 [0,0,1,1,0,0|2,0,0]=4 2708 B11R1.342 CC1(CCCN(C1)CCF)C 269982a_100000716857_100011217306 [0,0,1,1,0,0|2,0,0]=4 2709 B11R1.342 CC1(CCCN(C1)CCF)C 34a_100000716857_100011217306 [0,0,1,1,0,0|2,0,0]=4 2710 B11R1.342 CC1(CCCN(C1)CCO)C 2230a_100000716857_100000211926 [0,0,1,1,0,0|1,0,0]=3 2711 B11R1.342 CC1(CCCN(C1)CCO)C 269982a_100000716857_100000211926 [0,0,1,1,0,0|1,0,0]=3 2712 B11R1.342 CC1(CCCN(C1)CCO)C 34a_100000716857_100000211926 [0,0,1,1,0,0|1,0,0]=3 2713 B11R1.342 CC1(CCCN(C1)CCO)O 2230a_100000695535_100000211926 [0,0,1,1,0,0|2,0,0]=4 2714 B11R1.342 CC1(CCCN(C1)CCO)O 269982a_100000695535_100000211926 [0,0,1,1,0,0|2,0,0]=4 2715 B11R1.342 CC1(CN(CCO1)CCO)C 2230a_100000738910_100000211926 [0,0,1,1,0,0|2,0,0]=4 2716 B11R1.342 CC1(CN(CCO1)CCO)C 269982a_100000738910_100000211926 [0,0,1,1,0,0|2,0,0]=4 2717 B11R1.342 CC1(CN(CCO1)CCO)C 34a_100000738910_100000211926 [0,0,1,1,0,0|2,0,0]=4 2718 B11R1.342 CCCN1CCCC(C1)(C)C 2230a_100000716857_100000210303 [0,0,1,1,0,0|2,0,0]=4 2719 B11R1.342 CCCN1CCCC(C1)(C)C 269982a_100000716857_100000210303 [0,0,1,1,0,0|2,0,0]=4 2720 B11R1.342 CCCN1CCCC(C1)(C)C 34a_100000716857_100000210303 [0,0,1,1,0,0|2,0,0]=4 2721 B11R1.342 CCNC1CCCC(C1)(C)C 270004a_100015525214_100000031663 [0,0,1,1,0,0|2,0,0]=4 2722 B11R1.342 CCOC1CCCC(C1)(C)C 7a_100011995757_100000210202 [0,0,1,1,0,0|2,0,0]=4 2723 B11R1.565 CC1CCCN(CC1)C(C)C 2230a_100025706717_100000210206 [0,0,1,1,0,0|2,0,0]=4 2724 B11R1.565 CC1CCCN(CC1)C(C)C 269982a_100025706717_100000210206 [0,0,1,1,0,0|2,0,0]=4 2725 B11R1.565 CC1CCCN(CC1)C(C)C 34a_100025706717_100000210206 [0,0,1,1,0,0|2,0,0]=4 2726 B11R1.720 CC(C)CCCC(=O)C1CO1 1458a_100000701028_100011214892 [0,0,1,1,0,0|1,0,1]=4 2727 B11R1.720 CC(C)CCCN(C)C1CC1 2230a_100000226674_100011214892 [0,0,1,1,0,0|2,0,0]=4 2728 B11R1.720 CC(C)CCCN(C)C1CC1 269982a_100000226674_100011214892 [0,0,1,1,0,0|2,0,0]=4 2729 B11R1.720 CC(C)CCNC(C)C1CC1 2230a_100000700016_100000210312 [0,0,1,1,0,0|2,0,0]=4 2730 B11R1.720 CC(C)CCNC(C)C1CC1 269862a_100000210545_100000210639 [0,0,1,1,0,0|2,0,0]=4 2731 B11R1.720 CC(C)CCNC(C)C1CC1 269862a_100000700016_100000185833 [0,0,1,1,0,0|2,0,0]=4 2732 B11R1.720 CC(C)CCNC(C)C1CC1 34a_100000700016_100000210312 [0,0,1,1,0,0|2,0,0]=4 2733 B11R1.720 CC(C)CCNC(C)C1CO1 270004a_100000210545_100000031964 [0,0,1,1,0,0|1,0,0]=3 2734 B11R1.720 CC(C)CCOC(C)C1CC1 34a_100000744524_100000210312 [0,0,1,1,0,0|2,0,0]=4 2735 B11R1.720 CC(C)CCOC(C)C1CC1 7a_100000744524_100000210626 [0,0,1,1,0,0|2,0,0]=4 2736 B11R1.720 CC(NCCN(C)C)C1CO1 270004a_100000210585_100000031964 [0,0,1,1,0,0|2,0,0]=4 2737 B11R1.720 CC(O)CCNC(C)C1CO1 270004a_200000755665_100000031964 [0,0,1,1,0,0|2,0,0]=4 2738 B11R1.924 CC(C)CCNC1(CCC1)C 2230a_100000692455_100000210312 [0,0,1,1,0,0|2,0,0]=4 2739 B11R1.924 CC(C)CCNC1(CCC1)C 34a_100000692455_100000210312 [0,0,1,1,0,0|2,0,0]=4 2740 B11R1.924 CC(C)CCOC1(CCC1)C 34a_100000759064_100000210312 [0,0,1,1,0,0|2,0,0]=4 2741 B11R1.924 CC(C)CCOC1(CCC1)C 7a_100000759064_100000210626 [0,0,1,1,0,0|2,0,0]=4 2742 B11R1.924 CC(C)CNCC1(CCC1)C 2230a_100000210953_100000726658 [0,0,1,1,0,0|2,0,0]=4 2743 B11R1.924 CC(C)CNCC1(CCC1)C 2230a_100000706607_100000210760 [0,0,1,1,0,0|2,0,0]=4 2744 B11R1.924 CC(C)CNCC1(CCC1)C 270004a_100000706607_100000210432 [0,0,1,1,0,0|2,0,0]=4 2745 B11R1.924 CC(C)CNCC1(CCC1)C 34a_100000210953_100000726658 [0,0,1,1,0,0|2,0,0]=4 2746 B11R1.924 CC(C)COCC1(CCC1)C 34a_100000210257_100000726658 [0,0,1,1,0,0|2,0,0]=4 2747 B11R1.924 CC(C)CSCC1(CCC1)C 62a_100000210624_100000726658 [0,0,1,1,0,0|2,0,0]=4 2748 B11R1.924 CC(C)CSCC1(CCC1)C 62a_100000726658_100000210760 [0,0,1,1,0,0|2,0,0]=4 2749 B11R1.141 CC(C)CC(C)N1CCC1C 269982a_100000755817_100000731052 [0,0,1,1,0,0|2,0,0]=4 2750 B11R1.141 CC(C)CC(C)N1CCC1C 34a_100000755817_100000731052 [0,0,1,1,0,0|2,0,0]=4 2751 B11R1.314 CC1CCC(C1)N(C)C(C)C 270004a_200000211004_100011215218 [0,0,1,1,0,0|2,0,0]=4 2752 B11R1.503 CC(C)C(C)C(=O)CC1CC1 1458a_100000755409_100000742324 [0,0,1,1,0,0|0,0,2]=4 2753 B11R1.503 CC(C)C(C)N(C)CC1CC1 2230a_100000228512_100000742324 [0,0,1,1,0,0|2,0,0]=4 2754 B11R1.503 CC(C)C(C)N(C)CC1CC1 269982a_100000228512_100000756562 [0,0,1,1,0,0|2,0,0]=4 2755 B11R1.503 CC(C)N(C)C(C)CC1CC1 270004a_200000211004_200000686933 [0,0,1,1,0,0|2,0,0]=4 2756 B11R1.719 CC(C)CC(C)N(C)C1CC1 2230a_100000226674_100000731052 [0,0,1,1,0,0|2,0,0]=4 2757 B11R1.719 CC(C)CC(C)N(C)C1CC1 269982a_100000226674_100000731052 [0,0,1,1,0,0|2,0,0]=4 2758 B11R1.719 CC(C)CC(C)N(C)C1CC1 269982a_100000745462_100000211595 [0,0,1,1,0,0|2,0,0]=4 2759 B11R1.1263 CC(C)CC(=O)[C@H]1CC1(C)C 1458a_100000692687_100000210624 [0,0,1,1,0,0|0,0,2]=4 2760 B11R1.143 CC(C)C1CCCCCN1C 2230a_100000697956_200000210301 [0,0,1,1,0,0|2,0,0]=4 2761 B11R1.143 CC(C)C1CCCCCN1C 269982a_100000697956_200000210301 [0,0,1,1,0,0|2,0,0]=4 2762 B11R1.143 CC(C)C1CCCCCN1C 34a_100000697956_200000210301 [0,0,1,1,0,0|2,0,0]=4 2763 B11R1.143 CC(C)C1CCCCCN1[13CH3] 2230a_100000697956_200025704644 [0,0,1,1,0,0|2,0,0]=4 2764 B11R1.143 CC(C)C1CCCCCN1[13CH3] 269982a_100000697956_200025704644 [0,0,1,1,0,0|2,0,0]=4 2765 B11R1.143 CC(C)C1CCCCCN1[13CH3] 34a_100000697956_200025704644 [0,0,1,1,0,0|2,0,0]=4 2766 B11R1.420 CCCCN(C(C)C)C1CC1 2230a_100000226676_100000210211 [0,0,1,1,0,0|2,0,0]=4 2767 B11R1.420 CCCCN(C(C)C)C1CC1 269982a_100000207398_100000211595 [0,0,1,1,0,0|2,0,0]=4 2768 B11R1.420 CCCCN(C(C)C)C1CC1 269982a_100000226676_100000210211 [0,0,1,1,0,0|2,0,0]=4 2769 B11R1.420 CCCCN(C(C)C)C1CC1 34a_100000226676_100000210210 [0,0,1,1,0,0|2,0,0]=4 2770 B11R1.465 CCCCN1C(CCC1C)C 2230a_100000687148_100000210211 [0,0,1,1,0,0|2,0,0]=4 2771 B11R1.465 CCCCN1C(CCC1C)C 269982a_100000687148_100000210211 [0,0,1,1,0,0|2,0,0]=4 2772 B11R1.465 CCCCN1C(CCC1C)C 34a_100000687148_100000210210 [0,0,1,1,0,0|2,0,0]=4 2773 B11R1.721 CC(C)N(C(C)C)C1CCC1 269982a_100000086832_100000749161 [0,0,1,1,0,0|2,0,0]=4 2774 B11R1.721 CC(C)N(C(C)C)C1CCC1 34a_100000086832_100000749161 [0,0,1,1,0,0|2,0,0]=4 2775 B11R1.1381 CC(C)C(NC1CC1)C(C)C 34a_100000690608_100000211595 [0,0,1,1,0,0|2,0,0]=4 2776 B11R1.1381 CC(C)C(OC1CC1)C(C)C 34a_100011216681_100000211595 [0,0,1,1,0,0|2,0,0]=4 2777 B11R1.1381 CC(C)N(CC1CC1)C(C)C 2230a_100000086832_100000742324 [0,0,1,1,0,0|2,0,0]=4 2778 B11R1.1381 CC(C)N(CC1CC1)C(C)C 2230a_100000738798_100000210206 [0,0,1,1,0,0|2,0,0]=4 2779 B11R1.1381 CC(C)N(CC1CC1)C(C)C 269982a_100000086832_100000756562 [0,0,1,1,0,0|2,0,0]=4 2780 B11R1.1381 CC(C)N(CC1CC1)C(C)C 269982a_100000738798_100000210206 [0,0,1,1,0,0|2,0,0]=4 2781 B11R1.1381 CC(C)N(CC1CC1)C(C)C 34a_100000086832_100000742324 [0,0,1,1,0,0|2,0,0]=4 2782 B11R1.1381 CC(C)N(CC1CC1)C(C)C 34a_100000738798_100000210206 [0,0,1,1,0,0|2,0,0]=4 2783 B11R1.1466 CCNCC1C(C1(C)C)(C)C 2230a_100000725067_100000210202 [0,0,1,1,0,0|2,0,0]=4 2784 B11R1.10 CC1CC(CC(C1)(C)C)N[13CH3] 2230a_100011207991_200025704644 [0,0,1,1,0,0|2,0,0]=4 2785 B11R1.10 CNC1CC(CC(C1)(C)C)C 2230a_100011207991_200000210301 [0,0,1,1,0,0|2,0,0]=4 2786 B11R1.10 CNC1CC(CC(C1)(C)C)C 270004a_106832991635_100000209998 [0,0,1,1,0,0|2,0,0]=4 2787 B11R1.39 CCC(C)CN1CC[C@H](C1)C 2230a_100016987628_100000748023 [0,0,1,1,0,0|2,0,0]=4 2788 B11R1.39 CCC(C)CN1CC[C@H](C1)C 269982a_100016987628_100000748023 [0,0,1,1,0,0|2,0,0]=4 2789 B11R1.39 CCC(C)CN1CC[C@H](C1)C 270004a_100016987628_100000243153 [0,0,1,1,0,0|2,0,0]=4 2790 B11R1.39 CCC(C)CN1CC[C@H](C1)C 34a_100016987628_100000748023 [0,0,1,1,0,0|2,0,0]=4 2791 B11R1.39 CCC(C)NC1CCC(C1)C 270004a_100000209981_100011215218 [0,0,1,1,0,0|2,0,0]=4 2792 B11R1.39 CCC(C)OC1CCC(C1)C 34a_100000698185_100011215416 [0,0,1,1,0,0|2,0,0]=4 2793 B11R1.39 CC[C@H](C)CN1CC[C@H](C1)C 2230a_100016987628_100009816398 [0,0,1,1,0,0|2,0,0]=4 2794 B11R1.39 CC[C@H](C)CN1CC[C@H](C1)C 269982a_100016987628_100009816398 [0,0,1,1,0,0|2,0,0]=4 2795 B11R1.39 CC[C@H](C)CN1CC[C@H](C1)C 34a_100016987628_100009816398 [0,0,1,1,0,0|2,0,0]=4 2796 B11R1.198 CCC(C)CC(=O)CC1CC1 1458a_100000708755_100000742324 [0,0,1,1,0,0|0,0,2]=4 2797 B11R1.198 CCC(C)CC(=O)CC1CC1 1458a_100000738066_100000748023 [0,0,1,1,0,0|0,0,2]=4 2798 B11R1.198 CCC(C)CN(C)CC1CC1 2230a_100000741881_100000748023 [0,0,1,1,0,0|2,0,0]=4 2799 B11R1.198 CCC(C)CN(C)CC1CC1 2230a_100000753921_100000742324 [0,0,1,1,0,0|2,0,0]=4 2800 B11R1.198 CCC(C)CN(C)CC1CC1 269982a_100000741881_100000748023 [0,0,1,1,0,0|2,0,0]=4 2801 B11R1.198 CCC(C)CN(C)CC1CC1 269982a_100000753921_100000756562 [0,0,1,1,0,0|2,0,0]=4 2802 B11R1.198 CCC(C)CN(C)CC1CC1 270004a_100000741881_100000243153 [0,0,1,1,0,0|2,0,0]=4 2803 B11R1.198 CCC(C)NC(C)CC1CC1 270004a_100000209981_200000686933 [0,0,1,1,0,0|2,0,0]=4 2804 B11R1.198 CC[C@H](C)CC(=O)CC1CC1 1458a_100000738066_100009816398 [0,0,1,1,0,0|0,0,2]=4 2805 B11R1.198 CC[C@H](C)CN(C)CC1CC1 2230a_100000741881_100009816398 [0,0,1,1,0,0|2,0,0]=4 2806 B11R1.198 CC[C@H](C)CN(C)CC1CC1 269982a_100000741881_100009816398 [0,0,1,1,0,0|2,0,0]=4 2807 B11R1.257 CCC1CC1C(=O)CC(C)C 1458a_200011661523_100000210624 [0,0,1,1,0,0|0,0,2]=4 2808 B11R1.484 CC(C)CC(=O)CC1CCC1 1458a_100000210554_100000763275 [0,0,1,1,0,0|0,0,2]=4 2809 B11R1.484 CC(C)CC(=O)CC1CCC1 1458a_100000763092_100000210624 [0,0,1,1,0,0|0,0,2]=4 2810 B11R1.484 CC(C)CC(C)NC1CCC1 2230a_100000749019_100000731052 [0,0,1,1,0,0|2,0,0]=4 2811 B11R1.484 CC(C)CC(C)NC1CCC1 