0 B9R1.138 CC1CCC(N1C)(C)C 2230a_100015204717_200000210301 [0,0,0,0,0,0|1,0,1]=2 1 B9R1.138 CC1CCC(N1C)(C)C 269982a_100015204717_200000210301 [0,0,0,0,0,0|1,0,1]=2 2 B9R1.138 CC1CCC(N1C)(C)C 34a_100015204717_200000210301 [0,0,0,0,0,0|1,0,1]=2 3 B9R1.138 CC1CCC(N1[13CH3])(C)C 2230a_100015204717_200025704644 [0,0,0,0,0,0|1,0,1]=2 4 B9R1.138 CC1CCC(N1[13CH3])(C)C 269982a_100015204717_200025704644 [0,0,0,0,0,0|1,0,1]=2 5 B9R1.138 CC1CCC(N1[13CH3])(C)C 34a_100015204717_200025704644 [0,0,0,0,0,0|1,0,1]=2 6 B9R1.138 CC1N(CCC1(C)C)C 2230a_100102837566_200000210301 [0,0,0,0,0,0|3,0,0]=3 7 B9R1.138 CC1N(CCC1(C)C)C 269982a_100102837566_200000210301 [0,0,0,0,0,0|3,0,0]=3 8 B9R1.138 CC1N(CCC1(C)C)C 34a_100102837566_200000210301 [0,0,0,0,0,0|3,0,0]=3 9 B9R1.138 CC1N(CCC1(C)C)[13CH3] 2230a_100102837566_200025704644 [0,0,0,0,0,0|3,0,0]=3 10 B9R1.138 CC1N(CCC1(C)C)[13CH3] 269982a_100102837566_200025704644 [0,0,0,0,0,0|3,0,0]=3 11 B9R1.138 CC1N(CCC1(C)C)[13CH3] 34a_100102837566_200025704644 [0,0,0,0,0,0|3,0,0]=3 12 B8R1.19 CC1(CCCN1[13CH3])C 2230a_100000761399_200025704644 [1,0,0,0,0,0|0,0,1]=2 13 B8R1.19 CC1(CCCN1[13CH3])C 269982a_100000761399_200025704644 [1,0,0,0,0,0|0,0,1]=2 14 B8R1.19 CC1(CCCN1[13CH3])C 34a_100000761399_200025704644 [1,0,0,0,0,0|0,0,1]=2 15 B8R1.19 CC1(COCN1[13CH3])C 2230a_100000043020_200025704644 [1,0,0,0,0,0|1,0,1]=3 16 B8R1.19 CC1(COCN1[13CH3])C 269982a_100000043020_200025704644 [1,0,0,0,0,0|1,0,1]=3 17 B8R1.19 CC1(SCCN1[13CH3])C 2230a_100011217261_200025704644 [1,0,0,0,0,0|1,0,1]=3 18 B8R1.19 CC1(SCCN1[13CH3])C 269982a_100011217261_200025704644 [1,0,0,0,0,0|1,0,1]=3 19 B8R1.19 CC1(SCCN1[13CH3])C 34a_100011217261_200025704644 [1,0,0,0,0,0|1,0,1]=3 20 B8R1.19 CN1CCCC1(C)C 2230a_100000761399_200000210301 [1,0,0,0,0,0|0,0,1]=2 21 B8R1.19 CN1CCCC1(C)C 269982a_100000761399_200000210301 [1,0,0,0,0,0|0,0,1]=2 22 B8R1.19 CN1CCCC1(C)C 34a_100000761399_200000210301 [1,0,0,0,0,0|0,0,1]=2 23 B8R1.19 CN1CCSC1(C)C 2230a_100011217261_200000210301 [1,0,0,0,0,0|1,0,1]=3 24 B8R1.19 CN1CCSC1(C)C 269982a_100011217261_200000210301 [1,0,0,0,0,0|1,0,1]=3 25 B8R1.19 CN1CCSC1(C)C 34a_100011217261_200000210301 [1,0,0,0,0,0|1,0,1]=3 26 B8R1.19 CN1COCC1(C)C 2230a_100000043020_200000210301 [1,0,0,0,0,0|1,0,1]=3 27 B8R1.19 CN1COCC1(C)C 269982a_100000043020_200000210301 [1,0,0,0,0,0|1,0,1]=3 28 B8R1.50 CC1CCC(N1C)C 2230a_100000687148_200000210301 [1,0,0,0,0,0|1,0,1]=3 29 B8R1.50 CC1CCC(N1C)C 269982a_100000687148_200000210301 [1,0,0,0,0,0|1,0,1]=3 30 B8R1.50 CC1CCC(N1C)C 34a_100000687148_200000210301 [1,0,0,0,0,0|1,0,1]=3 31 B8R1.50 CC1CCC(N1[13CH3])C 2230a_100000687148_200025704644 [1,0,0,0,0,0|1,0,1]=3 32 B8R1.50 CC1CCC(N1[13CH3])C 269982a_100000687148_200025704644 [1,0,0,0,0,0|1,0,1]=3 33 B8R1.50 CC1CCC(N1[13CH3])C 34a_100000687148_200025704644 [1,0,0,0,0,0|1,0,1]=3 34 B8R1.51 CC1(CCN(C1)[13CH3])C 2230a_100000764714_200025704644 [1,0,0,0,0,0|3,0,0]=4 35 B8R1.51 CC1(CCN(C1)[13CH3])C 269982a_100000764714_200025704644 [1,0,0,0,0,0|3,0,0]=4 36 B8R1.51 CN1CCC(C1)(C)C 2230a_100000764714_200000210301 [1,0,0,0,0,0|3,0,0]=4 37 B8R1.51 CN1CCC(C1)(C)C 269982a_100000764714_200000210301 [1,0,0,0,0,0|3,0,0]=4 38 B10R1.43 CC1(COC(=O)[C@@H]1O[13CH3])C 34a_100009815050_200025704644 [0,1,0,0,0,0|2,0,0]=3 39 B10R1.43 CC1(COC(=O)[C@@H]1O[13CH3])C 7a_100009815050_200025704644 [0,1,0,0,0,0|2,0,0]=3 40 B10R1.43 CC1CCC(N1CF)(C)C 269982a_100015204717_100015361967 [0,1,0,0,0,0|1,0,1]=3 41 B10R1.43 CC1CCC(N1CF)(C)C 34a_100015204717_100015361967 [0,1,0,0,0,0|1,0,1]=3 42 B10R1.43 CCN1C(CCC1(C)C)C 2230a_100015204717_100000210202 [0,1,0,0,0,0|1,0,1]=3 43 B10R1.43 CCN1C(CCC1(C)C)C 269982a_100015204717_100000204670 [0,1,0,0,0,0|1,0,1]=3 44 B10R1.43 CCN1C(CCC1(C)C)C 34a_100015204717_100000210202 [0,1,0,0,0,0|1,0,1]=3 45 B10R1.43 CO[C@H]1C(=O)OCC1(C)C 34a_100009815050_200000210301 [0,1,0,0,0,0|2,0,0]=3 46 B10R1.43 CO[C@H]1C(=O)OCC1(C)C 7a_100009815050_200000210301 [0,1,0,0,0,0|2,0,0]=3 47 B10R1.220 CC1N(CCC1(C)C)CF 269982a_100102837566_100015361967 [0,1,0,0,0,0|3,0,0]=4 48 B10R1.220 CC1N(CCC1(C)C)CF 34a_100102837566_100015361967 [0,1,0,0,0,0|3,0,0]=4 49 B10R1.220 CCN1CCC(C1C)(C)C 2230a_100102837566_100000210202 [0,1,0,0,0,0|3,0,0]=4 50 B10R1.220 CCN1CCC(C1C)(C)C 269982a_100102837566_100000204670 [0,1,0,0,0,0|3,0,0]=4 51 B10R1.220 CCN1CCC(C1C)(C)C 34a_100102837566_100000210202 [0,1,0,0,0,0|3,0,0]=4 52 B8R0.2 C=CC(=O)N(C)C(C)C 1626a_200000211004_100000185746 [0,0,1,0,0,0|0,0,2]=3 53 B8R0.2 C=CC(=O)N(C)C(C)C 240690a_200000211004_200121576911 [0,0,1,0,0,0|0,0,2]=3 54 B8R0.2 CC(C)C(C)C(=O)CF 1458a_100000755409_100015361967 [0,0,1,0,0,0|2,0,0]=3 55 B8R0.2 CC(C)N(C)C(=O)CO 240690a_200000211004_100000210174 [0,0,1,0,0,0|1,0,0]=2 56 B8R0.2 CC(C)N(C)C(=O)CO 527a_200000211004_100000210174 [0,0,1,0,0,0|1,0,0]=2 57 B8R0.2 CC(C)N(C)C(C)CO 2230a_100000693034_100000210206 [0,0,1,0,0,0|2,0,1]=4 58 B8R0.2 CC(C)N(C)C(C)CO 269982a_100000693034_100000210206 [0,0,1,0,0,0|2,0,1]=4 59 B8R0.2 CC(C)N(C)[C@H](C)CO 269982a_200000211004_100016084084 [0,0,1,0,0,0|2,0,1]=4 60 B8R0.2 CC(C)[C@@H](O)C(=O)CF 1458a_100000691806_100015361967 [0,0,1,0,0,0|3,0,0]=4 61 B8R0.2 CCC(=O)C(=O)N(C)C 1458a_100011218876_100000210202 [0,0,1,0,0,0|3,0,0]=4 62 B8R0.2 CCC(=O)C(C)C(=O)C 1458a_100000070787_100000742827 [0,0,1,0,0,0|2,0,1]=4 63 B8R0.2 CCC(=O)C(C)C(=O)C 1458a_100000210414_100000179758 [0,0,1,0,0,0|2,0,1]=4 64 B8R0.2 CCC(=O)C(C)C(C)C 1458a_100000755409_100000210202 [0,0,1,0,0,0|1,0,0]=2 65 B8R0.2 CCC(=O)C(C)N(C)C 2230a_100102631434_100000742827 [0,0,1,0,0,0|2,0,0]=3 66 B8R0.2 CCC(=O)C(C)N(C)C 269982a_100102631434_100000742827 [0,0,1,0,0,0|2,0,0]=3 67 B8R0.2 CCC(=O)N(C)C(C)C 11a_200000211004_100000210414 [0,0,1,0,0,0|0,0,0]=1 68 B8R0.2 CCC(=O)N(C)C(C)C 1626a_200000211004_100000210414 [0,0,1,0,0,0|0,0,0]=1 69 B8R0.2 CCC(=O)N(C)C(C)C 240690a_200000211004_100000210414 [0,0,1,0,0,0|0,0,0]=1 70 B8R0.2 CCC(=O)N(C)C(C)C 527a_200000211004_100000210414 [0,0,1,0,0,0|0,0,0]=1 71 B8R0.2 CCC(=O)[C@H](C)N(C)C 1458a_100009822176_100000210202 [0,0,1,0,0,0|2,0,0]=3 72 B8R0.2 CCC(=O)[C@H](O)C(C)C 1458a_100000691806_100000210202 [0,0,1,0,0,0|2,0,0]=3 73 B8R0.2 CCC(C)N(C)C(C)C 2230a_100000741768_100000210206 [0,0,1,0,0,0|1,0,1]=3 74 B8R0.2 CCC(C)N(C)C(C)C 269982a_100000741768_100000210206 [0,0,1,0,0,0|1,0,1]=3 75 B8R0.2 CCC(C)N(C)C(C)C 269982a_200000211004_100000758301 [0,0,1,0,0,0|1,0,1]=3 76 B8R0.2 CCN(C)C(C)C(C)C 2230a_100000228512_100000210202 [0,0,1,0,0,0|3,0,0]=4 77 B8R0.2 CCN(C)C(C)C(C)C 2230a_100000746363_200000210301 [0,0,1,0,0,0|3,0,0]=4 78 B8R0.2 CCN(C)C(C)C(C)C 269982a_100000228512_100000204670 [0,0,1,0,0,0|3,0,0]=4 79 B8R0.2 CCN(C)C(C)C(C)C 269982a_100000746363_200000210301 [0,0,1,0,0,0|3,0,0]=4 80 B8R0.2 CCN([13CH3])C(C)C(C)C 2230a_100000746363_200025704644 [0,0,1,0,0,0|3,0,0]=4 81 B8R0.2 CCN([13CH3])C(C)C(C)C 269982a_100000746363_200025704644 [0,0,1,0,0,0|3,0,0]=4 82 B8R0.2 CNC(=O)C(=O)C(C)C 1458a_100011218921_100000210206 [0,0,1,0,0,0|3,0,0]=4 83 B8R0.2 CNC(=O)C(C)C(C)C 11a_106832991635_100000755409 [0,0,1,0,0,0|2,0,0]=3 84 B8R0.2 CNC(=O)C(C)C(C)C 1626a_100102657272_100000755409 [0,0,1,0,0,0|2,0,0]=3 85 B8R0.2 CNC(=O)C(C)C(C)C 240690a_100102657272_100000755409 [0,0,1,0,0,0|2,0,0]=3 86 B8R0.2 CNC(=O)C(C)C(C)C 527a_100102657272_100000755409 [0,0,1,0,0,0|2,0,0]=3 87 B8R0.2 CNC(=O)C(C)N(C)C 2230a_100102631434_100000731044 [0,0,1,0,0,0|3,0,0]=4 88 B8R0.2 CNC(=O)C(C)N(C)C 269982a_100102631434_100000209862 [0,0,1,0,0,0|3,0,0]=4 89 B8R0.2 CNC(=O)N(C)C(C)C 2708a_100102657272_200000211004 [0,0,1,0,0,0|1,0,0]=2 90 B8R0.2 CNC(=O)N(C)C(C)C 273464a_100102657272_200000211004 [0,0,1,0,0,0|1,0,0]=2 91 B8R0.2 CNC(=O)[C@H](C)N(C)C 240690a_100102657272_100009822176 [0,0,1,0,0,0|3,0,0]=4 92 B8R0.2 CNC(=O)[C@H](C)N(C)C 527a_100102657272_100009822176 [0,0,1,0,0,0|3,0,0]=4 93 B8R0.2 CNC(=O)[C@H](O)C(C)C 240690a_100102657272_100000691806 [0,0,1,0,0,0|3,0,0]=4 94 B8R0.2 COC(=O)C(C)N(C)C 2230a_100000725243_200000210301 [0,0,1,0,0,0|3,0,0]=4 95 B8R0.2 COC(=O)C(C)N(C)C 2230a_100102631434_100000211248 [0,0,1,0,0,0|3,0,0]=4 96 B8R0.2 COC(=O)C(C)N(C)C 269982a_100000725243_200000210301 [0,0,1,0,0,0|3,0,0]=4 97 B8R0.2 COC(=O)C(C)N(C)C 269982a_100102631434_100000211248 [0,0,1,0,0,0|3,0,0]=4 98 B8R0.2 COC(=O)C(C)N(C)[13CH3] 2230a_100000725243_200025704644 [0,0,1,0,0,0|3,0,0]=4 99 B8R0.2 COC(=O)C(C)N(C)[13CH3] 269982a_100000725243_200025704644 [0,0,1,0,0,0|3,0,0]=4 100 B8R0.2 COC(C)N(C)C(C)C 269982a_200000211004_100009879195 [0,0,1,0,0,0|2,0,1]=4 101 B8R0.2 C[C@@H](C(=O)CF)N(C)C 1458a_100009822176_100015361967 [0,0,1,0,0,0|3,0,0]=4 102 B8R0.9 C#CC(=O)CCC(C)C 1458a_100000211873_100000210312 [0,0,1,0,0,0|1,0,1]=3 103 B8R0.9 C#CC(=O)CCC(C)O 1458a_100000211873_100012276601 [0,0,1,0,0,0|2,0,1]=4 104 B8R0.9 C=C(C)CCC(=O)CC 1458a_100000210414_100000730704 [0,0,1,0,0,0|1,0,2]=4 105 B8R0.9 C=C(C)CCC(=O)CC 1458a_200000688413_100000210202 [0,0,1,0,0,0|1,0,2]=4 106 B8R0.9 C=C(C)CCC(=O)NC 11a_106832991635_200000688413 [0,0,1,0,0,0|0,0,2]=3 107 B8R0.9 C=C(C)CCC(=O)NC 1626a_100102657272_200000688413 [0,0,1,0,0,0|0,0,2]=3 108 B8R0.9 C=C(C)CCC(=O)NC 240690a_100102657272_200000688413 [0,0,1,0,0,0|0,0,2]=3 109 B8R0.9 C=C(C)CCC(=O)NC 527a_100102657272_200000688413 [0,0,1,0,0,0|0,0,2]=3 110 B8R0.9 C=C(C)CNC(=O)NC 2708a_100000765925_106832991635 [0,0,1,0,0,0|1,0,2]=4 111 B8R0.9 C=C(C)CNC(=O)NC 2708a_100102657272_100000765925 [0,0,1,0,0,0|1,0,2]=4 112 B8R0.9 C=C(C)CNC(=O)NC 273464a_100000765925_100102657272 [0,0,1,0,0,0|1,0,2]=4 113 B8R0.9 C=C(C)CNC(=O)NC 273464a_100102657272_100000765925 [0,0,1,0,0,0|1,0,2]=4 114 B8R0.9 C=C(C)CNC(=O)NC 512a_100000765925_100102657272 [0,0,1,0,0,0|1,0,2]=4 115 B8R0.9 C=C(C)CNC(=O)NC 512a_106832991638_100000765925 [0,0,1,0,0,0|1,0,2]=4 116 