270004a_100000692259_100000241760 [0,0,1,1,0,0|2,0,0]=4 2812 B11R1.484 CC(C)CC(C)NC1CCC1 34a_100000749019_100000731052 [0,0,1,1,0,0|2,0,0]=4 2813 B11R1.484 CC(C)CC(C)OC1CCC1 34a_100000211805_100000749161 [0,0,1,1,0,0|2,0,0]=4 2814 B11R1.484 CC(C)CC(C)OC1CCC1 34a_100000748187_100000731052 [0,0,1,1,0,0|2,0,0]=4 2815 B11R1.484 CC(C)CC(C)SC1CCC1 62a_100000731052_100000749161 [0,0,1,1,0,0|2,0,0]=4 2816 B11R1.484 CC(C)CN(C)CC1CCC1 2230a_100000747067_100000763275 [0,0,1,1,0,0|2,0,0]=4 2817 B11R1.484 CC(C)CN(C)CC1CCC1 2230a_200000750244_100000210760 [0,0,1,1,0,0|2,0,0]=4 2818 B11R1.484 CC(C)CN(C)CC1CCC1 269982a_100000747067_100000763275 [0,0,1,1,0,0|2,0,0]=4 2819 B11R1.484 CC(C)CN(C)CC1CCC1 269982a_200000750244_100000210624 [0,0,1,1,0,0|2,0,0]=4 2820 B11R1.484 CC(C)CN(C)CC1CCC1 270004a_200000750244_100000210432 [0,0,1,1,0,0|2,0,0]=4 2821 B11R1.484 CC(C)CN(C)CC1CCC1 34a_200000750244_100000210624 [0,0,1,1,0,0|2,0,0]=4 2822 B11R1.728 CC(C)CC(=O)CC1(CC1)C 1458a_100000112800_100000210624 [0,0,1,1,0,0|0,0,2]=4 2823 B11R1.728 CC(C)CC(C)NC1(CC1)C 2230a_100000757604_100000731052 [0,0,1,1,0,0|2,0,0]=4 2824 B11R1.728 CC(C)CC(C)OC1(CC1)C 7a_100011725673_100000731052 [0,0,1,1,0,0|2,0,0]=4 2825 B11R1.815 CCC(C)CC(=O)C1CC1C 1458a_100000211227_100000748023 [0,0,1,1,0,0|0,0,2]=4 2826 B11R1.815 CC[C@H](C)CC(=O)C1CC1C 1458a_100000211227_100009816398 [0,0,1,1,0,0|0,0,2]=4 2827 B11R1.897 CCC(C)CN1CC(C1)(C)C 2230a_100000753659_100000748023 [0,0,1,1,0,0|2,0,0]=4 2828 B11R1.897 CCC(C)CN1CC(C1)(C)C 269982a_100000753659_100000748023 [0,0,1,1,0,0|2,0,0]=4 2829 B11R1.897 CCC(C)CN1CC(C1)(C)C 270004a_100000753659_100000243153 [0,0,1,1,0,0|2,0,0]=4 2830 B11R1.897 CC[C@H](C)CN1CC(C1)(C)C 2230a_100000753659_100009816398 [0,0,1,1,0,0|2,0,0]=4 2831 B11R1.897 CC[C@H](C)CN1CC(C1)(C)C 269982a_100000753659_100009816398 [0,0,1,1,0,0|2,0,0]=4 2832 B11R1.355 CCC(C(C)C)N1CC(C1)C 270004a_100000702820_100000210600 [0,0,1,1,0,0|2,0,0]=4 2833 B11R1.811 CC(C)CCN(CF)C1CC1 269982a_100000737065_100015361967 [0,0,1,1,0,0|2,0,0]=4 2834 B11R1.811 CC(C)CN[C@@H](CO)C1CC1 2230a_100020623730_100000210760 [0,0,1,1,0,0|1,0,0]=3 2835 B11R1.811 CC(C)CN[C@@H](CO)C1CC1 270004a_100020623730_100000210432 [0,0,1,1,0,0|1,0,0]=3 2836 B11R1.811 CC(C)CN[C@@H](CO)C1CC1 34a_100020623730_100000210624 [0,0,1,1,0,0|1,0,0]=3 2837 B11R1.811 CC(C)COC(CN)C1CC1 34a_100000751198_100000210624 [0,0,1,1,0,0|2,0,0]=4 2838 B11R1.811 CC(O)CN[C@@H](CO)C1CC1 2230a_100020623730_100011218427 [0,0,1,1,0,0|2,0,0]=4 2839 B11R1.811 CC(O)CN[C@@H](CO)C1CC1 34a_100020623730_100011218427 [0,0,1,1,0,0|2,0,0]=4 2840 B11R1.811 CCC(NCC(C)C)C1CC1 2230a_100025715781_100000210760 [0,0,1,1,0,0|2,0,0]=4 2841 B11R1.811 CCC(NCC(C)C)C1CC1 269862a_100000210953_100000759681 [0,0,1,1,0,0|2,0,0]=4 2842 B11R1.811 CCC(NCC(C)C)C1CC1 270004a_100025715781_100000210432 [0,0,1,1,0,0|2,0,0]=4 2843 B11R1.811 CCC(NCC(C)C)C1CC1 34a_100025715781_100000210624 [0,0,1,1,0,0|2,0,0]=4 2844 B11R1.811 CCC(OCC(C)C)C1CC1 34a_100011351122_100000210624 [0,0,1,1,0,0|2,0,0]=4 2845 B11R1.811 CCC(OCC(C)C)C1CC1 7a_100011351122_100000210760 [0,0,1,1,0,0|2,0,0]=4 2846 B11R1.811 CCN(CCC(C)C)C1CC1 2230a_100000737065_100000210202 [0,0,1,1,0,0|2,0,0]=4 2847 B11R1.811 CCN(CCC(C)C)C1CC1 2230a_100000738653_100000210312 [0,0,1,1,0,0|2,0,0]=4 2848 B11R1.811 CCN(CCC(C)C)C1CC1 269982a_100000207693_100000211595 [0,0,1,1,0,0|2,0,0]=4 2849 B11R1.811 CCN(CCC(C)C)C1CC1 269982a_100000737065_100000204670 [0,0,1,1,0,0|2,0,0]=4 2850 B11R1.811 CCN(CCC(C)C)C1CC1 269982a_100000738653_100000210312 [0,0,1,1,0,0|2,0,0]=4 2851 B11R1.811 C[C@@H](O)CN[C@@H](CO)C1CC1 2230a_100020623730_100009817552 [0,0,1,1,0,0|2,0,0]=4 2852 B11R1.811 C[C@@H](O)CN[C@@H](CO)C1CC1 34a_100020623730_100009817552 [0,0,1,1,0,0|2,0,0]=4 2853 B11R1.1017 CC(C)C(CN)COC1CC1 34a_100000692819_100000211595 [0,0,1,1,0,0|2,0,0]=4 2854 B11R1.1017 CC(C)C(CN)OCC1CC1 34a_100000759067_100000742324 [0,0,1,1,0,0|2,0,0]=4 2855 B11R1.1017 CC(C)C(CO)CNC1CC1 34a_100000692819_100000211595 [0,0,1,1,0,0|1,0,0]=3 2856 B11R1.1017 CC(C)[C@H](CO)NCC1CC1 2230a_100011830312_100000742324 [0,0,1,1,0,0|1,0,0]=3 2857 B11R1.1017 CC(C)[C@H](CO)NCC1CC1 269862a_100011830312_100000741477 [0,0,1,1,0,0|1,0,0]=3 2858 B11R1.1017 CC(C)[C@H](CO)NCC1CC1 34a_100011830312_100000742324 [0,0,1,1,0,0|1,0,0]=3 2859 B11R1.1017 CC(C)[C@H](CO)NCC1CO1 2230a_100011830312_100011216344 [0,0,1,1,0,0|2,0,0]=4 2860 B11R1.1017 CC(C)[C@H](CO)NCC1CO1 34a_100011830312_102125554688 [0,0,1,1,0,0|2,0,0]=4 2861 B11R1.1017 CCC(COC1CC1)C(C)C 34a_100011995916_100000211595 [0,0,1,1,0,0|2,0,0]=4 2862 B11R1.1017 CCC(NCC1CC1)C(C)C 269862a_100000745074_100000741477 [0,0,1,1,0,0|2,0,0]=4 2863 B11R1.1017 CCC(NCC1CC1)C(C)C 270004a_100000735609_100000210600 [0,0,1,1,0,0|2,0,0]=4 2864 B11R1.1017 CCC(OCC1CC1)C(C)C 34a_100011218073_100000742324 [0,0,1,1,0,0|2,0,0]=4 2865 B11R1.1017 CCC(OCC1CC1)C(C)C 7a_100011218073_100000742324 [0,0,1,1,0,0|2,0,0]=4 2866 B11R1.1017 CCN(CCC1CC1)C(C)C 2230a_100000223864_100000694398 [0,0,1,1,0,0|2,0,0]=4 2867 B11R1.1017 CCN(CCC1CC1)C(C)C 269982a_100000223864_100000694398 [0,0,1,1,0,0|2,0,0]=4 2868 B11R1.1017 C[C@@H](O)[C@@H](CO)NCC1CC1 2230a_100015196842_100000742324 [0,0,1,1,0,0|2,0,0]=4 2869 B11R1.1017 C[C@@H](O)[C@@H](CO)NCC1CC1 269862a_100015196842_100000741477 [0,0,1,1,0,0|2,0,0]=4 2870 B11R1.1017 C[C@@H](O)[C@@H](CO)NCC1CC1 34a_100015196842_100000742324 [0,0,1,1,0,0|2,0,0]=4 2871 B11R1.193 CCCC1CCCC1N(C)C 270004a_100102631434_100000723119 [0,0,1,1,0,0|2,0,0]=4 2872 B11R1.193 CCCN1CCCC1C(C)C 2230a_100000762757_100000210303 [0,0,1,1,0,0|2,0,0]=4 2873 B11R1.193 CCCN1CCCC1C(C)C 269982a_100000762757_100000210303 [0,0,1,1,0,0|2,0,0]=4 2874 B11R1.193 CCCN1CCCC1C(C)C 34a_100000762757_100000210303 [0,0,1,1,0,0|2,0,0]=4 2875 B11R1.199 CCCC(=O)C1CCCC1C 1458a_100000690547_100000210303 [0,0,1,1,0,0|0,0,2]=4 2876 B11R1.199 CCCC(C)N1CCC[C@@H]1C 2230a_100020605311_100000766640 [0,0,1,1,0,0|2,0,0]=4 2877 B11R1.199 CCCC(C)N1CCC[C@@H]1C 269982a_100020605311_100000766640 [0,0,1,1,0,0|2,0,0]=4 2878 B11R1.199 CCCC(C)N1CCC[C@@H]1C 270004a_100020605311_100000211909 [0,0,1,1,0,0|2,0,0]=4 2879 B11R1.199 CCCC(C)N1CCC[C@H]1C 2230a_100015189458_100000766640 [0,0,1,1,0,0|2,0,0]=4 2880 B11R1.199 CCCC(C)N1CCC[C@H]1C 269982a_100015189458_100000766640 [0,0,1,1,0,0|2,0,0]=4 2881 B11R1.199 CCCC(C)N1CCC[C@H]1C 270004a_100015189458_100000211909 [0,0,1,1,0,0|2,0,0]=4 2882 B11R1.199 CCCC(C)N1CCC[C@H]1C 34a_100015189458_100000766640 [0,0,1,1,0,0|2,0,0]=4 2883 B11R1.298 CCC(C(C)C)N1CCCC1 270004a_100000188435_100000210600 [0,0,1,1,0,0|2,0,0]=4 2884 B11R1.298 CCC(C1CCCC1)N(C)C 270004a_100102631434_100011350732 [0,0,1,1,0,0|2,0,0]=4 2885 B11R1.298 CCN(C(C)C)C1CCCC1 2230a_100000223864_100000179811 [0,0,1,1,0,0|2,0,0]=4 2886 B11R1.298 CCN(C(C)C)C1CCCC1 2230a_100000736669_100000210202 [0,0,1,1,0,0|2,0,0]=4 2887 B11R1.298 CCN(C(C)C)C1CCCC1 269982a_100000223864_100000179811 [0,0,1,1,0,0|2,0,0]=4 2888 B11R1.298 CCN(C(C)C)C1CCCC1 269982a_100000736669_100000204670 [0,0,1,1,0,0|2,0,0]=4 2889 B11R1.298 CCN(C(C)C)C1CCCC1 270004a_100000223864_100000210133 [0,0,1,1,0,0|2,0,0]=4 2890 B11R1.298 CCN(C(C)C)C1CCCC1 34a_100000736669_100000210202 [0,0,1,1,0,0|2,0,0]=4 2891 B11R1.823 CCCC(C)N(CC)C1CC1 2230a_100000738653_100000766640 [0,0,1,1,0,0|2,0,0]=4 2892 B11R1.823 CCCC(C)N(CC)C1CC1 269982a_100000738653_100000766640 [0,0,1,1,0,0|2,0,0]=4 2893 B11R1.823 CCCC(C)N(CC)C1CC1 270004a_100000738653_100000211909 [0,0,1,1,0,0|2,0,0]=4 2894 B11R1.1021 CCC(C(C)C)N(C)C1CC1 270004a_100000226674_100000210600 [0,0,1,1,0,0|2,0,0]=4 2895 B11R1.1021 CCN(C(C)C)C(C)C1CC1 2230a_200000232609_100000210206 [0,0,1,1,0,0|2,0,0]=4 2896 B11R1.1021 CCN(C(C)C)C(C)C1CC1 269982a_200000232609_100000210206 [0,0,1,1,0,0|2,0,0]=4 2897 B11R2.34 CC1CCN(CC1)C2CC2 269982a_100000188429_100000211595 [1,0,0,1,0,0|1,0,0]=3 2898 B11R2.34 CC1CCN(CC1)C2CC2 34a_100000188429_100000211595 [1,0,0,1,0,0|1,0,0]=3 2899 B11R2.34 CN1CCN(CC1)C2CC2 2230a_100000742459_200000210301 [1,0,0,1,0,0|2,0,0]=4 2900 B11R2.34 CN1CCN(CC1)C2CC2 269982a_100000188432_100000211595 [1,0,0,1,0,0|2,0,0]=4 2901 B11R2.34 CN1CCN(CC1)C2CC2 269982a_100000742459_200000210301 [1,0,0,1,0,0|2,0,0]=4 2902 B11R2.34 FC1CCN(CC1)C2CC2 269982a_100015193889_100000211595 [1,0,0,1,0,0|2,0,0]=4 2903 B11R2.34 FC1CCN(CC1)C2CC2 34a_100015193889_100000211595 [1,0,0,1,0,0|2,0,0]=4 2904 B11R2.34 OC1CCN(CC1)C2CC2 269982a_100025773856_100000211595 [1,0,0,1,0,0|2,0,0]=4 2905 B11R2.34 [13CH3]N1CCN(CC1)C2CC2 2230a_100000742459_200025704644 [1,0,0,1,0,0|2,0,0]=4 2906 B11R2.34 [13CH3]N1CCN(CC1)C2CC2 269982a_100000742459_200025704644 [1,0,0,1,0,0|2,0,0]=4 2907 B11R2.64 CN1CCN2CCC1CC2 269982a_100000027273_200000210301 [1,0,0,1,0,0|2,0,0]=4 2908 B11R2.64 [13CH3]N1CCN2CCC1CC2 269982a_100000027273_200025704644 [1,0,0,1,0,0|2,0,0]=4 2909 B11R2.55 CC1CCCCN1C2CC2 269982a_100000211376_100000211595 [1,0,0,1,0,0|2,0,0]=4 2910 B11R2.55 CC1CCCCN1C2CC2 34a_100000211376_100000211595 [1,0,0,1,0,0|2,0,0]=4 2911 B11R2.845 CC(C)N1CC2CCC1C2 2230a_100000743476_100000210206 [1,0,0,1,0,0|2,0,0]=4 2912 B11R2.845 CC(C)N1CC2CCC1C2 269982a_100000743476_100000210206 [1,0,0,1,0,0|2,0,0]=4 2913 B11R2.845 CC(C)N1CC2CCC1C2 34a_100000743476_100000210206 [1,0,0,1,0,0|2,0,0]=4 2914 B11R2.845 CN(C)C1CC2CCC1C2 2230a_200000720876_200000210301 [1,0,0,1,0,0|2,0,0]=4 2915 B11R2.845 CN(C)C1CC2CCC1C2 269982a_100102631434_100000727232 [1,0,0,1,0,0|2,0,0]=4 2916 B11R2.845 CN(C)C1CC2CCC1C2 269982a_200000720876_200000210301 [1,0,0,1,0,0|2,0,0]=4 2917 B11R2.845 CN(C)C1CC2CCC1C2 270004a_100102631434_100000223372 [1,0,0,1,0,0|2,0,0]=4 2918 B11R2.845 CN(C)C1CC2CCC1C2 34a_200000720876_200000210301 [1,0,0,1,0,0|2,0,0]=4 2919 B11R2.845 CN([13CH3])C1CC2CCC1C2 2230a_200000720876_200025704644 [1,0,0,1,0,0|2,0,0]=4 2920 B11R2.845 CN([13CH3])C1CC2CCC1C2 269982a_200000720876_200025704644 [1,0,0,1,0,0|2,0,0]=4 2921 B11R2.845 CN([13CH3])C1CC2CCC1C2 34a_200000720876_200025704644 [1,0,0,1,0,0|2,0,0]=4 2922 B13R2.5400 CC1CCC(C(C1)C)OC2CC2 34a_100011539931_100000211595 [0,0,0,1,0,1|1,0,0]=3 2923 B13R2.9615 CC1=C[C@@H]([C@H]2C[C@@H]1C2(C)C)O[13CH3] 34a_200016078237_200025704644 [0,1,0,1,0,0|0,0,2]=4 2924 B13R2.9615 CC1=C[C@@H]([C@H]2C[C@@H]1C2(C)C)O[13CH3] 7a_200016078237_200025704644 [0,1,0,1,0,0|0,0,2]=4 2925 B13R2.9615 CO[C@H]1C=C([C@@H]2C[C@H]1C2(C)C)C 34a_200016078237_200000210301 [0,1,0,1,0,0|0,0,2]=4 2926 B13R2.9615 CO[C@H]1C=C([C@@H]2C[C@H]1C2(C)C)C 7a_200016078237_200000210301 [0,1,0,1,0,0|0,0,2]=4 2927 B9R0.48 CC(Br)COC(C)CCO 34a_100012180447_100009893172 [0,0,1,0,1,0|2,0,0]=4 2928 B9R0.48 CC(C)CCC(=O)CCO 1458a_100000181311_100000211926 [0,0,1,0,1,0|1,0,1]=4 2929 B9R0.48 CC(C)CCC(=O)CCO 1458a_100011216618_100000210312 [0,0,1,0,1,0|1,0,1]=4 2930 B9R0.48 CC(C)CCC(C)OCF 34a_100011215350_100015361967 [0,0,1,0,1,0|2,0,0]=4 2931 B9R0.48 CC(C)CCC(C)OCF 7a_100011215350_100015361967 [0,0,1,0,1,0|2,0,0]=4 2932 B9R0.48 CC(C)CCC(C)SCF 62a_100011261404_100015361967 [0,0,1,0,1,0|2,0,0]=4 2933 B9R0.48 CC(C)CCC(C)SCF 62a_100015361967_100011261404 [0,0,1,0,1,0|2,0,0]=4 2934 B9R0.48 CC(C)CCN(C)CCF 2230a_100000742789_100011217306 [0,0,1,0,1,0|2,0,0]=4 2935 B9R0.48 CC(C)CCN(C)CCF 269982a_100000742789_100011217306 [0,0,1,0,1,0|2,0,0]=4 2936 B9R0.48 CC(C)CCN(C)CCO 2230a_100000210263_100000210312 [0,0,1,0,1,0|1,0,0]=3 2937 B9R0.48 CC(C)CCN(C)CCO 2230a_100000742789_100000211926 [0,0,1,0,1,0|1,0,0]=3 2938 B9R0.48 CC(C)CCN(C)CCO 269982a_100000210263_100000210312 [0,0,1,0,1,0|1,0,0]=3 2939 B9R0.48 CC(C)CCN(C)CCO 269982a_100000742789_100000211926 [0,0,1,0,1,0|1,0,0]=3 2940 B9R0.48 CC(C)CNC(C)CCO 2230a_100000210953_100009893172 [0,0,1,0,1,0|1,0,0]=3 2941 B9R0.48 CC(C)CNC(C)CCO 34a_100000210953_100009893172 [0,0,1,0,1,0|1,0,0]=3 2942 B9R0.48 CC(C)CN[C@H](C)CCO 2230a_100000706166_100000210760 [0,0,1,0,1,0|1,0,0]=3 2943 B9R0.48 CC(C)CN[C@H](C)CCO 270004a_100000706166_100000210432 [0,0,1,0,1,0|1,0,0]=3 2944 B9R0.48 CC(C)CN[C@H](C)CCO 34a_100000706166_100000210624 [0,0,1,0,1,0|1,0,0]=3 2945 B9R0.48 CC(C)COC(C)CCBr 34a_100012276601_100000210624 [0,0,1,0,1,0|2,0,0]=4 2946 B9R0.48 CC(C)COC(C)CCO 34a_100000210257_100009893172 [0,0,1,0,1,0|1,0,0]=3 2947 B9R0.48 CC(C)CSC(C)CCO 62a_100000210624_100009893172 [0,0,1,0,1,0|1,0,0]=3 2948 B9R0.48 CC(C)CSC(C)CCO 62a_100009893172_100000210760 [0,0,1,0,1,0|1,0,0]=3 2949 B9R0.48 CC(C)OCN(C)CCO 2230a_100000210263_100000709892 [0,0,1,0,1,0|2,0,0]=4 2950 B9R0.48 CC(C)OCN(C)CCO 269982a_100000210263_100000709892 [0,0,1,0,1,0|2,0,0]=4 2951 B9R0.48 CC(CCN)COC(C)C 34a_106354213184_100000210206 [0,0,1,0,1,0|2,0,0]=4 2952 B9R0.48 CC(CCO)OC[C@@H](C)Cl 34a_100016084084_100009893172 [0,0,1,0,1,0|2,0,0]=4 2953 B9R0.48 CC(CCO)OC[C@@H](C)N 34a_100000737577_100009893172 [0,0,1,0,1,0|2,0,0]=4 2954 B9R0.48 CC(CCO)SC[C@@H](C)O 62a_100009817552_100009893172 [0,0,1,0,1,0|2,0,0]=4 2955 B9R0.48 CC(CCO)SC[C@@H](C)O 62a_100009893172_100009817552 [0,0,1,0,1,0|2,0,0]=4 2956 B9R0.48 CC(F)COC(C)CCO 34a_100015925927_100009893172 [0,0,1,0,1,0|2,0,0]=4 2957 B9R0.48 CC(O)CCN(C)CCO 2230a_100000210263_100012276601 [0,0,1,0,1,0|2,0,0]=4 2958 B9R0.48 CC(O)CCN(C)CCO 269982a_100000210263_100012276601 [0,0,1,0,1,0|2,0,0]=4 2959 B9R0.48 CC(O)CNC(C)CCO 2230a_100000210904_100009893172 [0,0,1,0,1,0|2,0,0]=4 2960 B9R0.48 CC(O)CNC(C)CCO 34a_100000210904_100009893172 [0,0,1,0,1,0|2,0,0]=4 2961 B9R0.48 CC(O)CN[C@H](C)CCO 2230a_100000706166_100011218427 [0,0,1,0,1,0|2,0,0]=4 2962 B9R0.48 CC(O)CN[C@H](C)CCO 34a_100000706166_100011218427 [0,0,1,0,1,0|2,0,0]=4 2963 B9R0.48 CC(O)CSC(C)CCO 62a_100009893172_100011218427 [0,0,1,0,1,0|2,0,0]=4 2964 B9R0.48 CC(O)CSC(C)CCO 62a_100011218427_100009893172 [0,0,1,0,1,0|2,0,0]=4 2965 B9R0.48 CCCC(C)CNC(C)C 2230a_100138425928_100011216630 [0,0,1,0,1,0|2,0,0]=4 2966 B9R0.48 CCCC(C)CNC(C)C 34a_100138425928_100011216630 [0,0,1,0,1,0|2,0,0]=4 2967 B9R0.48 CCCC(C)COC(C)C 34a_100000212225_100011216630 [0,0,1,0,1,0|2,0,0]=4 2968 B9R0.48 CCCC(C)COC(C)C 34a_100000688023_100000210206 [0,0,1,0,1,0|2,0,0]=4 2969 B9R0.48 CCCC(C)COC(C)C 7a_100000688023_100000210206 [0,0,1,0,1,0|2,0,0]=4 2970 B9R0.48 CCCC(C)CSC(C)C 62a_100000210206_100011216630 [0,0,1,0,1,0|2,0,0]=4 2971 B9R0.48 CCCC(C)CSC(C)C 62a_100011216630_100000210206 [0,0,1,0,1,0|2,0,0]=4 2972 B9R0.48 CCCC(C)NCC(C)C 2230a_100000210953_100000766640 [0,0,1,0,1,0|2,0,0]=4 2973 B9R0.48 CCCC(C)NCC(C)C 2230a_100000741246_100000210760 [0,0,1,0,1,0|2,0,0]=4 2974 B9R0.48 CCCC(C)NCC(C)C 270004a_100000210953_100000211909 [0,0,1,0,1,0|2,0,0]=4 2975 B9R0.48 CCCC(C)NCC(C)C 270004a_100000741246_100000210432 [0,0,1,0,1,0|2,0,0]=4 2976 B9R0.48 CCCC(C)NCC(C)C 34a_100000210953_100000766640 [0,0,1,0,1,0|2,0,0]=4 2977 B9R0.48 CCCC(C)OCC(C)C 34a_100000210257_100000766640 [0,0,1,0,1,0|2,0,0]=4 2978 B9R0.48 CCCC(C)OCC(C)C 34a_100000764384_100000210624 [0,0,1,0,1,0|2,0,0]=4 2979 B9R0.48 CCCC(C)OCC(C)C 7a_100000764384_100000210760 [0,0,1,0,1,0|2,0,0]=4 2980 B9R0.48 CCCC(C)SCC(C)C 62a_100000210624_100000766640 [0,0,1,0,1,0|2,0,0]=4 2981 B9R0.48 CCCC(C)SCC(C)C 62a_100000766640_100000210760 [0,0,1,0,1,0|2,0,0]=4 2982 B9R0.48 CCCN(C)CCC(C)C 2230a_100000742789_100000210303 [0,0,1,0,1,0|2,0,0]=4 2983 B9R0.48 CCCN(C)CCC(C)C 2230a_100000747261_100000210312 [0,0,1,0,1,0|2,0,0]=4 2984 B9R0.48 CCCN(C)CCC(C)C 269982a_100000742789_100000210303 [0,0,1,0,1,0|2,0,0]=4 2985 B9R0.48 CCCN(C)CCC(C)C 269982a_100000747261_100000210312 [0,0,1,0,1,0|2,0,0]=4 2986 B9R0.48 CCNC(C)CCC(C)C 2230a_100015525214_100011261404 [0,0,1,0,1,0|2,0,0]=4 2987 B9R0.48 CCNC(C)CCC(C)C 2230a_100138410893_100000210202 [0,0,1,0,1,0|2,0,0]=4 2988 B9R0.48 CCNC(C)CCC(C)C 270004a_100015525214_100000210476 [0,0,1,0,1,0|2,0,0]=4 2989 B9R0.48 CCOC(C)CCC(C)C 34a_100011215350_100000210202 [0,0,1,0,1,0|2,0,0]=4 2990 B9R0.48 CCOC(C)CCC(C)C 34a_100121572206_100011261404 [0,0,1,0,1,0|2,0,0]=4 2991 B9R0.48 CCOC(C)CCC(C)C 7a_100011215350_100000210202 [0,0,1,0,1,0|2,0,0]=4 2992 B9R0.48 CCSC(C)CCC(C)C 62a_100000210202_100011261404 [0,0,1,0,1,0|2,0,0]=4 2993 B9R0.48 CCSC(C)CCC(C)C 62a_100011261404_100000210202 [0,0,1,0,1,0|2,0,0]=4 2994 B9R0.48 CN(C)CCN(C)CCO 269982a_100000210263_100000755713 [0,0,1,0,1,0|2,0,0]=4 2995 B9R0.48 CN(C)CCN(C)CCO 269982a_100000225618_100000211926 [0,0,1,0,1,0|2,0,0]=4 2996 B9R0.48 C[C@H](CCO)NC[C@@H](C)O 2230a_100000706166_100009817552 [0,0,1,0,1,0|2,0,0]=4 2997 B9R0.48 C[C@H](CCO)NC[C@@H](C)O 34a_100000706166_100009817552 [0,0,1,0,1,0|2,0,0]=4 2998 B9R0.79 CC(C)C(=O)C(C)C(C)C 1458a_100000755409_100000210206 [0,0,1,0,1,0|0,0,2]=4 2999 B9R0.79 CC(C)C(=O)[C@H](O)C(C)C 1458a_100000691806_100000210206 [0,0,1,0,1,0|1,0,1]=4 3000 B9R0.79 CC(C)C(C)N(C)C(C)C 2230a_100000228512_100000210206 [0,0,1,0,1,0|2,0,0]=4 3001 B9R0.79 CC(C)C(C)N(C)C(C)C 269982a_100000228512_100000210206 [0,0,1,0,1,0|2,0,0]=4 3002 B9R0.42 CCC(C)CC(=O)C(C)C 1458a_100000210198_100000748023 [0,0,1,0,1,0|0,0,2]=4 3003 B9R0.42 CCC(C)CC(=O)C(C)C 1458a_100000708755_100000210206 [0,0,1,0,1,0|0,0,2]=4 3004 B9R0.42 CCC(C)CC(C)N(C)C 270004a_100102631434_100011710205 [0,0,1,0,1,0|2,0,0]=4 3005 B9R0.42 CCC(C)CN(C)C(C)C 2230a_100000753921_100000210206 [0,0,1,0,1,0|2,0,0]=4 3006 B9R0.42 CCC(C)CN(C)C(C)C 269982a_100000753921_100000210206 [0,0,1,0,1,0|2,0,0]=4 3007 B9R0.42 CCC(C)CN(C)C(C)C 269982a_200000211004_100000748023 [0,0,1,0,1,0|2,0,0]=4 3008 B9R0.42 CCC(C)CN(C)C(C)C 270004a_200000211004_100000243153 [0,0,1,0,1,0|2,0,0]=4 3009 B9R0.42 CCC(C)NC(C)C(C)C 2230a_100000211541_100000758301 [0,0,1,0,1,0|2,0,0]=4 3010 B9R0.42 CCC(C)OC(C)C(C)C 7a_100000748068_100000758301 [0,0,1,0,1,0|2,0,0]=4 3011 B9R0.42 CC[C@H](C)CC(=O)C(C)C 1458a_100000210198_100009816398 [0,0,1,0,1,0|0,0,2]=4 3012 B9R0.42 CC[C@H](C)CN(C)C(C)C 269982a_200000211004_100009816398 [0,0,1,0,1,0|2,0,0]=4 3013 B9R0.39 CC(C)CC(O[13CH3])C(C)C 34a_200011219802_200025704644 [0,0,1,0,1,0|2,0,0]=4 3014 B9R0.39 CC(C)CC(O[13CH3])C(C)C 7a_200011219802_200025704644 [0,0,1,0,1,0|2,0,0]=4 3015 B9R0.39 CC(C)CN(CF)C(C)C 269982a_100000737641_100015361967 [0,0,1,0,1,0|2,0,0]=4 3016 B9R0.39 CC(C)N[C@@H](CO)C(C)C 2230a_100011830312_100000210206 [0,0,1,0,1,0|1,0,0]=3 3017 B9R0.39 CC(C)N[C@@H](CO)C(C)C 34a_100011830312_100000210206 [0,0,1,0,1,0|1,0,0]=3 3018 B9R0.39 CC(C)N[C@H](CO)[C@@H](C)O 2230a_100015196842_100000210206 [0,0,1,0,1,0|2,0,0]=4 3019 B9R0.39 CC(C)N[C@H](CO)[C@@H](C)O 34a_100015196842_100000210206 [0,0,1,0,1,0|2,0,0]=4 3020 B9R0.39 CC(C)OC(CN)C(C)C 34a_100000759067_100000210206 [0,0,1,0,1,0|2,0,0]=4 3021 B9R0.39 CCC(OC(C)C)C(C)C 34a_100011218073_100000210206 [0,0,1,0,1,0|2,0,0]=4 3022 B9R0.39 CCC(OC(C)C)C(C)C 7a_100011218073_100000210206 [0,0,1,0,1,0|2,0,0]=4 3023 B9R0.39 CCN(CC(C)C)C(C)C 