B8R0.9 C=CC(=O)CCC(C)C 1458a_100000185746_100000210312 [0,0,1,0,0,0|1,0,1]=3 117 B8R0.9 C=CC(=O)CCC(C)O 1458a_100000185746_100012276601 [0,0,1,0,0,0|2,0,1]=4 118 B8R0.9 C=CC(=O)NCC(C)C 1626a_100000210953_100000185746 [0,0,1,0,0,0|2,0,1]=4 119 B8R0.9 C=CC(=O)NCC(C)C 240690a_100000210953_200121576911 [0,0,1,0,0,0|2,0,1]=4 120 B8R0.9 CC(C)CCC(=O)CF 1458a_100000181311_100015361967 [0,0,1,0,0,0|2,0,0]=3 121 B8R0.9 CC(C)CCC(=O)CO 1458a_100000210174_100000210312 [0,0,1,0,0,0|2,0,0]=3 122 B8R0.9 CC(C)CCC(C)N[13CH3] 2230a_100138410893_200025704644 [0,0,1,0,0,0|1,0,1]=3 123 B8R0.9 CC(C)CCC(C)O[13CH3] 34a_100011215350_200025704644 [0,0,1,0,0,0|2,0,1]=4 124 B8R0.9 CC(C)CCC(C)O[13CH3] 7a_100011215350_200025704644 [0,0,1,0,0,0|2,0,1]=4 125 B8R0.9 CC(C)CCC(C)S[13CH3] 62a_100011261404_200025704644 [0,0,1,0,0,0|2,0,1]=4 126 B8R0.9 CC(C)CCC(C)S[13CH3] 62a_200025704644_100011261404 [0,0,1,0,0,0|2,0,1]=4 127 B8R0.9 CC(C)CNC(=O)CO 240690a_100000210953_100000210174 [0,0,1,0,0,0|3,0,0]=4 128 B8R0.9 CC(C)CNC(=O)CO 527a_100000210953_100000210174 [0,0,1,0,0,0|3,0,0]=4 129 B8R0.9 CC(C)OCC(=O)CF 1458a_100000745533_100015361967 [0,0,1,0,0,0|3,0,0]=4 130 B8R0.9 CC(C)SCC(=O)CF 1458a_100000241585_100015361967 [0,0,1,0,0,0|3,0,0]=4 131 B8R0.9 CC(O)CCC(=O)CO 1458a_100000210174_100012276601 [0,0,1,0,0,0|3,0,0]=4 132 B8R0.9 CCC(=O)C=CC(C)C 1458a_100016268746_100000210202 [0,0,1,0,0,0|1,0,2]=4 133 B8R0.9 CCC(=O)CC=C(C)C 1458a_100000210414_100000761012 [0,0,1,0,0,0|1,0,2]=4 134 B8R0.9 CCC(=O)CC=C(C)C 1458a_100011220947_100000210202 [0,0,1,0,0,0|1,0,2]=4 135 B8R0.9 CCC(=O)CCC(C)C 1458a_100000181311_100000210202 [0,0,1,0,0,0|1,0,0]=2 136 B8R0.9 CCC(=O)CCC(C)C 1458a_100000210414_100000210312 [0,0,1,0,0,0|1,0,0]=2 137 B8R0.9 CCC(=O)CCC(C)O 1458a_100000210414_100012276601 [0,0,1,0,0,0|2,0,0]=3 138 B8R0.9 CCC(=O)CC[S+](C)C 1458a_100009452791_100000210202 [0,0,1,0,0,0|2,0,0]=3 139 B8R0.9 CCC(=O)COC(C)C 1458a_100000745533_100000210202 [0,0,1,0,0,0|2,0,0]=3 140 B8R0.9 CCC(=O)COC(C)C 34a_100000725409_100000210206 [0,0,1,0,0,0|2,0,0]=3 141 B8R0.9 CCC(=O)CSC(C)C 1458a_100000241585_100000210202 [0,0,1,0,0,0|2,0,0]=3 142 B8R0.9 CCC(=O)CSC(C)C 62a_100000210206_100000747405 [0,0,1,0,0,0|2,0,0]=3 143 B8R0.9 CCC(=O)CSC(C)C 62a_100000747405_100000210206 [0,0,1,0,0,0|2,0,0]=3 144 B8R0.9 CCC(=O)NCC(C)C 11a_100000210953_100000210414 [0,0,1,0,0,0|2,0,0]=3 145 B8R0.9 CCC(=O)NCC(C)C 1626a_100000210953_100000210414 [0,0,1,0,0,0|2,0,0]=3 146 B8R0.9 CCC(=O)NCC(C)C 240690a_100000210953_100000210414 [0,0,1,0,0,0|2,0,0]=3 147 B8R0.9 CCC(=O)NCC(C)C 527a_100000210953_100000210414 [0,0,1,0,0,0|2,0,0]=3 148 B8R0.9 CCC(=O)NCC(C)O 11a_100000210904_100000210414 [0,0,1,0,0,0|3,0,0]=4 149 B8R0.9 CCC(=O)NCC(C)O 240690a_100000210904_100000210414 [0,0,1,0,0,0|3,0,0]=4 150 B8R0.9 CCC(=O)NCC(C)O 527a_100000210904_100000210414 [0,0,1,0,0,0|3,0,0]=4 151 B8R0.9 CCC(=O)NNC(C)C 22a_100000741168_100000210414 [0,0,1,0,0,0|3,0,0]=4 152 B8R0.9 CCN(C)CCC(C)C 2230a_100000207693_200000210301 [0,0,1,0,0,0|3,0,0]=4 153 B8R0.9 CCN(C)CCC(C)C 2230a_100000225621_100000210312 [0,0,1,0,0,0|3,0,0]=4 154 B8R0.9 CCN(C)CCC(C)C 2230a_100000742789_100000210202 [0,0,1,0,0,0|3,0,0]=4 155 B8R0.9 CCN(C)CCC(C)C 269982a_100000207693_200000210301 [0,0,1,0,0,0|3,0,0]=4 156 B8R0.9 CCN(C)CCC(C)C 269982a_100000225621_100000210312 [0,0,1,0,0,0|3,0,0]=4 157 B8R0.9 CCN(C)CCC(C)C 269982a_100000742789_100000204670 [0,0,1,0,0,0|3,0,0]=4 158 B8R0.9 CCN([13CH3])CCC(C)C 2230a_100000207693_200025704644 [0,0,1,0,0,0|3,0,0]=4 159 B8R0.9 CCN([13CH3])CCC(C)C 269982a_100000207693_200025704644 [0,0,1,0,0,0|3,0,0]=4 160 B8R0.9 CNC(=O)C=CC(C)C 11a_106832991635_100016268746 [0,0,1,0,0,0|0,0,2]=3 161 B8R0.9 CNC(=O)C=CC(C)C 1626a_100102657272_100016268746 [0,0,1,0,0,0|0,0,2]=3 162 B8R0.9 CNC(=O)C=CC(C)C 240690a_100102657272_100016268746 [0,0,1,0,0,0|0,0,2]=3 163 B8R0.9 CNC(=O)CC=C(C)C 11a_106832991635_100011220947 [0,0,1,0,0,0|0,0,2]=3 164 B8R0.9 CNC(=O)CC=C(C)C 1626a_100102657272_100011220947 [0,0,1,0,0,0|0,0,2]=3 165 B8R0.9 CNC(=O)CC=C(C)C 240690a_100102657272_100011220947 [0,0,1,0,0,0|0,0,2]=3 166 B8R0.9 CNC(=O)CC=C(C)C 527a_100102657272_100011220947 [0,0,1,0,0,0|0,0,2]=3 167 B8R0.9 CNC(=O)CCC(=O)C 1458a_100011309844_200000210301 [0,0,1,0,0,0|1,0,1]=3 168 B8R0.9 CNC(=O)CCC(=O)N 240690a_100102657272_100011215257 [0,0,1,0,0,0|2,0,1]=4 169 B8R0.9 CNC(=O)CCC(=O)N 527a_100102657272_100011215257 [0,0,1,0,0,0|2,0,1]=4 170 B8R0.9 CNC(=O)CCC(=O)[13CH3] 1458a_100011309844_200025704644 [0,0,1,0,0,0|1,0,1]=3 171 B8R0.9 CNC(=O)CCC(C)C 11a_106832991635_100000181311 [0,0,1,0,0,0|0,0,0]=1 172 B8R0.9 CNC(=O)CCC(C)C 1626a_100102657272_100000181311 [0,0,1,0,0,0|0,0,0]=1 173 B8R0.9 CNC(=O)CCC(C)C 240690a_100102657272_100000181311 [0,0,1,0,0,0|0,0,0]=1 174 B8R0.9 CNC(=O)CCC(C)C 527a_100102657272_100000181311 [0,0,1,0,0,0|0,0,0]=1 175 B8R0.9 CNC(=O)CCC(C)O 1626a_100102657272_100000718519 [0,0,1,0,0,0|1,0,0]=2 176 B8R0.9 CNC(=O)CCN(C)C 11a_106832991635_100000689311 [0,0,1,0,0,0|1,0,0]=2 177 B8R0.9 CNC(=O)CCN(C)C 2230a_100000750875_200000210301 [0,0,1,0,0,0|1,0,0]=2 178 B8R0.9 CNC(=O)CCN(C)C 2230a_100102631434_100000737683 [0,0,1,0,0,0|1,0,0]=2 179 B8R0.9 CNC(=O)CCN(C)C 240690a_100102657272_100000689311 [0,0,1,0,0,0|1,0,0]=2 180 B8R0.9 CNC(=O)CCN(C)C 269982a_100000750875_200000210301 [0,0,1,0,0,0|1,0,0]=2 181 B8R0.9 CNC(=O)CCN(C)C 269982a_100102631434_100000737683 [0,0,1,0,0,0|1,0,0]=2 182 B8R0.9 CNC(=O)CCN(C)C 527a_100102657272_100000689311 [0,0,1,0,0,0|1,0,0]=2 183 B8R0.9 CNC(=O)CCN(C)[13CH3] 2230a_100000750875_200025704644 [0,0,1,0,0,0|1,0,0]=2 184 B8R0.9 CNC(=O)CCN(C)[13CH3] 269982a_100000750875_200025704644 [0,0,1,0,0,0|1,0,0]=2 185 B8R0.9 CNC(=O)CC[N+](=O)[O-] 11a_106832991635_200000064761 [0,0,1,0,0,0|3,0,0]=4 186 B8R0.9 CNC(=O)CC[N+](=O)[O-] 1626a_100102657272_200000064761 [0,0,1,0,0,0|3,0,0]=4 187 B8R0.9 CNC(=O)CC[N+](=O)[O-] 240690a_100102657272_200000064761 [0,0,1,0,0,0|3,0,0]=4 188 B8R0.9 CNC(=O)CC[S+](C)C 11a_106832991635_100009452791 [0,0,1,0,0,0|1,0,0]=2 189 B8R0.9 CNC(=O)CC[S+](C)C 1626a_100102657272_100009452791 [0,0,1,0,0,0|1,0,0]=2 190 B8R0.9 CNC(=O)CC[S+](C)C 240690a_100102657272_100009452791 [0,0,1,0,0,0|1,0,0]=2 191 B8R0.9 CNC(=O)CNC(=O)C 11a_100000693194_100015343762 [0,0,1,0,0,0|2,0,1]=4 192 B8R0.9 CNC(=O)CNC(=O)C 11a_106832991635_100000194580 [0,0,1,0,0,0|2,0,1]=4 193 B8R0.9 CNC(=O)CNC(=O)C 1626a_100102657272_100000194580 [0,0,1,0,0,0|2,0,1]=4 194 B8R0.9 CNC(=O)CNC(=O)C 240690a_100000693194_100015343762 [0,0,1,0,0,0|2,0,1]=4 195 B8R0.9 CNC(=O)CNC(=O)C 240690a_100102657272_100000194580 [0,0,1,0,0,0|2,0,1]=4 196 B8R0.9 CNC(=O)CNC(=O)C 527a_100000693194_100103153847 [0,0,1,0,0,0|2,0,1]=4 197 B8R0.9 CNC(=O)CNC(=O)C 527a_100102657272_100000194580 [0,0,1,0,0,0|2,0,1]=4 198 B8R0.9 CNC(=O)CNC(C)C 2230a_100000693194_100000210206 [0,0,1,0,0,0|1,0,0]=2 199 B8R0.9 CNC(=O)CNC(C)C 2230a_100138425928_100000183359 [0,0,1,0,0,0|1,0,0]=2 200 B8R0.9 CNC(=O)CNC(C)C 34a_100138425928_100000183359 [0,0,1,0,0,0|1,0,0]=2 201 B8R0.9 CNC(=O)COC(=O)C 1626a_100102657272_100000183556 [0,0,1,0,0,0|2,0,1]=4 202 B8R0.9 CNC(=O)COC(=O)C 240690a_100102657272_100000183556 [0,0,1,0,0,0|2,0,1]=4 203 B8R0.9 CNC(=O)COC(=O)C 527a_100102657272_100000183556 [0,0,1,0,0,0|2,0,1]=4 204 B8R0.9 CNC(=O)COC(C)C 11a_106832991635_100000745533 [0,0,1,0,0,0|1,0,0]=2 205 B8R0.9 CNC(=O)COC(C)C 1626a_100102657272_100000745533 [0,0,1,0,0,0|1,0,0]=2 206 B8R0.9 CNC(=O)COC(C)C 240690a_100102657272_100000745533 [0,0,1,0,0,0|1,0,0]=2 207 B8R0.9 CNC(=O)COC(C)C 34a_100000212225_100000183359 [0,0,1,0,0,0|1,0,0]=2 208 B8R0.9 CNC(=O)COC(C)C 34a_100000750040_100000210206 [0,0,1,0,0,0|1,0,0]=2 209 B8R0.9 CNC(=O)COC(C)C 527a_100102657272_100000745533 [0,0,1,0,0,0|1,0,0]=2 210 B8R0.9 CNC(=O)COC(F)F 11a_106832991635_200000719455 [0,0,1,0,0,0|3,0,0]=4 211 B8R0.9 CNC(=O)COC(F)F 1626a_100102657272_200000719455 [0,0,1,0,0,0|3,0,0]=4 212 B8R0.9 CNC(=O)COC(F)F 240690a_100102657272_200000719455 [0,0,1,0,0,0|3,0,0]=4 213 B8R0.9 CNC(=O)COC(F)F 527a_100102657272_200000719455 [0,0,1,0,0,0|3,0,0]=4 214 B8R0.9 CNC(=O)CSC(=O)C 11a_106832991635_100000049016 [0,0,1,0,0,0|2,0,1]=4 215 B8R0.9 CNC(=O)CSC(=O)C 1626a_100102657272_100000049016 [0,0,1,0,0,0|2,0,1]=4 216 B8R0.9 CNC(=O)CSC(=O)C 240690a_100102657272_100000049016 [0,0,1,0,0,0|2,0,1]=4 217 B8R0.9 CNC(=O)CSC(C)C 11a_106832991635_100000241585 [0,0,1,0,0,0|1,0,0]=2 218 B8R0.9 CNC(=O)CSC(C)C 1626a_100102657272_100000241585 [0,0,1,0,0,0|1,0,0]=2 219 B8R0.9 CNC(=O)CSC(C)C 240690a_100102657272_100000241585 [0,0,1,0,0,0|1,0,0]=2 220 B8R0.9 CNC(=O)CSC(C)C 527a_100102657272_100000241585 [0,0,1,0,0,0|1,0,0]=2 221 B8R0.9 CNC(=O)CSC(C)C 62a_100000183359_100000210206 [0,0,1,0,0,0|1,0,0]=2 222 B8R0.9 CNC(=O)CSC(C)C 62a_100000210206_100000183359 [0,0,1,0,0,0|1,0,0]=2 223 B8R0.9 CNC(=O)CSC(F)F 11a_106832991635_114828291038 [0,0,1,0,0,0|3,0,0]=4 224 B8R0.9 CNC(=O)CSC(F)F 1626a_100102657272_114828291038 [0,0,1,0,0,0|3,0,0]=4 225 B8R0.9 CNC(=O)CSC(F)F 240690a_100102657272_114828291038 [0,0,1,0,0,0|3,0,0]=4 226 B8R0.9 CNC(=O)CSC(F)F 527a_100102657272_114828291038 [0,0,1,0,0,0|3,0,0]=4 227 B8R0.9 CNC(=O)NCC(C)C 2708a_100000210953_106832991635 [0,0,1,0,0,0|1,0,0]=2 228 B8R0.9 CNC(=O)NCC(C)C 2708a_100102657272_100000210953 [0,0,1,0,0,0|1,0,0]=2 229 B8R0.9 CNC(=O)NCC(C)C 273464a_100000210953_100102657272 [0,0,1,0,0,0|1,0,0]=2 230 B8R0.9 CNC(=O)NCC(C)C 273464a_100102657272_100000210953 [0,0,1,0,0,0|1,0,0]=2 231 B8R0.9 CNC(=O)NCC(C)C 512a_100000210953_100102657272 [0,0,1,0,0,0|1,0,0]=2 232 B8R0.9 CNC(=O)NCC(C)C 512a_106832991638_100000210953 [0,0,1,0,0,0|1,0,0]=2 233 B8R0.9 CNC(=O)NCC(C)O 2708a_100102657272_100000210904 [0,0,1,0,0,0|2,0,0]=3 234 B8R0.9 CNC(=O)NCC(C)O 273464a_100000210904_100102657272 [0,0,1,0,0,0|2,0,0]=3 