2230a_100000223864_100000210760 [0,0,1,0,1,0|2,0,0]=4 3024 B9R0.39 CCN(CC(C)C)C(C)C 2230a_100000737641_100000210202 [0,0,1,0,1,0|2,0,0]=4 3025 B9R0.39 CCN(CC(C)C)C(C)C 2230a_100000738554_100000210206 [0,0,1,0,1,0|2,0,0]=4 3026 B9R0.39 CCN(CC(C)C)C(C)C 269982a_100000223864_100000210624 [0,0,1,0,1,0|2,0,0]=4 3027 B9R0.39 CCN(CC(C)C)C(C)C 269982a_100000737641_100000204670 [0,0,1,0,1,0|2,0,0]=4 3028 B9R0.39 CCN(CC(C)C)C(C)C 269982a_100000738554_100000210206 [0,0,1,0,1,0|2,0,0]=4 3029 B9R0.39 CCN(CC(C)C)C(C)C 270004a_100000223864_100000210432 [0,0,1,0,1,0|2,0,0]=4 3030 B9R0.39 COC(CC(C)C)C(C)C 34a_200011219802_200000210301 [0,0,1,0,1,0|2,0,0]=4 3031 B9R0.39 COC(CC(C)C)C(C)C 7a_200011219802_200000210301 [0,0,1,0,1,0|2,0,0]=4 3032 B9R1.35 CC(C)N1CCC(C1)O 2230a_100011215560_100000210206 [1,0,0,0,1,0|2,0,0]=4 3033 B9R1.35 CC(C)N1CCC(C1)O 269982a_100011215560_100000210206 [1,0,0,0,1,0|2,0,0]=4 3034 B9R1.35 CC(C)N1CC[C@@H](C1)F 2230a_100015203821_100000210206 [1,0,0,0,1,0|2,0,0]=4 3035 B9R1.35 CC(C)N1CC[C@@H](C1)F 269982a_100015203821_100000210206 [1,0,0,0,1,0|2,0,0]=4 3036 B9R1.35 CC(C)N1CC[C@@H](C1)F 34a_100015203821_100000210206 [1,0,0,0,1,0|2,0,0]=4 3037 B9R1.35 CC(C)N1CC[C@H](C1)C 2230a_100016987628_100000210206 [1,0,0,0,1,0|1,0,0]=3 3038 B9R1.35 CC(C)N1CC[C@H](C1)C 269982a_100016987628_100000210206 [1,0,0,0,1,0|1,0,0]=3 3039 B9R1.35 CC(C)N1CC[C@H](C1)C 34a_100016987628_100000210206 [1,0,0,0,1,0|1,0,0]=3 3040 B9R1.35 CC1CCC(C1)N(C)C 270004a_100102631434_100011215218 [1,0,0,0,1,0|1,0,0]=3 3041 B9R1.35 CN(C)C1CCC(C1)O 270004a_100102631434_100012614533 [1,0,0,0,1,0|2,0,0]=4 3042 B9R1.35 CN(C)[C@H]1CCN(C1)[13CH3] 2230a_100016988096_200025704644 [1,0,0,0,1,0|2,0,0]=4 3043 B9R1.35 CN(C)[C@H]1CCN(C1)[13CH3] 269982a_100016988096_200025704644 [1,0,0,0,1,0|2,0,0]=4 3044 B9R1.35 CN1CCC(C1)N(C)C 2230a_103436538152_200000210301 [1,0,0,0,1,0|2,0,0]=4 3045 B9R1.35 CN1CCC(C1)N(C)C 269982a_100102631434_200012183744 [1,0,0,0,1,0|2,0,0]=4 3046 B9R1.35 CN1CCC(C1)N(C)C 269982a_103436538152_200000210301 [1,0,0,0,1,0|2,0,0]=4 3047 B9R1.35 CN1CCC(C1)N(C)[13CH3] 2230a_103436538152_200025704644 [1,0,0,0,1,0|2,0,0]=4 3048 B9R1.35 CN1CCC(C1)N(C)[13CH3] 269982a_103436538152_200025704644 [1,0,0,0,1,0|2,0,0]=4 3049 B9R1.35 CN1CC[C@@H](C1)N(C)C 2230a_100016988096_200000210301 [1,0,0,0,1,0|2,0,0]=4 3050 B9R1.35 CN1CC[C@@H](C1)N(C)C 269982a_100016988096_200000210301 [1,0,0,0,1,0|2,0,0]=4 3051 B9R1.41 CC(C)C1CCCN1C 2230a_100000762757_200000210301 [1,0,0,0,1,0|2,0,0]=4 3052 B9R1.41 CC(C)C1CCCN1C 269982a_100000762757_200000210301 [1,0,0,0,1,0|2,0,0]=4 3053 B9R1.41 CC(C)C1CCCN1C 34a_100000762757_200000210301 [1,0,0,0,1,0|2,0,0]=4 3054 B9R1.41 CC(C)C1CCCN1[13CH3] 2230a_100000762757_200025704644 [1,0,0,0,1,0|2,0,0]=4 3055 B9R1.41 CC(C)C1CCCN1[13CH3] 269982a_100000762757_200025704644 [1,0,0,0,1,0|2,0,0]=4 3056 B9R1.41 CC(C)C1CCCN1[13CH3] 34a_100000762757_200025704644 [1,0,0,0,1,0|2,0,0]=4 3057 B9R1.41 CC(C)N1CCC[C@@H]1C 2230a_100020605311_100000210206 [1,0,0,0,1,0|2,0,0]=4 3058 B9R1.41 CC(C)N1CCC[C@@H]1C 269982a_100020605311_100000210206 [1,0,0,0,1,0|2,0,0]=4 3059 B9R1.41 CC(C)N1CCC[C@H]1C 2230a_100015189458_100000210206 [1,0,0,0,1,0|2,0,0]=4 3060 B9R1.41 CC(C)N1CCC[C@H]1C 269982a_100015189458_100000210206 [1,0,0,0,1,0|2,0,0]=4 3061 B9R1.41 CC(C)N1CCC[C@H]1C 34a_100015189458_100000210206 [1,0,0,0,1,0|2,0,0]=4 3062 B9R1.41 CN(C)[C@@H]1CCC[C@H]1O 269982a_100102631434_200016002552 [1,0,0,0,1,0|1,0,0]=3 3063 B11R0.176 C#CCC(C)OCCCC(C)C 34a_100000685586_100011214892 [0,0,1,0,0,1|1,0,1]=4 3064 B11R0.176 C#CCC(C)OCCCC(C)C 7a_100000685586_100011214892 [0,0,1,0,0,1|1,0,1]=4 3065 B11R0.176 C=CCC(C)COCCC(C)C 34a_100009832082_100000210312 [0,0,1,0,0,1|1,0,1]=4 3066 B11R0.176 C=CCC(C)COCCC(C)C 7a_100009832082_100000210626 [0,0,1,0,0,1|1,0,1]=4 3067 B11R0.176 C=CC[C@@H](C)OCCCC(C)C 34a_100000731007_100011214892 [0,0,1,0,0,1|1,0,1]=4 3068 B11R0.176 C=CC[C@@H](C)OCCCC(C)C 7a_100000731007_100011214892 [0,0,1,0,0,1|1,0,1]=4 3069 B11R0.176 CC(=CCCN[C@H](C)CCO)C 2230a_100000706166_100011217483 [0,0,1,0,0,1|0,0,2]=4 3070 B11R0.176 CC(=CCCN[C@H](C)CCO)C 34a_100000706166_100011217483 [0,0,1,0,0,1|0,0,2]=4 3071 B11R0.176 CC(=CCCSC(C)CCO)C 62a_100009893172_100011217483 [0,0,1,0,0,1|0,0,2]=4 3072 B11R0.176 CC(=CCCSC(C)CCO)C 62a_100011217483_100009893172 [0,0,1,0,0,1|0,0,2]=4 3073 B11R0.176 CC(=O)CCCN[C@H](C)CCO 34a_100000706166_100000685027 [0,0,1,0,0,1|1,0,1]=4 3074 B11R0.176 CC(=O)CCCOC(C)CCO 34a_100000759063_100009893172 [0,0,1,0,0,1|1,0,1]=4 3075 B11R0.176 CC(=O)CCCOC(C)CCO 7a_100000759063_100009893172 [0,0,1,0,0,1|1,0,1]=4 3076 B11R0.176 CC(=O)CCCSC(C)CCO 62a_100009893172_100011215641 [0,0,1,0,0,1|1,0,1]=4 3077 B11R0.176 CC(=O)CCCSC(C)CCO 62a_100011215641_100009893172 [0,0,1,0,0,1|1,0,1]=4 3078 B11R0.176 CC(C)CCCCC(=O)CCO 1458a_100011216618_100011216152 [0,0,1,0,0,1|1,0,1]=4 3079 B11R0.176 CC(C)CCCCC(=O)CCO 1458a_100011933920_100000211926 [0,0,1,0,0,1|1,0,1]=4 3080 B11R0.176 CC(C)CCCCN(C)CCO 2230a_100000210263_100011216152 [0,0,1,0,0,1|1,0,0]=3 3081 B11R0.176 CC(C)CCCCN(C)CCO 269982a_100000210263_100011216152 [0,0,1,0,0,1|1,0,0]=3 3082 B11R0.176 CC(C)CCCNC(=O)CCO 240690a_200000737386_100011216618 [0,0,1,0,0,1|1,0,1]=4 3083 B11R0.176 CC(C)CCCNC(C)CC#N 2230a_200000737386_100009813641 [0,0,1,0,0,1|1,0,1]=4 3084 B11R0.176 CC(C)CCCNC(C)CCO 2230a_200000737386_100009893172 [0,0,1,0,0,1|0,0,0]=2 3085 B11R0.176 CC(C)CCCNC(C)CCO 34a_200000737386_100009893172 [0,0,1,0,0,1|0,0,0]=2 3086 B11R0.176 CC(C)CCCN[C@@H](C)CC#N 2230a_100016994482_100011214892 [0,0,1,0,0,1|1,0,1]=4 3087 B11R0.176 CC(C)CCCN[C@H](C)CCO 2230a_100000706166_100011214892 [0,0,1,0,0,1|0,0,0]=2 3088 B11R0.176 CC(C)CCCN[C@H](C)CCO 34a_100000706166_100011214892 [0,0,1,0,0,1|0,0,0]=2 3089 B11R0.176 CC(C)CCCOC(C)CC#N 7a_100000210774_100009813641 [0,0,1,0,0,1|1,0,1]=4 3090 B11R0.176 CC(C)CCCOC(C)CCBr 34a_100012276601_100011214892 [0,0,1,0,0,1|1,0,0]=3 3091 B11R0.176 CC(C)CCCOC(C)CCO 34a_100000210774_100009893172 [0,0,1,0,0,1|0,0,0]=2 3092 B11R0.176 CC(C)CCCOC(C)CCO 7a_100000210774_100009893172 [0,0,1,0,0,1|0,0,0]=2 3093 B11R0.176 CC(C)CCCSC(C)CC#N 62a_100009813641_100011214892 [0,0,1,0,0,1|1,0,1]=4 3094 B11R0.176 CC(C)CCCSC(C)CC#N 62a_100011214892_100009813641 [0,0,1,0,0,1|1,0,1]=4 3095 B11R0.176 CC(C)CCCSC(C)CCO 62a_100009893172_100011214892 [0,0,1,0,0,1|0,0,0]=2 3096 B11R0.176 CC(C)CCCSC(C)CCO 62a_100011214892_100009893172 [0,0,1,0,0,1|0,0,0]=2 3097 B11R0.176 CC(C)CCOCC(C)CCN 34a_106354213184_100000210312 [0,0,1,0,0,1|1,0,0]=3 3098 B11R0.176 CC(C)NCCOC(C)CCO 34a_100000224655_100009893172 [0,0,1,0,0,1|1,0,0]=3 3099 B11R0.176 CC(C)OCCN[C@H](C)CCO 2230a_100000706166_100000211751 [0,0,1,0,0,1|1,0,0]=3 3100 B11R0.176 CC(C)OCCN[C@H](C)CCO 34a_100000706166_100000211751 [0,0,1,0,0,1|1,0,0]=3 3101 B11R0.176 CC(C)OCCOC(C)CCBr 34a_100012276601_100000211751 [0,0,1,0,0,1|2,0,0]=4 3102 B11R0.176 CC(C)OCCOC(C)CCO 34a_100000211219_100009893172 [0,0,1,0,0,1|1,0,0]=3 3103 B11R0.176 CC(C)OCCOC(C)CCO 7a_100000211219_100009893172 [0,0,1,0,0,1|1,0,0]=3 3104 B11R0.176 CC(C)OCCSC(C)CCO 62a_100000211751_100009893172 [0,0,1,0,0,1|1,0,0]=3 3105 B11R0.176 CC(C)OCCSC(C)CCO 62a_100009893172_100000211751 [0,0,1,0,0,1|1,0,0]=3 3106 B11R0.176 CC(C)SCCN[C@H](C)CCO 2230a_100000706166_100000730970 [0,0,1,0,0,1|1,0,0]=3 3107 B11R0.176 CC(C)SCCN[C@H](C)CCO 34a_100000706166_100000730970 [0,0,1,0,0,1|1,0,0]=3 3108 B11R0.176 CC(C)SCCSC(C)CCO 62a_100000730970_100009893172 [0,0,1,0,0,1|1,0,0]=3 3109 B11R0.176 CC(C)SCCSC(C)CCO 62a_100009893172_100000730970 [0,0,1,0,0,1|1,0,0]=3 3110 B11R0.176 CC(CCBr)OCCSC(C)C 34a_100012276601_100000730970 [0,0,1,0,0,1|2,0,0]=4 3111 B11R0.176 CC(CCN)COCOC(C)C 34a_106354213184_100000709892 [0,0,1,0,0,1|2,0,0]=4 3112 B11R0.176 CC(CCO)NCCCS(=O)C 2230a_200000753449_100009893172 [0,0,1,0,0,1|2,0,0]=4 3113 B11R0.176 CC(CCO)NCCOC(C)C 2230a_100000701111_100009893172 [0,0,1,0,0,1|1,0,0]=3 3114 B11R0.176 CC(CCO)NCCOC(C)C 34a_100000701111_100009893172 [0,0,1,0,0,1|1,0,0]=3 3115 B11R0.176 CC(CCO)NCCSC(C)C 2230a_100000731138_100009893172 [0,0,1,0,0,1|1,0,0]=3 3116 B11R0.176 CC(CCO)NCCSC(C)C 34a_100000731138_100009893172 [0,0,1,0,0,1|1,0,0]=3 3117 B11R0.176 CC(CCO)OCCSC(C)C 34a_200011212901_100009893172 [0,0,1,0,0,1|1,0,0]=3 3118 B11R0.176 CC(CCO)OCCSC(C)C 7a_200011212901_100009893172 [0,0,1,0,0,1|1,0,0]=3 3119 B11R0.176 CC(CCO)SCCCN(C)C 62a_100009893172_100000757444 [0,0,1,0,0,1|1,0,0]=3 3120 B11R0.176 CC(O)CCCN[C@H](C)CCO 2230a_100000706166_200000718107 [0,0,1,0,0,1|1,0,0]=3 3121 B11R0.176 CC(O)CCCN[C@H](C)CCO 34a_100000706166_200000718107 [0,0,1,0,0,1|1,0,0]=3 3122 B11R0.176 CC(O)CCCOC(C)CCBr 34a_100012276601_200000718107 [0,0,1,0,0,1|2,0,0]=4 3123 B11R0.176 CC(O)CCCSC(C)CCO 62a_100009893172_200000718107 [0,0,1,0,0,1|1,0,0]=3 3124 B11R0.176 CC(O)CCCSC(C)CCO 62a_200000718107_100009893172 [0,0,1,0,0,1|1,0,0]=3 3125 B11R0.176 CC(O)CCOCC(C)CCN 34a_106354213184_100012276601 [0,0,1,0,0,1|2,0,0]=4 3126 B11R0.176 CCCC(C)CCCOC(C)C 34a_100011713154_100000210206 [0,0,1,0,0,1|1,0,0]=3 3127 B11R0.176 CCCC(C)CCCOC(C)C 7a_100011713154_100000210206 [0,0,1,0,0,1|1,0,0]=3 3128 B11R0.176 CCCC(C)CCOCC(C)C 34a_100011217855_100000210624 [0,0,1,0,0,1|1,0,0]=3 3129 B11R0.176 CCCC(C)CCOCC(C)C 7a_100011217855_100000210760 [0,0,1,0,0,1|1,0,0]=3 3130 B11R0.176 CCCC(C)CCOCC(C)O 34a_100011217855_100011218427 [0,0,1,0,0,1|2,0,0]=4 3131 B11R0.176 CCCC(C)CCOCC(C)O 7a_100011217855_100011218427 [0,0,1,0,0,1|2,0,0]=4 3132 B11R0.176 CCCC(C)CCOC[C@@H](C)O 34a_100011217855_100009817552 [0,0,1,0,0,1|2,0,0]=4 3133 B11R0.176 CCCC(C)CCOC[C@@H](C)O 7a_100011217855_100009817552 [0,0,1,0,0,1|2,0,0]=4 3134 B11R0.176 CCCC(C)CNCCC(C)C 270004a_100000210545_100000243154 [0,0,1,0,0,1|1,0,0]=3 3135 B11R0.176 CCCC(C)CNCCC(C)O 2230a_200000755665_100011216630 [0,0,1,0,0,1|2,0,0]=4 3136 B11R0.176 CCCC(C)CNCCC(C)O 270004a_200000755665_100000243154 [0,0,1,0,0,1|2,0,0]=4 3137 B11R0.176 CCCC(C)CNCCN(C)C 270004a_100000210585_100000243154 [0,0,1,0,0,1|2,0,0]=4 3138 B11R0.176 CCCC(C)COCCC(C)Br 34a_100009893172_100011216630 [0,0,1,0,0,1|2,0,0]=4 3139 B11R0.176 CCCC(C)COCCC(C)C 34a_100000210254_100011216630 [0,0,1,0,0,1|1,0,0]=3 3140 B11R0.176 CCCC(C)COCCC(C)C 34a_100000688023_100000210312 [0,0,1,0,0,1|1,0,0]=3 3141 B11R0.176 CCCC(C)COCCC(C)C 7a_100000210254_100011216630 [0,0,1,0,0,1|1,0,0]=3 3142 B11R0.176 CCCC(C)COCCC(C)C 7a_100000688023_100000210626 [0,0,1,0,0,1|1,0,0]=3 3143 B11R0.176 CCCC(C)COCCC(C)O 34a_100000688023_100012276601 [0,0,1,0,0,1|2,0,0]=4 3144 B11R0.176 CCCC(C)COCCC(C)O 7a_100000688023_100012276601 [0,0,1,0,0,1|2,0,0]=4 3145 B11R0.176 CCCC(C)COCCN(C)C 7a_100000688023_100000755713 [0,0,1,0,0,1|2,0,0]=4 3146 B11R0.176 CCCC(C)COCC[C@@H](C)N 34a_100000706166_100011216630 [0,0,1,0,0,1|2,0,0]=4 3147 B11R0.176 CCCC(C)COCOC(C)C 34a_100000688023_100000709892 [0,0,1,0,0,1|2,0,0]=4 3148 B11R0.176 CCCC(C)CSCCC(C)C 62a_100000210312_100011216630 [0,0,1,0,0,1|1,0,0]=3 3149 B11R0.176 CCCC(C)CSCCC(C)C 62a_100011216630_100000210312 [0,0,1,0,0,1|1,0,0]=3 3150 B11R0.176 CCCC(C)CSCCC(C)O 62a_100011216630_100012276601 [0,0,1,0,0,1|2,0,0]=4 3151 B11R0.176 CCCC(C)CSCCC(C)O 62a_100012276601_100011216630 [0,0,1,0,0,1|2,0,0]=4 3152 B11R0.176 CCCC(C)CSCCN(C)C 62a_100011216630_100000755713 [0,0,1,0,0,1|2,0,0]=4 3153 B11R0.176 CCCC(C)CSCOC(C)C 62a_100000709892_100011216630 [0,0,1,0,0,1|2,0,0]=4 3154 B11R0.176 CCCC(C)CSCOC(C)C 62a_100011216630_100000709892 [0,0,1,0,0,1|2,0,0]=4 3155 B11R0.176 CCCC(C)NCCCC(C)C 2230a_100000741246_100011214892 [0,0,1,0,0,1|1,0,0]=3 3156 B11R0.176 CCCC(C)NCCCC(C)C 2230a_200000737386_100000766640 [0,0,1,0,0,1|1,0,0]=3 3157 B11R0.176 CCCC(C)NCCCC(C)C 270004a_200000737386_100000211909 [0,0,1,0,0,1|1,0,0]=3 3158 B11R0.176 CCCC(C)NCCCC(C)C 34a_200000737386_100000766640 [0,0,1,0,0,1|1,0,0]=3 3159 B11R0.176 CCCC(C)NCCCC(C)O 2230a_100000741246_200000718107 [0,0,1,0,0,1|2,0,0]=4 3160 B11R0.176 CCCC(C)NCCCN(C)C 270004a_102531767803_100000211909 [0,0,1,0,0,1|2,0,0]=4 3161 B11R0.176 CCCC(C)NCCOC(C)C 2230a_100000701111_100000766640 [0,0,1,0,0,1|2,0,0]=4 3162 B11R0.176 CCCC(C)NCCOC(C)C 2230a_100000741246_100000211751 [0,0,1,0,0,1|2,0,0]=4 3163 B11R0.176 CCCC(C)NCCOC(C)C 270004a_100000701111_100000211909 [0,0,1,0,0,1|2,0,0]=4 3164 B11R0.176 CCCC(C)NCCOC(C)C 34a_100000701111_100000766640 [0,0,1,0,0,1|2,0,0]=4 3165 B11R0.176 CCCC(C)NCCSC(C)C 2230a_100000731138_100000766640 [0,0,1,0,0,1|2,0,0]=4 3166 B11R0.176 CCCC(C)NCCSC(C)C 2230a_100000741246_100000730970 [0,0,1,0,0,1|2,0,0]=4 3167 B11R0.176 CCCC(C)NCCSC(C)C 270004a_100000731138_100000211909 [0,0,1,0,0,1|2,0,0]=4 3168 B11R0.176 CCCC(C)NCCSC(C)C 34a_100000731138_100000766640 [0,0,1,0,0,1|2,0,0]=4 3169 B11R0.176 CCCC(C)OCCCC(C)C 34a_100000210774_100000766640 [0,0,1,0,0,1|1,0,0]=3 3170 B11R0.176 CCCC(C)OCCCC(C)C 34a_100000764384_100011214892 [0,0,1,0,0,1|1,0,0]=3 3171 B11R0.176 CCCC(C)OCCCC(C)C 7a_100000210774_100000766640 [0,0,1,0,0,1|1,0,0]=3 3172 B11R0.176 CCCC(C)OCCCC(C)C 7a_100000764384_100011214892 [0,0,1,0,0,1|1,0,0]=3 3173 B11R0.176 CCCC(C)OCCCC(C)O 34a_100000764384_200000718107 [0,0,1,0,0,1|2,0,0]=4 3174 B11R0.176 CCCC(C)OCCCC(C)O 7a_100000764384_200000718107 [0,0,1,0,0,1|2,0,0]=4 3175 B11R0.176 CCCC(C)OCCCN(C)C 7a_100000764384_100000757444 [0,0,1,0,0,1|2,0,0]=4 3176 B11R0.176 CCCC(C)OCCNC(C)C 34a_100000224655_100000766640 [0,0,1,0,0,1|2,0,0]=4 3177 B11R0.176 CCCC(C)OCCOC(C)C 34a_100000211219_100000766640 [0,0,1,0,0,1|2,0,0]=4 3178 B11R0.176 CCCC(C)OCCOC(C)C 34a_100000764384_100000211751 [0,0,1,0,0,1|2,0,0]=4 3179 B11R0.176 CCCC(C)OCCOC(C)C 7a_100000211219_100000766640 [0,0,1,0,0,1|2,0,0]=4 3180 B11R0.176 CCCC(C)OCCOC(C)C 7a_100000764384_100000211751 [0,0,1,0,0,1|2,0,0]=4 3181 B11R0.176 CCCC(C)OCCSC(C)C 34a_100000764384_100000730970 [0,0,1,0,0,1|2,0,0]=4 3182 B11R0.176 CCCC(C)OCCSC(C)C 34a_200011212901_100000766640 [0,0,1,0,0,1|2,0,0]=4 3183 B11R0.176 CCCC(C)OCCSC(C)C 7a_100000764384_100000730970 [0,0,1,0,0,1|2,0,0]=4 3184 B11R0.176 CCCC(C)OCCSC(C)C 7a_200011212901_100000766640 [0,0,1,0,0,1|2,0,0]=4 3185 B11R0.176 CCCC(C)SCCCC(C)C 62a_100000766640_100011214892 [0,0,1,0,0,1|1,0,0]=3 3186 B11R0.176 CCCC(C)SCCCC(C)C 62a_100011214892_100000766640 [0,0,1,0,0,1|1,0,0]=3 3187 B11R0.176 CCCC(C)SCCCC(C)O 62a_100000766640_200000718107 [0,0,1,0,0,1|2,0,0]=4 3188 B11R0.176 CCCC(C)SCCCC(C)O 62a_200000718107_100000766640 [0,0,1,0,0,1|2,0,0]=4 3189 B11R0.176 CCCC(C)SCCCN(C)C 62a_100000766640_100000757444 [0,0,1,0,0,1|2,0,0]=4 3190 B11R0.176 CCCC(C)SCCOC(C)C 62a_100000211751_100000766640 [0,0,1,0,0,1|2,0,0]=4 3191 B11R0.176 CCCC(C)SCCOC(C)C 62a_100000766640_100000211751 [0,0,1,0,0,1|2,0,0]=4 3192 B11R0.176 CCCC(C)SCCSC(C)C 62a_100000730970_100000766640 [0,0,1,0,0,1|2,0,0]=4 3193 B11R0.176 CCCC(C)SCCSC(C)C 62a_100000766640_100000730970 [0,0,1,0,0,1|2,0,0]=4 3194 B11R0.176 CCCN(C)CCCCC(C)C 2230a_100000747261_100011216152 [0,0,1,0,0,1|2,0,0]=4 3195 B11R0.176 CCCN(C)CCCCC(C)C 269982a_100000747261_100011216152 [0,0,1,0,0,1|2,0,0]=4 3196 B11R0.176 CCC[C@H](N)CCOCC(C)C 34a_100015193777_100000210624 [0,0,1,0,0,1|2,0,0]=4 3197 B11R0.176 CCC[C@H](N)COCCC(C)C 34a_100000732646_100000210312 [0,0,1,0,0,1|2,0,0]=4 3198 B11R0.176 CCNC(C)CCOCC(C)C 270004a_100015525214_200011216429 [0,0,1,0,0,1|2,0,0]=4 3199 B11R0.176 CN(C)CCCCN(C)CCO 269982a_100000210263_100000690147 [0,0,1,0,0,1|2,0,0]=4 3200 B11R0.176 COCC(C)NCCCC(C)C 2230a_200000737386_100000765312 [0,0,1,0,0,1|2,0,0]=4 3201 B11R0.176 COCC(C)NCCCC(C)C 270004a_200000737386_100000749346 [0,0,1,0,0,1|2,0,0]=4 3202 B11R0.176 COCC(C)NCCCC(C)C 34a_200000737386_100000765312 [0,0,1,0,0,1|2,0,0]=4 3203 B11R0.176 COCC(C)OCCCC(C)C 34a_100000210774_100000765312 [0,0,1,0,0,1|2,0,0]=4 3204 B11R0.176 COCC(C)OCCCC(C)C 7a_100000210774_100000765312 [0,0,1,0,0,1|2,0,0]=4 3205 B11R0.176 COCC(C)SCCCC(C)C 62a_100000765312_100011214892 [0,0,1,0,0,1|2,0,0]=4 3206 B11R0.176 COCC(C)SCCCC(C)C 62a_100011214892_100000765312 [0,0,1,0,0,1|2,0,0]=4 3207 B11R0.176 COC[C@@H](C)NCCCC(C)C 2230a_100000764878_100011214892 [0,0,1,0,0,1|2,0,0]=4 3208 B11R0.176 COC[C@@H](C)OCCCC(C)C 34a_100011934205_100011214892 [0,0,1,0,0,1|2,0,0]=4 3209 B11R0.176 CSCC(C)NCCCC(C)C 270004a_200000737386_100011216314 [0,0,1,0,0,1|2,0,0]=4 3210 B11R0.149 CC(C)CC(=O)C(C)CC(C)C 1458a_100000210554_100000731052 [0,0,1,0,0,1|0,0,2]=4 3211 B11R0.149 CC(C)CC(=O)[C@@H](O)CC(C)C 1458a_100012027011_100000210624 [0,0,1,0,0,1|1,0,1]=4 3212 B11R0.149 CC(C)CC(C)N(C)CC(C)C 2230a_100000745462_100000210760 [0,0,1,0,0,1|2,0,0]=4 3213 B11R0.149 CC(C)CC(C)N(C)CC(C)C 2230a_100000747067_100000731052 [0,0,1,0,0,1|2,0,0]=4 3214 B11R0.149 CC(C)CC(C)N(C)CC(C)C 269982a_100000745462_100000210624 [0,0,1,0,0,1|2,0,0]=4 3215 B11R0.149 CC(C)CC(C)N(C)CC(C)C 269982a_100000747067_100000731052 [0,0,1,0,0,1|2,0,0]=4 3216 B11R0.149 CC(C)CC(C)N(C)CC(C)C 270004a_100000745462_100000210432 [0,0,1,0,0,1|2,0,0]=4 3217 B11R0.149 CC(C)C[C@H](O)C(=O)NC(C)C 1626a_100138425928_100012027011 [0,0,1,0,0,1|1,0,1]=4 3218 B11R0.149 CC(C)C[C@H](O)C(=O)NC(C)C 240690a_100138425928_100012027011 [0,0,1,0,0,1|1,0,1]=4 3219 B11R0.173 CC(C)CCC(=O)C(C)C(C)C 1458a_100000755409_100000210312 [0,0,1,0,0,1|0,0,2]=4 3220 B11R0.173 CC(C)CCC(C)N(C)C(C)C 269982a_200000211004_100011261404 [0,0,1,0,0,1|2,0,0]=4 3221 B11R0.173 CC(C)CCC(C)N(C)C(C)C 270004a_200000211004_100000210476 [0,0,1,0,0,1|2,0,0]=4 3222 B11R0.173 CC(C)CCN(C)C(C)C(C)C 2230a_100000228512_100000210312 [0,0,1,0,0,1|2,0,0]=4 3223 B11R0.173 CC(C)CCN(C)C(C)C(C)C 269982a_100000228512_100000210312 [0,0,1,0,0,1|2,0,0]=4 3224 B11R0.173 CC(C)CNC(=O)C(C)C(C)C 11a_100000210953_100000755409 [0,0,1,0,0,1|0,0,2]=4 3225 B11R0.173 CC(C)CNC(=O)C(C)C(C)C 1626a_100000210953_100000755409 [0,0,1,0,0,1|0,0,2]=4 3226 B11R0.173 CC(C)CNC(=O)C(C)C(C)C 240690a_100000210953_100000755409 [0,0,1,0,0,1|0,0,2]=4 3227 B11R0.173 CC(C)CNC(=O)C(C)C(C)C 527a_100000210953_100000755409 [0,0,1,0,0,1|0,0,2]=4 3228 B11R0.173 CC(C)OCN(C)C(C)C(C)C 2230a_100000228512_100000709892 [0,0,1,0,0,1|2,0,0]=4 3229 B11R0.173 CC(C)OCN(C)C(C)C(C)C 269982a_100000228512_100000709892 [0,0,1,0,0,1|2,0,0]=4 3230 B11R0.160 CC(C)N(CCCO)C[C@@H](C)O 2230a_100000182298_100009817552 [0,0,1,0,0,1|2,0,0]=4 3231 B11R0.160 CC(C)N(CCCO)C[C@@H](C)O 269982a_100000182298_100009817552 [0,0,1,0,0,1|2,0,0]=4 3232 B11R0.160 CC(O)CN(CCCO)C(C)C 2230a_100000182298_100011218427 [0,0,1,0,0,1|2,0,0]=4 3233 B11R0.160 CC(O)CN(CCCO)C(C)C 269982a_100000182298_100011218427 [0,0,1,0,0,1|2,0,0]=4 3234 B11R0.160 CCCCN(CC(C)C)C(C)C 2230a_100000207398_100000210760 [0,0,1,0,0,1|2,0,0]=4 3235 B11R0.160 CCCCN(CC(C)C)C(C)C 2230a_100000737641_100000210211 [0,0,1,0,0,1|2,0,0]=4 3236 B11R0.160 CCCCN(CC(C)C)C(C)C 269982a_100000207398_100000210624 [0,0,1,0,0,1|2,0,0]=4 3237 B11R0.160 CCCCN(CC(C)C)C(C)C 269982a_100000737641_100000210211 [0,0,1,0,0,1|2,0,0]=4 3238 B11R0.160 CCCCN(CC(C)C)C(C)C 270004a_100000207398_100000210432 [0,0,1,0,0,1|2,0,0]=4 3239 B11R0.160 CCCCN(CC(C)O)C(C)C 2230a_100000207398_100011218427 [0,0,1,0,0,1|1,0,0]=3 3240 B11R0.160 CCCCN(CC(C)O)C(C)C 269982a_100000207398_100011218427 [0,0,1,0,0,1|1,0,0]=3 3241 B11R0.160 CCCCN(C[C@@H](C)O)C(C)C 2230a_100000207398_100009817552 [0,0,1,0,0,1|1,0,0]=3 3242 B11R0.160 CCCCN(C[C@@H](C)O)C(C)C 269982a_100000207398_100009817552 [0,0,1,0,0,1|1,0,0]=3 3243 B11R0.160 CCCOC(CC(C)C)C(C)C 34a_200011219802_100000210303 [0,0,1,0,0,1|2,0,0]=4 3244 B11R0.160 CCCOC(CC(C)C)C(C)C 7a_200011219802_100000210303 [0,0,1,0,0,1|2,0,0]=4 3245 B11R0.160 COCCN(CC(C)O)C(C)C 2230a_200000223778_100011218427 [0,0,1,0,0,1|2,0,0]=4 3246 B11R0.160 COCCN(CC(C)O)C(C)C 269982a_200000223778_100011218427 [0,0,1,0,0,1|2,0,0]=4 3247 B11R0.160 COCCN(C[C@@H](C)O)C(C)C 2230a_200000223778_100009817552 [0,0,1,0,0,1|2,0,0]=4 3248 B11R0.160 COCCN(C[C@@H](C)O)C(C)C 269982a_200000223778_100009817552 [0,0,1,0,0,1|2,0,0]=4 3249 B11R0.93 CCC(C)CC(=O)CCC(C)C 1458a_100000181311_100000748023 [0,0,1,0,0,1|0,0,2]=4 3250 B11R0.93 CCC(C)CC(=O)CCC(C)C 1458a_100000708755_100000210312 [0,0,1,0,0,1|0,0,2]=4 3251 B11R0.93 CCC(C)CC(=O)COC(C)C 1458a_100000745533_100000748023 [0,0,1,0,0,1|0,0,2]=4 3252 B11R0.93 CCC(C)CC(=O)CSC(C)C 1458a_100000241585_100000748023 [0,0,1,0,0,1|0,0,2]=4 3253 B11R0.93 CCC(C)CC(=O)NCC(C)C 11a_100000210953_100000708755 [0,0,1,0,0,1|0,0,2]=4 3254 B11R0.93 CCC(C)CC(=O)NCC(C)C 1626a_100000210953_100000708755 [0,0,1,0,0,1|0,0,2]=4 3255 B11R0.93 CCC(C)CC(=O)NCC(C)C 240690a_100000210953_100000708755 [0,0,1,0,0,1|0,0,2]=4 3256 B11R0.93 CCC(C)CC(=O)NCC(C)C 527a_100000210953_100000708755 [0,0,1,0,0,1|0,0,2]=4 3257 B11R0.93 CCC(C)CC(C)NCC(C)C 2230a_100000763565_100000210760 [0,0,1,0,0,1|1,0,0]=3 3258 B11R0.93 CCC(C)CC(C)NCC(C)C 270004a_100000210953_100011710205 [0,0,1,0,0,1|1,0,0]=3 3259 B11R0.93 CCC(C)CC(C)NCC(C)C 270004a_100000763565_100000210432 [0,0,1,0,0,1|1,0,0]=3 3260 B11R0.93 CCC(C)CC(C)NCC(C)O 2230a_100000763565_100011218427 [0,0,1,0,0,1|2,0,0]=4 3261 B11R0.93 CCC(C)CC(C)NCC(C)O 270004a_100000210904_100011710205 [0,0,1,0,0,1|2,0,0]=4 3262 B11R0.93 CCC(C)CC(C)NC[C@@H](C)O 2230a_100000763565_100009817552 [0,0,1,0,0,1|2,0,0]=4 3263 B11R0.93 CCC(C)CN(C)CCC(C)C 2230a_100000742789_100000748023 [0,0,1,0,0,1|2,0,0]=4 3264 B11R0.93 CCC(C)CN(C)CCC(C)C 2230a_100000753921_100000210312 [0,0,1,0,0,1|2,0,0]=4 3265 B11R0.93 CCC(C)CN(C)CCC(C)C 269982a_100000742789_100000748023 [0,0,1,0,0,1|2,0,0]=4 3266 B11R0.93 CCC(C)CN(C)CCC(C)C 269982a_100000753921_100000210312 [0,0,1,0,0,1|2,0,0]=4 3267 B11R0.93 CCC(C)CN(C)CCC(C)C 270004a_100000742789_100000243153 [0,0,1,0,0,1|2,0,0]=4 3268 B11R0.93 CCC(C)CN(C)COC(C)C 2230a_100000753921_100000709892 [0,0,1,0,0,1|2,0,0]=4 3269 B11R0.93 CCC(C)CN(C)COC(C)C 269982a_100000753921_100000709892 [0,0,1,0,0,1|2,0,0]=4 3270 B11R0.93 CCC(C)NC(C)CCC(C)C 2230a_100000209981_100011261404 [0,0,1,0,0,1|2,0,0]=4 3271 B11R0.93 CCC(C)NC(C)CCC(C)C 2230a_100138410893_100000758301 [0,0,1,0,0,1|2,0,0]=4 3272 B11R0.93 CCC(C)NC(C)CCC(C)C 270004a_100000209981_100000210476 [0,0,1,0,0,1|2,0,0]=4 3273 B11R0.93 CCC(C)OC(C)CCC(C)C 34a_100011215350_100011215416 [0,0,1,0,0,1|2,0,0]=4 3274 B11R0.93 CCC(C)OC(C)CCC(C)C 7a_100011215350_100000758301 [0,0,1,0,0,1|2,0,0]=4 3275 B11R0.93 CCC(C)SC(C)CCC(C)C 62a_100000758301_100011261404 [0,0,1,0,0,1|2,0,0]=4 3276 B11R0.93 CCC(C)SC(C)CCC(C)C 62a_100011261404_100000758301 [0,0,1,0,0,1|2,0,0]=4 3277 B11R0.93 CC[C@H](C)CC(=O)CCC(C)C 1458a_100000181311_100009816398 [0,0,1,0,0,1|0,0,2]=4 3278 B11R0.93 CC[C@H](C)CC(=O)COC(C)C 1458a_100000745533_100009816398 [0,0,1,0,0,1|0,0,2]=4 3279 B11R0.93 CC[C@H](C)CC(=O)CSC(C)C 1458a_100000241585_100009816398 [0,0,1,0,0,1|0,0,2]=4 3280 B11R0.93 CC[C@H](C)CN(C)CCC(C)C 2230a_100000742789_100009816398 [0,0,1,0,0,1|2,0,0]=4 3281 B11R0.93 CC[C@H](C)CN(C)CCC(C)C 269982a_100000742789_100009816398 [0,0,1,0,0,1|2,0,0]=4 3282 B11R0.107 CC(C)CC(C)NCC(C)CO 34a_100000744482_100000731052 [0,0,1,0,0,1|2,0,0]=4 3283 B11R0.107 CC(C)CC(C)NC[C@@H](C)CO 2230a_100000692259_100000059175 [0,0,1,0,0,1|2,0,0]=4 3284 B11R0.107 CC(C)CC(C)OCC(C)CN 34a_100000744482_100000731052 [0,0,1,0,0,1|2,0,0]=4 3285 B11R0.107 CC(C)CC(C)OC[C@@H](C)CO 34a_100000211805_100000059175 [0,0,1,0,0,1|2,0,0]=4 3286 B11R0.107 CC(C)CC(C)OC[C@@H](C)CO 7a_100000211805_100000059175 [0,0,1,0,0,1|2,0,0]=4 3287 B11R0.107 CC(C)CC(C)SC[C@@H](C)CO 62a_100000059175_100000731052 [0,0,1,0,0,1|2,0,0]=4 3288 B11R0.107 CC(C)CC(C)SC[C@@H](C)CO 62a_100000731052_100000059175 [0,0,1,0,0,1|2,0,0]=4 3289 B11R0.107 CC(C)C[C@H](N)COC(C)CO 34a_100011830311_100012180447 [0,0,1,0,0,1|2,0,0]=4 3290 B11R0.107 CCC(C)CCC(=O)CC(C)C 1458a_100000701222_100000210624 [0,0,1,0,0,1|0,0,2]=4 3291 B11R0.107 CCC(C)CCC(C)OC(C)C 7a_200011216552_100000210206 [0,0,1,0,0,1|2,0,0]=4 3292 B11R0.107 CCC(C)CNC(=O)CC(C)C 11a_100020588543_100000210554 [0,0,1,0,0,1|0,0,2]=4 3293 B11R0.107 CCC(C)CNC(=O)CC(C)C 1626a_100020588543_100000210554 [0,0,1,0,0,1|0,0,2]=4 3294 B11R0.107 CCC(C)CNC(=O)CC(C)C 240690a_100020588543_100000210554 [0,0,1,0,0,1|0,0,2]=4 3295 B11R0.107 CCC(C)CNC(=O)CC(C)C 527a_100020588543_100000210554 [0,0,1,0,0,1|0,0,2]=4 3296 B11R0.107 CCC(C)CNC(C)CC(C)C 2230a_100000692259_100000748023 [0,0,1,0,0,1|1,0,0]=3 3297 B11R0.107 CCC(C)CNC(C)CC(C)C 2230a_100020588543_100000731052 [0,0,1,0,0,1|1,0,0]=3 3298 B11R0.107 CCC(C)CNC(C)CC(C)C 270004a_100000692259_100000243153 [0,0,1,0,0,1|1,0,0]=3 3299 B11R0.107 CCC(C)COC(C)CC(C)C 34a_100000211805_100000748023 [0,0,1,0,0,1|1,0,0]=3 3300 B11R0.107 CCC(C)COC(C)CC(C)C 7a_100000211805_100000748023 [0,0,1,0,0,1|1,0,0]=3 3301 B11R0.107 CCC(C)CSC(C)CC(C)C 62a_100000731052_100000748023 [0,0,1,0,0,1|1,0,0]=3 3302 B11R0.107 CCC(C)CSC(C)CC(C)C 62a_100000748023_100000731052 [0,0,1,0,0,1|1,0,0]=3 3303 B11R0.107 CCC(C)CSC(C)CN(C)C 62a_100000748023_100020606517 [0,0,1,0,0,1|2,0,0]=4 3304 B11R0.107 CCC(C)CSC(C)CN(C)C 62a_100020606517_100000748023 [0,0,1,0,0,1|2,0,0]=4 3305 B11R0.107 CCC(C)NCC(C)CN(C)C 2230a_100000209981_100015348159 [0,0,1,0,0,1|2,0,0]=4 3306 B11R0.107 CCC(C)OCC(C)CN(C)C 7a_100000210228_100015348159 [0,0,1,0,0,1|2,0,0]=4 3307 B11R0.107 CCC(C)OC[C@@H](N)CC(C)C 34a_100011830311_100011215416 [0,0,1,0,0,1|1,0,0]=3 3308 B11R0.107 CCC(C)SCC(C)CN(C)C 62a_100000758301_100015348159 [0,0,1,0,0,1|2,0,0]=4 3309 B11R0.107 CCC(C)SCC(C)CN(C)C 62a_100015348159_100000758301 [0,0,1,0,0,1|2,0,0]=4 3310 B11R0.107 CCC(O)CNC(C)CC(C)C 2230a_100000692259_100011218378 [0,0,1,0,0,1|2,0,0]=4 3311 B11R0.107 CCC(O)CNC(C)CC(C)C 2230a_100011218483_100000731052 [0,0,1,0,0,1|2,0,0]=4 3312 B11R0.107 CCC(O)COC(C)CC(C)C 34a_100000211805_100011218378 [0,0,1,0,0,1|2,0,0]=4 3313 B11R0.107 CCC(O)COC(C)CC(C)C 7a_100000211805_100011218378 [0,0,1,0,0,1|2,0,0]=4 3314 B11R0.107 CCC(O)CSC(C)CC(C)C 62a_100000731052_100011218378 [0,0,1,0,0,1|2,0,0]=4 3315 B11R0.107 CCC(O)CSC(C)CC(C)C 62a_100011218378_100000731052 [0,0,1,0,0,1|2,0,0]=4 3316 B11R0.107 CC[C@H](C)CNC(C)CC(C)C 2230a_100000692259_100009816398 [0,0,1,0,0,1|1,0,0]=3 3317 B11R0.107 CC[C@H](C)COC(C)CC(C)C 34a_100000211805_100009816398 [0,0,1,0,0,1|1,0,0]=3 3318 B11R0.107 CC[C@H](C)COC(C)CC(C)C 7a_100000211805_100009816398 [0,0,1,0,0,1|1,0,0]=3 3319 B11R0.107 CC[C@H](C)COC(C)CC(C)C 7a_100009816381_100000731052 [0,0,1,0,0,1|1,0,0]=3 3320 B11R0.107 CC[C@H](C)CSC(C)CC(C)C 62a_100000731052_100009816398 [0,0,1,0,0,1|1,0,0]=3 3321 B11R0.107 CC[C@H](C)CSC(C)CC(C)C 62a_100009816398_100000731052 [0,0,1,0,0,1|1,0,0]=3 3322 B11R0.107 CC[C@H](C)CSC(C)CN(C)C 62a_100009816398_100020606517 [0,0,1,0,0,1|2,0,0]=4 3323 B11R0.107 CC[C@H](C)CSC(C)CN(C)C 62a_100020606517_100009816398 [0,0,1,0,0,1|2,0,0]=4 3324 B11R0.107 COC(C)COC(C)CC(C)C 34a_100000690652_100000731052 [0,0,1,0,0,1|2,0,0]=4 3325 B11R0.107 CO[C@H](C)CNC(C)CC(C)C 2230a_100020591295_100000731052 [0,0,1,0,0,1|2,0,0]=4 3326 B11R0.143 CC(C)CC(CN)COC(C)C 34a_200000723437_100000210206 [0,0,1,0,0,1|2,0,0]=4 3327 B11R0.143 CC(C)CC(CO)CNC(C)C 34a_200000723437_100000210206 [0,0,1,0,0,1|1,0,0]=3 3328 B11R0.143 CC(C)CN[C@H](CO)CC(C)C 2230a_100011830311_100000210760 [0,0,1,0,0,1|1,0,0]=3 3329 B11R0.143 CC(C)CN[C@H](CO)CC(C)C 270004a_100011830311_100000210432 [0,0,1,0,0,1|1,0,0]=3 3330 B11R0.143 CC(C)CN[C@H](CO)CC(C)C 34a_100011830311_100000210624 [0,0,1,0,0,1|1,0,0]=3 3331 B11R0.143 CC(C)C[C@@H](CO)NCC(C)O 2230a_100011830311_100011218427 [0,0,1,0,0,1|2,0,0]=4 3332 B11R0.143 CC(C)C[C@@H](CO)NCC(C)O 34a_100011830311_100011218427 [0,0,1,0,0,1|2,0,0]=4 3333 B11R0.143 CC(C)C[C@@H](CO)NC[C@@H](C)O 2230a_100011830311_100009817552 [0,0,1,0,0,1|2,0,0]=4 3334 B11R0.143 CC(C)C[C@@H](CO)NC[C@@H](C)O 34a_100011830311_100009817552 [0,0,1,0,0,1|2,0,0]=4 3335 B11R0.143 CCC(CCC(C)C)OC(C)C 34a_100011216567_100000210206 [0,0,1,0,0,1|1,0,0]=3 3336 B11R0.143 CCC(CCC(C)C)OC(C)C 7a_100011216567_100000210206 [0,0,1,0,0,1|1,0,0]=3 3337 B11R0.143 CCC(COC(C)C)CC(C)C 34a_100012186708_100000210206 [0,0,1,0,0,1|2,0,0]=4 3338 B11R0.143 CCC(COC(C)C)CC(C)C 7a_100012186708_100000210206 [0,0,1,0,0,1|2,0,0]=4 3339 B11R0.143 