235 B8R0.9 CNC(=O)NCC(C)O 273464a_100102657272_100000210904 [0,0,1,0,0,0|2,0,0]=3 236 B8R0.9 CNC(=O)NCC(C)O 512a_100000210904_100102657272 [0,0,1,0,0,0|2,0,0]=3 237 B8R0.9 CNC(=O)NCC(C)O 512a_106832991638_100000210904 [0,0,1,0,0,0|2,0,0]=3 238 B8R0.9 CNC(=O)NCC(F)F 2708a_100102657272_100000765723 [0,0,1,0,0,0|3,0,0]=4 239 B8R0.9 CNC(=O)NCC(F)F 273464a_100000765723_100102657272 [0,0,1,0,0,0|3,0,0]=4 240 B8R0.9 CNC(=O)NCC(F)F 273464a_100102657272_100000765723 [0,0,1,0,0,0|3,0,0]=4 241 B8R0.9 CNC(=O)NCC(F)F 512a_100000765723_100102657272 [0,0,1,0,0,0|3,0,0]=4 242 B8R0.9 CNC(=O)NCC(F)F 512a_106832991638_100000765723 [0,0,1,0,0,0|3,0,0]=4 243 B8R0.9 CNC(=O)NNC(C)C 273464a_100102657272_100000741168 [0,0,1,0,0,0|2,0,0]=3 244 B8R0.9 CNC(=O)NNC(C)C 512a_100000741168_100102657272 [0,0,1,0,0,0|2,0,0]=3 245 B8R0.9 CNC(=O)NNC(C)C 512a_106832991638_100000741168 [0,0,1,0,0,0|2,0,0]=3 246 B8R0.9 CNC(C)CCC(C)C 2230a_100138410893_200000210301 [0,0,1,0,0,0|1,0,1]=3 247 B8R0.9 CNC(C)CCC(C)C 2230a_106832991635_100011261404 [0,0,1,0,0,0|1,0,1]=3 248 B8R0.9 CNC(C)CCC(C)C 270004a_106832991635_100000210476 [0,0,1,0,0,0|1,0,1]=3 249 B8R0.9 CNC(C)CCC(C)C 34a_100102657272_100011261404 [0,0,1,0,0,0|1,0,1]=3 250 B8R0.9 COC(=O)CCC(=O)C 1458a_100000187943_200000210301 [0,0,1,0,0,0|2,0,1]=4 251 B8R0.9 COC(=O)CCC(=O)[13CH3] 1458a_100000187943_200025704644 [0,0,1,0,0,0|2,0,1]=4 252 B8R0.9 COC(=O)CCN(C)C 2230a_100102631434_100000204255 [0,0,1,0,0,0|2,0,0]=3 253 B8R0.9 COC(=O)CCN(C)C 269982a_100025711912_200000210301 [0,0,1,0,0,0|2,0,0]=3 254 B8R0.9 COC(=O)CCN(C)C 269982a_100102631434_100000204255 [0,0,1,0,0,0|2,0,0]=3 255 B8R0.9 COC(=O)CCN(C)[13CH3] 269982a_100025711912_200025704644 [0,0,1,0,0,0|2,0,0]=3 256 B8R0.9 COC(=O)CNC(C)C 2230a_100138425928_100000747449 [0,0,1,0,0,0|2,0,0]=3 257 B8R0.9 COC(=O)CNC(C)C 34a_100138425928_100000747449 [0,0,1,0,0,0|2,0,0]=3 258 B8R0.9 COC(=O)COC(C)C 34a_100000212225_100000747449 [0,0,1,0,0,0|2,0,0]=3 259 B8R0.9 COC(=O)CSC(C)C 62a_100000210206_100000747449 [0,0,1,0,0,0|2,0,0]=3 260 B8R0.9 COC(=O)CSC(C)C 62a_100000747449_100000210206 [0,0,1,0,0,0|2,0,0]=3 261 B8R0.9 COC(C)CCC(C)C 34a_100011215350_200000210301 [0,0,1,0,0,0|2,0,1]=4 262 B8R0.9 COC(C)CCC(C)C 34a_100138415774_100011261404 [0,0,1,0,0,0|2,0,1]=4 263 B8R0.9 COC(C)CCC(C)C 7a_100011215350_200000210301 [0,0,1,0,0,0|2,0,1]=4 264 B8R0.9 CSC(C)CCC(C)C 62a_100011261404_200000210301 [0,0,1,0,0,0|2,0,1]=4 265 B8R0.9 CSC(C)CCC(C)C 62a_200000210301_100011261404 [0,0,1,0,0,0|2,0,1]=4 266 B8R0.9 C[S+](C)CCC(=O)CF 1458a_100009452791_100015361967 [0,0,1,0,0,0|3,0,0]=4 267 B8R0.13 CCC(C)(C)N(C)CF 269982a_200000755171_100015361967 [0,0,1,0,0,0|1,0,1]=3 268 B8R0.13 CCN(C)C(C)(C)CC 2230a_200000755171_100000210202 [0,0,1,0,0,0|1,0,1]=3 269 B8R0.13 CCN(C)C(C)(C)CC 269982a_100000225621_100000032637 [0,0,1,0,0,0|1,0,1]=3 270 B8R0.13 CCN(C)C(C)(C)CC 269982a_200000755171_100000204670 [0,0,1,0,0,0|1,0,1]=3 271 B8R0.13 CCN(C)C(C)(C)CO 269982a_100000747347_200000210301 [0,0,1,0,0,0|2,0,1]=4 272 B8R0.13 CCN(C)C(C)(C)CO 269982a_100015204102_100000204670 [0,0,1,0,0,0|2,0,1]=4 273 B8R0.13 CCN([13CH3])C(C)(C)CO 269982a_100000747347_200025704644 [0,0,1,0,0,0|2,0,1]=4 274 B8R0.13 CN(CF)C(C)(C)CO 269982a_100015204102_100015361967 [0,0,1,0,0,0|2,0,1]=4 275 B8R0.25 C#CC(C)(C)NCC=O 34a_100000054563_200009817547 [0,0,1,0,0,0|2,0,1]=4 276 B8R0.25 C#CC(C)(C)OCC=O 34a_100000189450_200009817547 [0,0,1,0,0,0|2,0,1]=4 277 B8R0.25 C#CC(C)(C)OCC=O 7a_100000189450_200015260668 [0,0,1,0,0,0|2,0,1]=4 278 B8R0.25 C#CC(C)(C)SCC=O 62a_100000038118_200015260668 [0,0,1,0,0,0|2,0,1]=4 279 B8R0.25 C#CC(C)(C)SCC=O 62a_200015260668_100000038118 [0,0,1,0,0,0|2,0,1]=4 280 B8R0.25 C=CC(C)(C)OCC=O 34a_100011215311_200009817547 [0,0,1,0,0,0|2,0,1]=4 281 B8R0.25 C=CC(C)(C)OCC=O 7a_100011215311_200015260668 [0,0,1,0,0,0|2,0,1]=4 282 B8R0.25 C=CCNC(C)(C)CC 2230a_100000211385_100000210623 [0,0,1,0,0,0|3,0,0]=4 283 B8R0.25 C=CCOC(C)(C)CC 7a_100000210230_100015514636 [0,0,1,0,0,0|3,0,0]=4 284 B8R0.25 C=CCSC(C)(C)CC 62a_100000032637_100000210623 [0,0,1,0,0,0|3,0,0]=4 285 B8R0.25 C=CCSC(C)(C)CC 62a_100000210623_100000032637 [0,0,1,0,0,0|3,0,0]=4 286 B8R0.25 CC(C)(C#N)OCC=O 34a_200015195151_200009817547 [0,0,1,0,0,0|3,0,0]=4 287 B8R0.25 CC(C)(C#N)SCC=O 62a_100011162410_200015260668 [0,0,1,0,0,0|3,0,0]=4 288 B8R0.25 CC(C)(C#N)SCC=O 62a_200015260668_100011162410 [0,0,1,0,0,0|3,0,0]=4 289 B8R0.25 CC(C)(CCCBr)O[13CH3] 7a_100009888830_200025704644 [0,0,1,0,0,0|2,0,1]=4 290 B8R0.25 CC(C)(CCl)OCC=O 7a_100000764493_200015260668 [0,0,1,0,0,0|3,0,0]=4 291 B8R0.25 CC(C)(CO)NCC=O 2230a_100000210608_200015260668 [0,0,1,0,0,0|3,0,0]=4 292 B8R0.25 CCC(C)(C)NCC=O 2230a_100000211385_200015260668 [0,0,1,0,0,0|2,0,0]=3 293 B8R0.25 CCC(C)(C)OCC=O 7a_100000210230_200015260668 [0,0,1,0,0,0|2,0,0]=3 294 B8R0.25 CCC(C)(C)SCC=O 