CCN(CCC(C)C)CC(C)C 2230a_100000207693_100000210760 [0,0,1,0,0,1|2,0,0]=4 3340 B11R0.143 CCN(CCC(C)C)CC(C)C 2230a_100000738554_100000210312 [0,0,1,0,0,1|2,0,0]=4 3341 B11R0.143 CCN(CCC(C)C)CC(C)C 269982a_100000207693_100000210624 [0,0,1,0,0,1|2,0,0]=4 3342 B11R0.143 CCN(CCC(C)C)CC(C)C 269982a_100000738554_100000210312 [0,0,1,0,0,1|2,0,0]=4 3343 B11R0.143 CCN(CCC(C)C)CC(C)C 270004a_100000207693_100000210432 [0,0,1,0,0,1|2,0,0]=4 3344 B11R0.273 C#CC(OCCC(C)C)C(C)C 34a_100011217124_100000210312 [0,0,1,0,0,1|1,0,1]=4 3345 B11R0.273 C#CC(OCCC(C)C)C(C)C 7a_100011217124_100000210626 [0,0,1,0,0,1|1,0,1]=4 3346 B11R0.273 C=C(C)CCN[C@@H](CO)C(C)C 2230a_100011830312_100000730704 [0,0,1,0,0,1|0,0,2]=4 3347 B11R0.273 C=C(C)CCN[C@@H](CO)C(C)C 34a_100011830312_100000730704 [0,0,1,0,0,1|0,0,2]=4 3348 B11R0.273 C=C(C)CNCC(CO)C(C)C 34a_100000692819_100000748629 [0,0,1,0,0,1|0,0,2]=4 3349 B11R0.273 C=CC(OCCC(C)C)C(C)C 34a_100000732651_100000210312 [0,0,1,0,0,1|1,0,1]=4 3350 B11R0.273 C=CC(OCCC(C)C)C(C)C 7a_100000732651_100000210626 [0,0,1,0,0,1|1,0,1]=4 3351 B11R0.273 CC(=CCN[C@@H](CO)C(C)C)C 2230a_100011830312_100000761012 [0,0,1,0,0,1|0,0,2]=4 3352 B11R0.273 CC(=CCN[C@@H](CO)C(C)C)C 34a_100011830312_100000761012 [0,0,1,0,0,1|0,0,2]=4 3353 B11R0.273 CC(C)C(CN)COC[C@@H](C)O 34a_100000692819_100009817552 [0,0,1,0,0,1|2,0,0]=4 3354 B11R0.273 CC(C)C(CO)CNCC(F)F 34a_100000692819_100011934356 [0,0,1,0,0,1|2,0,0]=4 3355 B11R0.273 CC(C)C(CO)CNC[C@@H](C)O 34a_100000692819_100009817552 [0,0,1,0,0,1|1,0,0]=3 3356 B11R0.273 CC(C)CCN[C@@H](CO)C(C)C 2230a_100011830312_100000210312 [0,0,1,0,0,1|0,0,0]=2 3357 B11R0.273 CC(C)CCN[C@@H](CO)C(C)C 269862a_100011830312_100000185833 [0,0,1,0,0,1|0,0,0]=2 3358 B11R0.273 CC(C)CCN[C@@H](CO)C(C)C 34a_100011830312_100000210312 [0,0,1,0,0,1|0,0,0]=2 3359 B11R0.273 CC(C)CCN[C@H](CO)[C@@H](C)O 2230a_100015196842_100000210312 [0,0,1,0,0,1|1,0,0]=3 3360 B11R0.273 CC(C)CCN[C@H](CO)[C@@H](C)O 269862a_100015196842_100000185833 [0,0,1,0,0,1|1,0,0]=3 3361 B11R0.273 CC(C)CCN[C@H](CO)[C@@H](C)O 34a_100015196842_100000210312 [0,0,1,0,0,1|1,0,0]=3 3362 B11R0.273 CC(C)CCOC(C#N)C(C)C 34a_100000748901_100000210312 [0,0,1,0,0,1|1,0,1]=4 3363 B11R0.273 CC(C)CCOC(C#N)C(C)C 7a_100000748901_100000210626 [0,0,1,0,0,1|1,0,1]=4 3364 B11R0.273 CC(C)CCOC(CN)C(C)C 34a_100000759067_100000210312 [0,0,1,0,0,1|1,0,0]=3 3365 B11R0.273 CC(C)CNCC(CO)C(C)C 270004a_100000692819_100000210432 [0,0,1,0,0,1|0,0,0]=2 3366 B11R0.273 CC(C)CNCC(CO)C(C)C 34a_100000692819_100000210624 [0,0,1,0,0,1|0,0,0]=2 3367 B11R0.273 CC(C)COCC(CN)C(C)C 34a_100000692819_100000210624 [0,0,1,0,0,1|1,0,0]=3 3368 B11R0.273 CC(C)OCN[C@@H](CO)C(C)C 2230a_100011830312_100000709892 [0,0,1,0,0,1|1,0,0]=3 3369 B11R0.273 CC(C)OCN[C@@H](CO)C(C)C 34a_100011830312_100000709892 [0,0,1,0,0,1|1,0,0]=3 3370 B11R0.273 CC(C)OCN[C@H](CO)[C@@H](C)O 2230a_100015196842_100000709892 [0,0,1,0,0,1|2,0,0]=4 3371 B11R0.273 CC(C)OCN[C@H](CO)[C@@H](C)O 34a_100015196842_100000709892 [0,0,1,0,0,1|2,0,0]=4 3372 B11R0.273 CC(C)OCOC(CN)C(C)C 34a_100000759067_100000709892 [0,0,1,0,0,1|2,0,0]=4 3373 B11R0.273 CC(O)CCN[C@@H](CO)C(C)C 2230a_100011830312_100012276601 [0,0,1,0,0,1|1,0,0]=3 3374 B11R0.273 CC(O)CCN[C@@H](CO)C(C)C 34a_100011830312_100012276601 [0,0,1,0,0,1|1,0,0]=3 3375 B11R0.273 CC(O)CCN[C@H](CO)[C@@H](C)O 2230a_100015196842_100012276601 [0,0,1,0,0,1|2,0,0]=4 3376 B11R0.273 CC(O)CCN[C@H](CO)[C@@H](C)O 34a_100015196842_100012276601 [0,0,1,0,0,1|2,0,0]=4 3377 B11R0.273 CC(O)CCOC(CN)C(C)C 34a_100000759067_100012276601 [0,0,1,0,0,1|2,0,0]=4 3378 B11R0.273 CC(O)CNCC(CO)C(C)C 34a_100000692819_100011218427 [0,0,1,0,0,1|1,0,0]=3 3379 B11R0.273 CC(O)COCC(CN)C(C)C 34a_100000692819_100011218427 [0,0,1,0,0,1|2,0,0]=4 3380 B11R0.273 CCC(CNCC(C)C)C(C)C 269862a_100000210953_100011214906 [0,0,1,0,0,1|1,0,0]=3 3381 B11R0.273 CCC(CNCC(C)C)N(C)C 270004a_100000738386_100000210432 [0,0,1,0,0,1|2,0,0]=4 3382 B11R0.273 CCC(CNCC(C)O)C(C)C 269862a_100000210904_100011214906 [0,0,1,0,0,1|2,0,0]=4 3383 B11R0.273 CCC(COCC(C)C)C(C)C 34a_100011995916_100000210624 [0,0,1,0,0,1|1,0,0]=3 3384 B11R0.273 CCC(COCC(C)C)C(C)C 7a_100011995916_100000210760 [0,0,1,0,0,1|1,0,0]=3 3385 B11R0.273 CCC(COCC(C)O)C(C)C 34a_100011995916_100011218427 [0,0,1,0,0,1|2,0,0]=4 3386 B11R0.273 CCC(COCC(C)O)C(C)C 7a_100011995916_100011218427 [0,0,1,0,0,1|2,0,0]=4 3387 B11R0.273 CCC(COC[C@@H](C)O)C(C)C 34a_100011995916_100009817552 [0,0,1,0,0,1|2,0,0]=4 3388 B11R0.273 CCC(COC[C@@H](C)O)C(C)C 7a_100011995916_100009817552 [0,0,1,0,0,1|2,0,0]=4 3389 B11R0.273 CCC(NCCC(C)C)C(C)C 269862a_100000745074_100000185833 [0,0,1,0,0,1|1,0,0]=3 3390 B11R0.273 CCC(NCCC(C)C)C(C)C 270004a_100000210545_100000210600 [0,0,1,0,0,1|1,0,0]=3 3391 B11R0.273 CCC(NCCC(C)O)C(C)C 270004a_200000755665_100000210600 [0,0,1,0,0,1|2,0,0]=4 3392 B11R0.273 CCC(NCCN(C)C)C(C)C 270004a_100000210585_100000210600 [0,0,1,0,0,1|2,0,0]=4 3393 B11R0.273 CCC(OCCC(C)C)C(C)C 34a_100011218073_100000210312 [0,0,1,0,0,1|1,0,0]=3 3394 B11R0.273 CCC(OCCC(C)C)C(C)C 7a_100011218073_100000210626 [0,0,1,0,0,1|1,0,0]=3 3395 B11R0.273 CCC(OCCC(C)O)C(C)C 34a_100011218073_100012276601 [0,0,1,0,0,1|2,0,0]=4 3396 B11R0.273 CCC(OCCC(C)O)C(C)C 7a_100011218073_100012276601 [0,0,1,0,0,1|2,0,0]=4 3397 B11R0.273 CCC(OCCN(C)C)C(C)C 7a_100011218073_100000755713 [0,0,1,0,0,1|2,0,0]=4 3398 B11R0.273 CCC(OCOC(C)C)C(C)C 34a_100011218073_100000709892 [0,0,1,0,0,1|2,0,0]=4 3399 B11R0.273 CCN(CCCC(C)C)C(C)C 2230a_100000223864_100011214892 [0,0,1,0,0,1|2,0,0]=4 3400 B11R0.273 CCN(CCCC(C)C)C(C)C 269982a_100000223864_100011214892 [0,0,1,0,0,1|2,0,0]=4 3401 B11R0.273 CCN(CCOC(C)C)C(C)C 2230a_100000223864_100000211751 [0,0,1,0,0,1|2,0,0]=4 3402 B11R0.273 CCN(CCOC(C)C)C(C)C 269982a_100000223864_100000211751 [0,0,1,0,0,1|2,0,0]=4 3403 B11R0.273 CCN(CCSC(C)C)C(C)C 2230a_100000223864_100000730970 [0,0,1,0,0,1|2,0,0]=4 3404 B11R0.273 CCN(CCSC(C)C)C(C)C 269982a_100000223864_100000730970 [0,0,1,0,0,1|2,0,0]=4 3405 B11R0.273 CC[C@H](NCCC(C)C)[C@@H](C)O 2230a_100161114882_100000210312 [0,0,1,0,0,1|2,0,0]=4 3406 B11R0.273 CC[C@H](NCCC(C)C)[C@@H](C)O 269862a_100161114882_100000185833 [0,0,1,0,0,1|2,0,0]=4 3407 B11R0.273 CC[C@H](NCCC(C)C)[C@@H](C)O 34a_100161114882_100000210312 [0,0,1,0,0,1|2,0,0]=4 3408 B11R0.55 CCC(NC(C)COC)C(C)C 270004a_100000745074_100000749346 [0,0,1,0,0,1|2,0,0]=4 3409 B11R0.55 CCC(NC(C)CSC)C(C)C 270004a_100000745074_100011216314 [0,0,1,0,0,1|2,0,0]=4 3410 B11R0.55 CCC(N[C@H](C)CCO)C(C)C 270004a_100000706166_100000210600 [0,0,1,0,0,1|2,0,0]=4 3411 B11R0.55 CCC(N[C@H](C)COC)C(C)C 270004a_100000764878_100000210600 [0,0,1,0,0,1|2,0,0]=4 3412 B11R0.55 CCC(OC(C)CCO)C(C)C 34a_100011218073_100009893172 [0,0,1,0,0,1|2,0,0]=4 3413 B11R0.55 CCC(OC(C)CCO)C(C)C 7a_100011218073_100009893172 [0,0,1,0,0,1|2,0,0]=4 3414 B11R0.55 CCC(OC(C)COC)C(C)C 34a_100011218073_100000765312 [0,0,1,0,0,1|2,0,0]=4 3415 B11R0.55 CCC(OC(C)COC)C(C)C 7a_100011218073_100000765312 [0,0,1,0,0,1|2,0,0]=4 3416 B11R0.55 CCCC(=O)NC(CC)C(C)C 11a_100000745074_100000211992 [0,0,1,0,0,1|0,0,2]=4 3417 B11R0.55 CCCC(=O)NC(CC)C(C)C 1626a_100000745074_100000211992 [0,0,1,0,0,1|0,0,2]=4 3418 B11R0.55 CCCC(=O)NC(CC)C(C)C 240690a_100000745074_100000211992 [0,0,1,0,0,1|0,0,2]=4 3419 B11R0.55 CCCC(=O)NC(CC)C(C)C 527a_100000745074_100000211992 [0,0,1,0,0,1|0,0,2]=4 3420 B11R0.55 CCCC(C)CN(CC)C(C)C 2230a_100000223864_100011216630 [0,0,1,0,0,1|2,0,0]=4 3421 B11R0.55 CCCC(C)CN(CC)C(C)C 269982a_100000223864_100011216630 [0,0,1,0,0,1|2,0,0]=4 3422 B11R0.55 CCCC(C)CN(CC)C(C)C 270004a_100000223864_100000243154 [0,0,1,0,0,1|2,0,0]=4 3423 B11R0.55 CCCC(C)NC(CC)C(C)C 270004a_100000741246_100000210600 [0,0,1,0,0,1|1,0,0]=3 3424 B11R0.55 CCCC(C)NC(CC)C(C)C 270004a_100000745074_100000211909 [0,0,1,0,0,1|1,0,0]=3 3425 B11R0.55 CCCC(C)N[C@@H](CC)[C@@H](C)O 2230a_100161114882_100000766640 [0,0,1,0,0,1|2,0,0]=4 3426 B11R0.55 CCCC(C)N[C@@H](CC)[C@@H](C)O 34a_100161114882_100000766640 [0,0,1,0,0,1|2,0,0]=4 3427 B11R0.55 CCCC(C)N[C@@H](CO)C(C)C 2230a_100011830312_100000766640 [0,0,1,0,0,1|2,0,0]=4 3428 B11R0.55 CCCC(C)N[C@@H](CO)C(C)C 270004a_100011830312_100000211909 [0,0,1,0,0,1|2,0,0]=4 3429 B11R0.55 CCCC(C)N[C@@H](CO)C(C)C 34a_100011830312_100000766640 [0,0,1,0,0,1|2,0,0]=4 3430 B11R0.55 CCCC(C)OC(CC)C(C)C 34a_100011218073_100000766640 [0,0,1,0,0,1|1,0,0]=3 3431 B11R0.55 CCCC(C)OC(CC)C(C)C 7a_100011218073_100000766640 [0,0,1,0,0,1|1,0,0]=3 3432 B11R0.55 CCCC(C)OC(CN)C(C)C 34a_100000759067_100000766640 [0,0,1,0,0,1|2,0,0]=4 3433 B11R0.56 CCCC(C)C(CC)OC(C)C 34a_200011218412_100000210206 [0,0,1,0,0,1|1,0,0]=3 3434 B11R0.56 CCCC(C)C(CC)OC(C)C 7a_200011218412_100000210206 [0,0,1,0,0,1|1,0,0]=3 3435 B11R0.56 CCCC(C)N(CC)CC(C)C 2230a_100000738554_100000766640 [0,0,1,0,0,1|2,0,0]=4 3436 B11R0.56 CCCC(C)N(CC)CC(C)C 269982a_100000738554_100000766640 [0,0,1,0,0,1|2,0,0]=4 3437 B11R0.56 CCCC(C)N(CC)CC(C)C 270004a_100000738554_100000211909 [0,0,1,0,0,1|2,0,0]=4 3438 B11R1.20 CC(=O)CC1CCC(CC1)C 1458a_100011215564_200000210301 [1,0,0,0,0,1|1,0,1]=4 3439 B11R1.20 CC(=O)N[C@H]1CC[C@@H](CC1)C 1626a_100020625639_100015343762 [1,0,0,0,0,1|1,0,1]=4 3440 B11R1.20 CC(=O)N[C@H]1CC[C@@H](CC1)C 240690a_100020625639_100015343762 [1,0,0,0,0,1|1,0,1]=4 3441 B11R1.20 CC(=O)N[C@H]1CC[C@@H](CC1)C 