62a_100000032637_200015260668 [0,0,1,0,0,0|2,0,0]=3 295 B8R0.25 CCC(C)(C)SCC=O 62a_200015260668_100000032637 [0,0,1,0,0,0|2,0,0]=3 296 B8R0.25 CCCCC(C)(C)OC 7a_100011219641_200000210301 [0,0,1,0,0,0|2,0,1]=4 297 B8R0.25 CCCCC(C)(C)O[13CH3] 7a_100011219641_200025704644 [0,0,1,0,0,0|2,0,1]=4 298 B8R0.25 COC(C)(C)CCCBr 7a_100009888830_200000210301 [0,0,1,0,0,0|2,0,1]=4 299 B8R0.25 COC(C)(C)CCO[13CH3] 7a_100000699976_200025704644 [0,0,1,0,0,0|3,0,0]=4 300 B8R0.25 COCCC(C)(C)OC 7a_100000699976_200000210301 [0,0,1,0,0,0|3,0,0]=4 301 B8R0.27 CC(=O)N(C)C(C)(C)C 11a_100011215553_100015343762 [0,0,1,0,0,0|0,0,0]=1 302 B8R0.27 CC(=O)N(C)C(C)(C)C 1626a_100011215553_100015343762 [0,0,1,0,0,0|0,0,0]=1 303 B8R0.27 CC(=O)N(C)C(C)(C)C 240690a_100011215553_100015343762 [0,0,1,0,0,0|0,0,0]=1 304 B8R0.27 CC(=O)[C@@H](O)C(C)(C)C 1458a_100009816492_200000210301 [0,0,1,0,0,0|2,0,0]=3 305 B8R0.27 CC(C)(C)[C@H](O)C(=O)[13CH3] 1458a_100009816492_200025704644 [0,0,1,0,0,0|2,0,0]=3 306 B8R0.27 CC(C)N(C)C(C)(C)C 269982a_100011215553_100000210206 [0,0,1,0,0,0|1,0,1]=3 307 B8R0.27 CC(C)N(C)C(C)(C)C 269982a_200000211004_100000210625 [0,0,1,0,0,0|1,0,1]=3 308 B8R0.27 CC(C)N(C)C(C)(C)C 269982a_200020682127_200000210301 [0,0,1,0,0,0|1,0,1]=3 309 B8R0.27 CC(C)N([13CH3])C(C)(C)C 269982a_200020682127_200025704644 [0,0,1,0,0,0|1,0,1]=3 310 B8R0.27 CC(N(C)C)C(C)(C)C 2230a_100000745498_200000210301 [0,0,1,0,0,0|3,0,0]=4 311 B8R0.27 CC(N(C)C)C(C)(C)C 269982a_100000745498_200000210301 [0,0,1,0,0,0|3,0,0]=4 312 B8R0.27 CC(N(C)[13CH3])C(C)(C)C 2230a_100000745498_200025704644 [0,0,1,0,0,0|3,0,0]=4 313 B8R0.27 CC(N(C)[13CH3])C(C)(C)C 269982a_100000745498_200025704644 [0,0,1,0,0,0|3,0,0]=4 314 B7R0.2 C=CC(=O)NC(C)C 1626a_100138425928_100000185746 [1,0,1,0,0,0|0,0,2]=4 315 B7R0.2 C=CC(=O)NC(C)C 240690a_100138425928_200121576911 [1,0,1,0,0,0|0,0,2]=4 316 B7R0.2 CC(C)CC(=O)CF 1458a_100000210554_100015361967 [1,0,1,0,0,0|2,0,0]=4 317 B7R0.2 CC(C)CC(=O)CO 1458a_100000210174_100000210624 [1,0,1,0,0,0|2,0,0]=4 318 B7R0.2 CC(C)NC(=O)CO 240690a_100138425928_100000210174 [1,0,1,0,0,0|1,0,0]=3 319 B7R0.2 CC(C)NC(=O)CO 527a_100138425928_100000210174 [1,0,1,0,0,0|1,0,0]=3 320 B7R0.2 CCC(=O)C=C(C)C 1458a_100000211388_100000210202 [1,0,1,0,0,0|1,0,1]=4 321 B7R0.2 CCC(=O)CC(C)C 1458a_100000210414_100000210624 [1,0,1,0,0,0|1,0,0]=3 322 B7R0.2 CCC(=O)CC(C)C 1458a_100000210554_100000210202 [1,0,1,0,0,0|1,0,0]=3 323 B7R0.2 CCC(=O)CC(C)O 1458a_100000210414_100011218427 [1,0,1,0,0,0|2,0,0]=4 324 B7R0.2 CCC(=O)CN(C)C 1458a_100000750896_100000210202 [1,0,1,0,0,0|2,0,0]=4 325 B7R0.2 CCC(=O)CN(C)C 269982a_100102631434_100000747405 [1,0,1,0,0,0|2,0,0]=4 326 B7R0.2 CCC(=O)C[C@@H](C)O 1458a_100011933948_100000210202 [1,0,1,0,0,0|2,0,0]=4 327 B7R0.2 CCC(=O)C[S+](C)C 1458a_200159257847_100000210202 [1,0,1,0,0,0|2,0,0]=4 328 B7R0.2 CCC(=O)NC(C)C 11a_100138425928_100000210414 [1,0,1,0,0,0|0,0,0]=2 329 B7R0.2 CCC(=O)NC(C)C 1626a_100138425928_100000210414 [1,0,1,0,0,0|0,0,0]=2 330 B7R0.2 CCC(=O)NC(C)C 240690a_100138425928_100000210414 [1,0,1,0,0,0|0,0,0]=2 331 B7R0.2 CCC(=O)NC(C)C 527a_100138425928_100000210414 [1,0,1,0,0,0|0,0,0]=2 332 B7R0.2 CCC(C)NC(C)C 2230a_100000209981_100000210206 [1,0,1,0,0,0|1,0,1]=4 333 B7R0.2 CCC(C)NC(C)C 2230a_100138425928_100000758301 [1,0,1,0,0,0|1,0,1]=4 334 B7R0.2 CCC(C)NC(C)C 34a_100138425928_100011215416 [1,0,1,0,0,0|1,0,1]=4 335 B7R0.2 CNC(=O)CC(C)C 11a_106832991635_100000210554 [1,0,1,0,0,0|2,0,0]=4 336 B7R0.2 CNC(=O)CC(C)C 1626a_100102657272_100000210554 [1,0,1,0,0,0|2,0,0]=4 337 B7R0.2 CNC(=O)CC(C)C 240690a_100102657272_100000210554 [1,0,1,0,0,0|2,0,0]=4 338 B7R0.2 CNC(=O)CC(C)C 527a_100102657272_100000210554 [1,0,1,0,0,0|2,0,0]=4 339 B7R0.2 CNC(=O)NC(C)C 2708a_100102657272_100138425928 [1,0,1,0,0,0|1,0,0]=3 340 B7R0.2 CNC(=O)NC(C)C 2708a_100138425928_106832991635 [1,0,1,0,0,0|1,0,0]=3 341 B7R0.2 CNC(=O)NC(C)C 273464a_100138425928_100102657272 [1,0,1,0,0,0|1,0,0]=3 342 B7R0.2 CNC(=O)NC(C)C 512a_100138425928_100102657272 [1,0,1,0,0,0|1,0,0]=3 343 B7R0.2 CNC(=O)NC(C)C 512a_106832991638_100138425928 [1,0,1,0,0,0|1,0,0]=3 344 B7R0.5 CC(C)N(C)CCF 269982a_200000211004_100011217306 [1,0,1,0,0,0|1,0,1]=4 345 B7R0.5 CC(C)N(C)CCO 2230a_100000210263_100000210206 [1,0,1,0,0,0|1,0,1]=4 346 B7R0.5 CC(C)N(C)CCO 2230a_100000224655_200000210301 [1,0,1,0,0,0|1,0,1]=4 347 B7R0.5 CC(C)N(C)CCO 269982a_100000210263_100000210206 [1,0,1,0,0,0|1,0,1]=4 348 B7R0.5 CC(C)N(C)CCO 269982a_100000224655_200000210301 [1,0,1,0,0,0|1,0,1]=4 349 B7R0.5 CC(C)N(C)CCO 269982a_200000211004_100000211926 [1,0,1,0,0,0|1,0,1]=4 350 B7R0.5 CC(C)N([13CH3])CCO 2230a_100000224655_200025704644 [1,0,1,0,0,0|1,0,1]=4 351 B7R0.5 CC(C)N([13CH3])CCO 269982a_100000224655_200025704644 [1,0,1,0,0,0|1,0,1]=4 352 B7R0.5 CCCN(C)C(C)C 2230a_100000747261_100000210206 [1,0,1,0,0,0|0,0,1]=3 353 B7R0.5 CCCN(C)C(C)C 