527a_100020625639_100103153847 [1,0,0,0,0,1|1,0,1]=4 3442 B11R1.20 CC(C)CN1CCC(CC1)C 2230a_100000188429_100000210760 [1,0,0,0,0,1|1,0,0]=3 3443 B11R1.20 CC(C)CN1CCC(CC1)C 269982a_100000188429_100000210624 [1,0,0,0,0,1|1,0,0]=3 3444 B11R1.20 CC(C)CN1CCC(CC1)C 270004a_100000188429_100000210432 [1,0,0,0,0,1|1,0,0]=3 3445 B11R1.20 CC(C)CN1CCC(CC1)C 34a_100000188429_100000210624 [1,0,0,0,0,1|1,0,0]=3 3446 B11R1.20 CC(C)CN1CCC(CC1)F 2230a_100015193889_100000210760 [1,0,0,0,0,1|2,0,0]=4 3447 B11R1.20 CC(C)CN1CCC(CC1)F 269982a_100015193889_100000210624 [1,0,0,0,0,1|2,0,0]=4 3448 B11R1.20 CC(C)CN1CCC(CC1)F 270004a_100015193889_100000210432 [1,0,0,0,0,1|2,0,0]=4 3449 B11R1.20 CC(C)CN1CCC(CC1)F 34a_100015193889_100000210624 [1,0,0,0,0,1|2,0,0]=4 3450 B11R1.20 CC(C)CN1CCC(CC1)O 2230a_100025773856_100000210760 [1,0,0,0,0,1|2,0,0]=4 3451 B11R1.20 CC(C)CN1CCC(CC1)O 269982a_100025773856_100000210624 [1,0,0,0,0,1|2,0,0]=4 3452 B11R1.20 CC(C)CN1CCC(CC1)O 270004a_100025773856_100000210432 [1,0,0,0,0,1|2,0,0]=4 3453 B11R1.20 CC(C)CN1CCN(CC1)C 2230a_100000188432_100000210760 [1,0,0,0,0,1|2,0,0]=4 3454 B11R1.20 CC(C)CN1CCN(CC1)C 2230a_100000203725_200000210301 [1,0,0,0,0,1|2,0,0]=4 3455 B11R1.20 CC(C)CN1CCN(CC1)C 269982a_100000188432_100000210624 [1,0,0,0,0,1|2,0,0]=4 3456 B11R1.20 CC(C)CN1CCN(CC1)C 269982a_100000203725_200000210301 [1,0,0,0,0,1|2,0,0]=4 3457 B11R1.20 CC(C)CN1CCN(CC1)C 270004a_100000188432_100000210432 [1,0,0,0,0,1|2,0,0]=4 3458 B11R1.20 CC(C)CN1CCN(CC1)[13CH3] 2230a_100000203725_200025704644 [1,0,0,0,0,1|2,0,0]=4 3459 B11R1.20 CC(C)CN1CCN(CC1)[13CH3] 269982a_100000203725_200025704644 [1,0,0,0,0,1|2,0,0]=4 3460 B11R1.20 CC(C)N[C@H]1CC[C@@H](CC1)C 2230a_100020625639_100000210206 [1,0,0,0,0,1|0,0,0]=2 3461 B11R1.20 CC(C)N[C@H]1CC[C@@H](CC1)C 34a_100020625639_100000210206 [1,0,0,0,0,1|0,0,0]=2 3462 B11R1.20 CC(C)OC1CCC(=O)CC1 34a_100000764474_100000210206 [1,0,0,0,0,1|1,0,1]=4 3463 B11R1.20 CC(C)OC1CCC(=O)CC1 7a_100000764474_100000210206 [1,0,0,0,0,1|1,0,1]=4 3464 B11R1.20 CC(C)OC1CCN(CC1)C 2230a_100011226139_200000210301 [1,0,0,0,0,1|1,0,0]=3 3465 B11R1.20 CC(C)OC1CCN(CC1)C 269982a_100011226139_200000210301 [1,0,0,0,0,1|1,0,0]=3 3466 B11R1.20 CC(C)OC1CCN(CC1)C 34a_100011226139_200000210301 [1,0,0,0,0,1|1,0,0]=3 3467 B11R1.20 CC(C)OC1CCN(CC1)[13CH3] 2230a_100011226139_200025704644 [1,0,0,0,0,1|1,0,0]=3 3468 B11R1.20 CC(C)OC1CCN(CC1)[13CH3] 269982a_100011226139_200025704644 [1,0,0,0,0,1|1,0,0]=3 3469 B11R1.20 CC(C)OC1CCN(CC1)[13CH3] 34a_100011226139_200025704644 [1,0,0,0,0,1|1,0,0]=3 3470 B11R1.20 CC(C)O[C@H]1CC[C@H](CC1)N 34a_100020628982_100000210206 [1,0,0,0,0,1|1,0,0]=3 3471 B11R1.20 CC(C)SC1CCN(CC1)C 62a_100000210206_100011215917 [1,0,0,0,0,1|1,0,0]=3 3472 B11R1.20 CC(O)CN1CCC(CC1)C 2230a_100000188429_100011218427 [1,0,0,0,0,1|2,0,0]=4 3473 B11R1.20 CC(O)CN1CCC(CC1)C 269982a_100000188429_100011218427 [1,0,0,0,0,1|2,0,0]=4 3474 B11R1.20 CC(O)CN1CCC(CC1)C 34a_100000188429_100011218427 [1,0,0,0,0,1|2,0,0]=4 3475 B11R1.20 CC1CCC(CC1)CC(=O)[13CH3] 1458a_100011215564_200025704644 [1,0,0,0,0,1|1,0,1]=4 3476 B11R1.20 CC1CCC(CC1)NC(C)C 34a_100138425928_200011216234 [1,0,0,0,0,1|0,0,0]=2 3477 B11R1.20 CC1CCC(CC1)OC(C)C 34a_100000210714_100000210206 [1,0,0,0,0,1|0,0,0]=2 3478 B11R1.20 CC1CCC(CC1)OC(C)C 34a_100000212225_200011216234 [1,0,0,0,0,1|0,0,0]=2 3479 B11R1.20 CC1CCC(CC1)OC(C)C 7a_100000210714_100000210206 [1,0,0,0,0,1|0,0,0]=2 3480 B11R1.20 CC1CCC(CC1)SC(C)C 62a_100000210206_200011216234 [1,0,0,0,0,1|0,0,0]=2 3481 B11R1.20 CC1CCN(CC1)C[C@@H](C)O 2230a_100000188429_100009817552 [1,0,0,0,0,1|2,0,0]=4 3482 B11R1.20 CC1CCN(CC1)C[C@@H](C)O 269982a_100000188429_100009817552 [1,0,0,0,0,1|2,0,0]=4 3483 B11R1.20 CC1CCN(CC1)C[C@@H](C)O 34a_100000188429_100009817552 [1,0,0,0,0,1|2,0,0]=4 3484 B11R1.20 CN(C)CC1CCN(CC1)C 2230a_100000741015_200000210301 [1,0,0,0,0,1|2,0,0]=4 3485 B11R1.20 CN(C)CC1CCN(CC1)C 2230a_100000751948_200000210301 [1,0,0,0,0,1|2,0,0]=4 3486 B11R1.20 CN(C)CC1CCN(CC1)C 269982a_100000741015_200000210301 [1,0,0,0,0,1|2,0,0]=4 3487 B11R1.20 CN(C)CC1CCN(CC1)C 269982a_100000751948_200000210301 [1,0,0,0,0,1|2,0,0]=4 3488 B11R1.20 CN(C)CC1CCN(CC1)C 269982a_100102631434_100015183002 [1,0,0,0,0,1|2,0,0]=4 3489 B11R1.20 CN(C)CC1CCN(CC1)[13CH3] 2230a_100000741015_200025704644 [1,0,0,0,0,1|2,0,0]=4 3490 B11R1.20 CN(C)CC1CCN(CC1)[13CH3] 269982a_100000741015_200025704644 [1,0,0,0,0,1|2,0,0]=4 3491 B11R1.20 CN([13CH3])CC1CCN(CC1)C 2230a_100000751948_200025704644 [1,0,0,0,0,1|2,0,0]=4 3492 B11R1.20 CN([13CH3])CC1CCN(CC1)C 269982a_100000751948_200025704644 [1,0,0,0,0,1|2,0,0]=4 3493 B11R1.86 CC(=O)N[C@@H]1CCCC[C@@H]1O 240690a_100015191688_100015343762 [1,0,0,0,0,1|1,0,1]=4 3494 B11R1.86 CC(=O)N[C@@H]1CCCC[C@@H]1O 527a_100015191688_100103153847 [1,0,0,0,0,1|1,0,1]=4 3495 B11R1.86 CC(C)CN1CCCCC1C 2230a_100000211376_100000210760 [1,0,0,0,0,1|2,0,0]=4 3496 B11R1.86 CC(C)CN1CCCCC1C 269982a_100000211376_100000210624 [1,0,0,0,0,1|2,0,0]=4 3497 B11R1.86 CC(C)CN1CCCCC1C 270004a_100000211376_100000210432 [1,0,0,0,0,1|2,0,0]=4 3498 B11R1.86 CC(C)CN1CCCCC1C 34a_100000211376_100000210624 [1,0,0,0,0,1|2,0,0]=4 3499 B11R1.86 CC(C)NC1CCCCC1=O 34a_100138425928_100000754470 [1,0,0,0,0,1|0,0,2]=4 3500 B11R1.86 CC(C)NC1CCCCC1C 2230a_100000211402_100000210206 [1,0,0,0,0,1|1,0,0]=3 3501 B11R1.86 CC(C)NC1CCCCC1C 34a_100000211402_100000210206 [1,0,0,0,0,1|1,0,0]=3 3502 B11R1.86 CC(C)NC1CCCCC1F 34a_100138425928_100015423560 [1,0,0,0,0,1|1,0,0]=3 3503 B11R1.86 CC(C)NC1CCCCC1O 34a_100138425928_100000038908 [1,0,0,0,0,1|0,0,0]=2 3504 B11R1.86 CC(C)N[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000210206 [1,0,0,0,0,1|1,0,0]=3 3505 B11R1.86 CC(C)N[C@@H]1CCCC[C@H]1F 34a_100015195156_100000210206 [1,0,0,0,0,1|1,0,0]=3 3506 B11R1.86 CC(C)N[C@@H]1CCOC[C@@H]1O 2230a_100016994285_100000210206 [1,0,0,0,0,1|1,0,0]=3 3507 B11R1.86 CC(C)N[C@H]1CCOC[C@@H]1F 2230a_100016994078_100000210206 [1,0,0,0,0,1|2,0,0]=4 3508 B11R1.86 CC(C)N[C@H]1CCOC[C@@H]1F 34a_100016994078_100000210206 [1,0,0,0,0,1|2,0,0]=4 3509 B11R1.86 CC(C)N[C@H]1COCC[C@@H]1O 2230a_100015739063_100000210206 [1,0,0,0,0,1|1,0,0]=3 3510 B11R1.86 CC(C)OC1CCCCC1=O 34a_100000212225_100000754470 [1,0,0,0,0,1|0,0,2]=4 3511 B11R1.86 CC(C)OC1CCCCC1=O 34a_100011214950_100000210206 [1,0,0,0,0,1|0,0,2]=4 3512 B11R1.86 CC(C)OC1CCCCC1C 34a_100000211207_100000210206 [1,0,0,0,0,1|1,0,0]=3 3513 B11R1.86 CC(C)OC1CCCCC1C 7a_100000211207_100000210206 [1,0,0,0,0,1|1,0,0]=3 3514 B11R1.86 CC(C)OC1CCCCC1Cl 34a_100000038908_100000210206 [1,0,0,0,0,1|1,0,0]=3 3515 B11R1.86 CC(C)OC1CCCCC1Cl 7a_100000038908_100000210206 [1,0,0,0,0,1|1,0,0]=3 3516 B11R1.86 CC(C)OC1CCCCC1F 34a_100000212225_100015423560 [1,0,0,0,0,1|1,0,0]=3 3517 B11R1.86 CC(C)OC1CCCCC1O 34a_100000212225_100000038908 [1,0,0,0,0,1|0,0,0]=2 3518 B11R1.86 CC(C)OC1CCNCC1C 34a_100011998114_100000210206 [1,0,0,0,0,1|2,0,0]=4 3519 B11R1.86 CC(C)OC1CNCCC1C 34a_100000696640_100000210206 [1,0,0,0,0,1|2,0,0]=4 3520 B11R1.86 CC(C)O[C@@H]1CCCC[C@H]1F 34a_100009816020_100000210206 [1,0,0,0,0,1|1,0,0]=3 3521 B11R1.86 CC(C)O[C@@H]1CCCC[C@H]1F 7a_100009816020_100000210206 [1,0,0,0,0,1|1,0,0]=3 3522 B11R1.86 CC(C)O[C@@H]1CCNC[C@@H]1F 34a_200016994291_100000210206 [1,0,0,0,0,1|2,0,0]=4 3523 B11R1.86 CC(C)O[C@H]1CCCC[C@H]1N 34a_100015191688_100000210206 [1,0,0,0,0,1|1,0,0]=3 3524 B11R1.86 CC(C)O[C@H]1CCOC[C@@H]1N 34a_100015739063_100000210206 [1,0,0,0,0,1|2,0,0]=4 3525 B11R1.86 CC(C)O[C@H]1COCC[C@H]1N 34a_100016994285_100000210206 [1,0,0,0,0,1|2,0,0]=4 3526 B11R1.86 CC(C)SC1CCCCC1=O 62a_100000204591_100000210206 [1,0,0,0,0,1|0,0,2]=4 3527 B11R1.86 CC(C)SC1CCCCC1=O 62a_100000210206_100000204591 [1,0,0,0,0,1|0,0,2]=4 3528 B11R1.86 CC(C)SC1CCCCC1F 62a_100000210206_100015423560 [1,0,0,0,0,1|1,0,0]=3 3529 B11R1.86 CC(C)SC1CCCCC1F 62a_100015423560_100000210206 [1,0,0,0,0,1|1,0,0]=3 3530 B11R1.86 CC(C)SC1CCCCC1O 62a_100000038908_100000210206 [1,0,0,0,0,1|0,0,0]=2 3531 B11R1.86 CC(C)SC1CCCCC1O 62a_100000210206_100000038908 [1,0,0,0,0,1|0,0,0]=2 3532 B11R1.497 CC(C)N1CCCCC(C1)O 2230a_100025706797_100000210206 [1,0,0,0,0,1|1,0,0]=3 3533 B11R1.497 CC(C)N1CCCCC(C1)O 269982a_100025706797_100000210206 [1,0,0,0,0,1|1,0,0]=3 3534 B11R1.497 CC(C)N1CCOC[C@@H](C1)O 2230a_100016073750_100000210206 [1,0,0,0,0,1|2,0,0]=4 3535 B11R1.497 CC(C)N1CCOC[C@@H](C1)O 269982a_100016073750_100000210206 [1,0,0,0,0,1|2,0,0]=4 3536 B11R1.74 CC1CC(CC(C1)N(C)C)C 270004a_100102631434_100000753413 [0,0,0,0,1,1|2,0,0]=4 3537 B11R1.74 CC1CC(CN(C1)C(C)C)C 2230a_100000210448_100000210206 [0,0,0,0,1,1|2,0,0]=4 3538 B11R1.74 CC1CC(CN(C1)C(C)C)C 269982a_100000210448_100000210206 [0,0,0,0,1,1|2,0,0]=4 3539 B11R1.74 CC1CC(CN(C1)C(C)C)C 34a_100000210448_100000210206 [0,0,0,0,1,1|2,0,0]=4 3540 B13R1.164 CC(C)COC1CCC(CC1C)C 34a_100011539931_100000210624 [0,0,0,0,0,2|1,0,0]=3 3541 B13R1.164 CC(C)COC1CCC(CC1C)C 7a_100011539931_100000210760 [0,0,0,0,0,2|1,0,0]=3 3542 B13R1.164 CC(O)COC1CCC(CC1C)C 34a_100011539931_100011218427 [0,0,0,0,0,2|2,0,0]=4 3543 B13R1.164 CC(O)COC1CCC(CC1C)C 7a_100011539931_100011218427 [0,0,0,0,0,2|2,0,0]=4 3544 B13R1.164 CC1CCC(C(C1)C)OC[C@@H](C)O 34a_100011539931_100009817552 [0,0,0,0,0,2|2,0,0]=4 3545 B13R1.164 CC1CCC(C(C1)C)OC[C@@H](C)O 7a_100011539931_100009817552 [0,0,0,0,0,2|2,0,0]=4