2230a_106256033942_200000210301 [1,0,1,0,0,0|0,0,1]=3 354 B7R0.5 CCCN(C)C(C)C 269982a_100000747261_100000210206 [1,0,1,0,0,0|0,0,1]=3 355 B7R0.5 CCCN(C)C(C)C 269982a_106256033942_200000210301 [1,0,1,0,0,0|0,0,1]=3 356 B7R0.5 CCCN(C)C(C)C 269982a_200000211004_100000210303 [1,0,1,0,0,0|0,0,1]=3 357 B7R0.5 CCCN([13CH3])C(C)C 2230a_106256033942_200025704644 [1,0,1,0,0,0|0,0,1]=3 358 B7R0.5 CCCN([13CH3])C(C)C 269982a_106256033942_200025704644 [1,0,1,0,0,0|0,0,1]=3 359 B7R0.5 CCNC(C)C(C)C 2230a_100000211541_100000210202 [1,0,1,0,0,0|2,0,0]=4 360 B7R0.5 CCOC(C)C(C)C 7a_100000748068_100000210202 [1,0,1,0,0,0|2,0,0]=4 361 B7R0.5 COCN(C)C(C)C 269982a_200000211004_100000766300 [1,0,1,0,0,0|1,0,1]=4 362 B7R0.5 CSCN(C)C(C)C 269982a_200000211004_100011218213 [1,0,1,0,0,0|1,0,1]=4 363 B7R0.10 C/C=C(\C)/C(=O)CC 1458a_100020587367_100000210202 [1,0,1,0,0,0|1,0,1]=4 364 B7R0.10 C=CC(=O)N(C)CC 1626a_100000225621_100000185746 [1,0,1,0,0,0|0,0,2]=4 365 B7R0.10 C=CC(=O)N(C)CC 240690a_100000225621_200121576911 [1,0,1,0,0,0|0,0,2]=4 366 B7R0.10 CCC(=O)C(C)CC 1458a_100000210414_100000758301 [1,0,1,0,0,0|1,0,0]=3 367 B7R0.10 CCC(=O)C(C)CC 1458a_100011192722_100000210202 [1,0,1,0,0,0|1,0,0]=3 368 B7R0.10 CCC(=O)C(C)NC 2230a_106832991635_100000742827 [1,0,1,0,0,0|2,0,0]=4 369 B7R0.10 CCC(=O)C(C)NC 7a_106832991635_100000742827 [1,0,1,0,0,0|2,0,0]=4 370 B7R0.10 CCC(=O)C(C)OC 1458a_100000743197_100000210202 [1,0,1,0,0,0|2,0,0]=4 371 B7R0.10 CCC(=O)C(C)SC 1458a_100000149566_100000210202 [1,0,1,0,0,0|2,0,0]=4 372 B7R0.10 CCC(=O)C(C)SC 62a_100000742827_200000210301 [1,0,1,0,0,0|2,0,0]=4 373 B7R0.10 CCC(=O)C(C)SC 62a_200000210301_100000742827 [1,0,1,0,0,0|2,0,0]=4 374 B7R0.10 CCC(=O)C(C)S[13CH3] 62a_100000742827_200025704644 [1,0,1,0,0,0|2,0,0]=4 375 B7R0.10 CCC(=O)C(C)S[13CH3] 62a_200025704644_100000742827 [1,0,1,0,0,0|2,0,0]=4 376 B7R0.10 CCC(=O)C(O)CC 1458a_100011196387_100000210202 [1,0,1,0,0,0|2,0,0]=4 377 B7R0.10 CCC(=O)N(C)CC 11a_100000225621_100000210414 [1,0,1,0,0,0|0,0,0]=2 378 B7R0.10 CCC(=O)N(C)CC 1626a_100000225621_100000210414 [1,0,1,0,0,0|0,0,0]=2 379 B7R0.10 CCC(=O)N(C)CC 240690a_100000225621_100000210414 [1,0,1,0,0,0|0,0,0]=2 380 B7R0.10 CCC(=O)N(C)CC 527a_100000225621_100000210414 [1,0,1,0,0,0|0,0,0]=2 381 B7R0.10 CCC(C)C(=O)CF 1458a_100011192722_100015361967 [1,0,1,0,0,0|2,0,0]=4 382 B7R0.10 CCC(C)C(=O)CO 1458a_100000210174_100000758301 [1,0,1,0,0,0|2,0,0]=4 383 B7R0.10 CCC(C)C(=O)NC 11a_106832991635_100011192722 [1,0,1,0,0,0|2,0,0]=4 384 B7R0.10 CCC(C)C(=O)NC 1626a_100102657272_100011192722 [1,0,1,0,0,0|2,0,0]=4 385 B7R0.10 CCC(C)C(=O)NC 240690a_100102657272_100011192722 [1,0,1,0,0,0|2,0,0]=4 386 B7R0.10 CCC(C)C(=O)NC 527a_100102657272_100011192722 [1,0,1,0,0,0|2,0,0]=4 387 B7R0.10 CCC(C)N(C)CC 2230a_100000225621_100000758301 [1,0,1,0,0,0|1,0,1]=4 388 B7R0.10 CCC(C)N(C)CC 2230a_100000732650_200000210301 [1,0,1,0,0,0|1,0,1]=4 389 B7R0.10 CCC(C)N(C)CC 2230a_100000741768_100000210202 [1,0,1,0,0,0|1,0,1]=4 390 B7R0.10 CCC(C)N(C)CC 269982a_100000225621_100000758301 [1,0,1,0,0,0|1,0,1]=4 391 B7R0.10 CCC(C)N(C)CC 269982a_100000732650_200000210301 [1,0,1,0,0,0|1,0,1]=4 392 B7R0.10 CCC(C)N(C)CC 269982a_100000741768_100000204670 [1,0,1,0,0,0|1,0,1]=4 393 B7R0.10 CCC(C)N(C)CF 269982a_100000741768_100015361967 [1,0,1,0,0,0|1,0,1]=4 394 B7R0.10 CCC(C)N([13CH3])CC 2230a_100000732650_200025704644 [1,0,1,0,0,0|1,0,1]=4 395 B7R0.10 CCC(C)N([13CH3])CC 269982a_100000732650_200025704644 [1,0,1,0,0,0|1,0,1]=4 396 B7R0.10 CCN(C)C(=O)CO 240690a_100000225621_100000210174 [1,0,1,0,0,0|1,0,0]=3 397 B7R0.10 CCN(C)C(=O)CO 527a_100000225621_100000210174 [1,0,1,0,0,0|1,0,0]=3 398 B7R0.10 CCN(C)C(=O)NC 2708a_100102657272_100000225621 [1,0,1,0,0,0|1,0,0]=3 399 B7R0.10 CCN(C)C(=O)NC 273464a_100102657272_100000225621 [1,0,1,0,0,0|1,0,0]=3 400 B7R0.16 CC(=O)C(C)C(C)C 1458a_100000755409_200000210301 [1,0,1,0,0,0|1,0,0]=3 401 B7R0.16 CC(=O)C(C)N(C)C 2230a_100102631434_100009814033 [1,0,1,0,0,0|2,0,0]=4 402 B7R0.16 CC(=O)C(C)N(C)C 269982a_100102631434_100009814033 [1,0,1,0,0,0|2,0,0]=4 403 B7R0.16 CC(=O)N(C)C(C)C 11a_200000211004_100015343762 [1,0,1,0,0,0|0,0,0]=2 404 B7R0.16 CC(=O)N(C)C(C)C 1626a_200000211004_100015343762 [1,0,1,0,0,0|0,0,0]=2 405 B7R0.16 CC(=O)N(C)C(C)C 240690a_200000211004_100015343762 [1,0,1,0,0,0|0,0,0]=2 406 B7R0.16 CC(=O)N(C)C(C)C 527a_200000211004_100103153847 [1,0,1,0,0,0|0,0,0]=2 407 B7R0.16 CC(=O)[C@H](C)N(C)C 1458a_100009822176_200000210301 [1,0,1,0,0,0|2,0,0]=4 408 B7R0.16 CC(=O)[C@H](O)C(C)C 1458a_100000691806_200000210301 [1,0,1,0,0,0|2,0,0]=4 409 B7R0.16 CC(C)C(C)C(=O)[13CH3] 1458a_100000755409_200025704644 [1,0,1,0,0,0|1,0,0]=3 410 B7R0.16 CC(C)N(C)C(C)C 2230a_100000086832_200000210301 [1,0,1,0,0,0|1,0,1]=4 411 B7R0.16 CC(C)N(C)C(C)C 269982a_100000086832_200000210301 [1,0,1,0,0,0|1,0,1]=4 412 B7R0.16 CC(C)N(C)C(C)C 269982a_200000211004_100000210206 [1,0,1,0,0,0|1,0,1]=4 413 B7R0.16 CC(C)N(C)C(C)C 34a_100000086832_200000210301 [1,0,1,0,0,0|1,0,1]=4 414 B7R0.16 CC(C)N([13CH3])C(C)C 2230a_100000086832_200025704644 [1,0,1,0,0,0|1,0,1]=4 415 B7R0.16 CC(C)N([13CH3])C(C)C 269982a_100000086832_200025704644 [1,0,1,0,0,0|1,0,1]=4 416 B7R0.16 CC(C)N([13CH3])C(C)C 34a_100000086832_200025704644 [1,0,1,0,0,0|1,0,1]=4 417 B7R0.16 CC(C)[C@@H](O)C(=O)[13CH3] 1458a_100000691806_200025704644 [1,0,1,0,0,0|2,0,0]=4 418 B7R0.16 C[C@@H](C(=O)[13CH3])N(C)C 1458a_100009822176_200025704644 [1,0,1,0,0,0|2,0,0]=4 419 B7R0.3 C#CC(=O)CCCC 1458a_100000211873_100000210211 [1,0,1,0,0,0|1,0,1]=4 420 B7R0.3 C#CCCC(=O)NC 11a_106832991635_100000692101 [1,0,1,0,0,0|0,0,2]=4 421 B7R0.3 C#CCCC(=O)NC 1626a_100102657272_100000692101 [1,0,1,0,0,0|0,0,2]=4 422 B7R0.3 C#CCCC(=O)NC 240690a_100102657272_100000692101 [1,0,1,0,0,0|0,0,2]=4 423 B7R0.3 C#CCCC(=O)NC 527a_100102657272_100000692101 [1,0,1,0,0,0|0,0,2]=4 424 B7R0.3 C=CC(=O)CCCC 1458a_100000185746_100000210211 [1,0,1,0,0,0|1,0,1]=4 425 B7R0.3 C=CCCC(=O)NC 11a_106832991635_100000749702 [1,0,1,0,0,0|0,0,2]=4 426 B7R0.3 C=CCCC(=O)NC 1626a_100102657272_100000749702 [1,0,1,0,0,0|0,0,2]=4 427 B7R0.3 C=CCCC(=O)NC 240690a_100102657272_100000749702 [1,0,1,0,0,0|0,0,2]=4 428 B7R0.3 C=CCCC(=O)NC 527a_100102657272_100000749702 [1,0,1,0,0,0|0,0,2]=4 429 B7R0.3 C=CCCC(C)NC 270004a_106832991635_100000762624 [1,0,1,0,0,0|1,0,0]=3 430 B7R0.3 C=CCCC(C)OC 34a_100000765329_200000210301 [1,0,1,0,0,0|2,0,0]=4 431 B7R0.3 C=CCCC(C)OC 7a_100000765329_200000210301 [1,0,1,0,0,0|2,0,0]=4 432 B7R0.3 C=CCCC(C)O[13CH3] 34a_100000765329_200025704644 [1,0,1,0,0,0|2,0,0]=4 433 B7R0.3 C=CCCC(C)O[13CH3] 7a_100000765329_200025704644 [1,0,1,0,0,0|2,0,0]=4 434 B7R0.3 CC=CCC(=O)NC 11a_106832991635_100121576822 [1,0,1,0,0,0|0,0,2]=4 435 B7R0.3 CC=CCC(=O)NC 1626a_100102657272_100121576822 [1,0,1,0,0,0|0,0,2]=4 436 B7R0.3 CC=CCC(=O)NC 240690a_100102657272_100121576822 [1,0,1,0,0,0|0,0,2]=4 437 B7R0.3 CC=CCC(=O)NC 527a_100102657272_100121576822 [1,0,1,0,0,0|0,0,2]=4 438 B7R0.3 CCC(=O)CCCF 1458a_100000210414_100011934791 [1,0,1,0,0,0|2,0,0]=4 439 B7R0.3 CCC(=O)CCCO 1458a_100000210414_100011215043 [1,0,1,0,0,0|2,0,0]=4 440 B7R0.3 CCC(=O)CCOC 1458a_100000210414_100000233755 [1,0,1,0,0,0|2,0,0]=4 441 B7R0.3 CCC(=O)CCOC 1458a_100000749529_100000210202 [1,0,1,0,0,0|2,0,0]=4 442 B7R0.3 CCC(=O)CCSC 1458a_100000174002_100000210202 [1,0,1,0,0,0|2,0,0]=4 443 B7R0.3 CCC(=O)CCSC 1458a_100000210414_100000751147 [1,0,1,0,0,0|2,0,0]=4 444 B7R0.3 CCC(C)NCC=O 2230a_100000209981_200015260668 [1,0,1,0,0,0|2,0,0]=4 445 B7R0.3 CCC(C)OCC=O 7a_100000210228_200015260668 [1,0,1,0,0,0|2,0,0]=4 446 B7R0.3 CCC(C)SCC=O 62a_100000758301_200015260668 [1,0,1,0,0,0|2,0,0]=4 447 B7R0.3 CCC(C)SCC=O 62a_200015260668_100000758301 [1,0,1,0,0,0|2,0,0]=4 448 B7R0.3 CCC=CC(=O)NC 11a_106832991635_100000212282 [1,0,1,0,0,0|0,0,2]=4 449 B7R0.3 CCC=CC(=O)NC 1626a_100102657272_100000212282 [1,0,1,0,0,0|0,0,2]=4 450 B7R0.3 CCC=CC(=O)NC 240690a_100102657272_100000212282 [1,0,1,0,0,0|0,0,2]=4 451 B7R0.3 CCCCC(=O)CC 1458a_100000210183_100000210202 [1,0,1,0,0,0|1,0,0]=3 452 B7R0.3 CCCCC(=O)CC 1458a_100000210414_100000210211 [1,0,1,0,0,0|1,0,0]=3 453 B7R0.3 CCCCC(=O)CF 1458a_100000210183_100015361967 [1,0,1,0,0,0|2,0,0]=4 454 B7R0.3 CCCCC(=O)CO 1458a_100000210174_100000210211 [1,0,1,0,0,0|2,0,0]=4 455 B7R0.3 CCCCC(=O)NC 11a_106832991635_100000210183 [1,0,1,0,0,0|0,0,0]=2 456 B7R0.3 CCCCC(=O)NC 1626a_100102657272_100000210183 [1,0,1,0,0,0|0,0,0]=2 457 B7R0.3 CCCCC(=O)NC 240690a_100102657272_100000210183 [1,0,1,0,0,0|0,0,0]=2 458 B7R0.3 CCCCC(=O)NC 527a_100102657272_100000210183 [1,0,1,0,0,0|0,0,0]=2 459 B7R0.3 CCCCC(C)NC 2230a_100000126638_200000210301 [1,0,1,0,0,0|1,0,1]=4 460 B7R0.3 CCCCC(C)NC 2230a_106832991635_200011215066 [1,0,1,0,0,0|1,0,1]=4 461 B7R0.3 CCCCC(C)NC 270004a_106832991635_100000210087 [1,0,1,0,0,0|1,0,1]=4 462 B7R0.3 CCCCC(C)NC 34a_100102657272_200011215066 [1,0,1,0,0,0|1,0,1]=4 463 B7R0.3 CCCCC(C)NC 7a_106832991635_200011215066 [1,0,1,0,0,0|1,0,1]=4 464 B7R0.3 CCCCC(C)N[13CH3] 2230a_100000126638_200025704644 [1,0,1,0,0,0|1,0,1]=4 465 B7R0.3 CCCNC(=O)CC 11a_100020643023_100000210414 [1,0,1,0,0,0|2,0,0]=4 466 B7R0.3 CCCNC(=O)CC 1626a_100020643023_100000210414 [1,0,1,0,0,0|2,0,0]=4 467 B7R0.3 CCCNC(=O)CC 240690a_100020643023_100000210414 [1,0,1,0,0,0|2,0,0]=4 468 B7R0.3 CCCNC(=O)CC 527a_100020643023_100000210414 [1,0,1,0,0,0|2,0,0]=4 469 B7R0.3 CCCNC(=O)NC 2708a_100020643023_106832991635 [1,0,1,0,0,0|1,0,0]=3 470 B7R0.3 CCCNC(=O)NC 2708a_100102657272_100020643023 [1,0,1,0,0,0|1,0,0]=3 471 B7R0.3 CCCNC(=O)NC 273464a_100020643023_100102657272 [1,0,1,0,0,0|1,0,0]=3 472 B7R0.3 CCCNC(=O)NC 273464a_100102657272_100020643023 [1,0,1,0,0,0|1,0,0]=3 473 B7R0.3 CCCNC(=O)NC 512a_100020643023_100102657272 [1,0,1,0,0,0|1,0,0]=3 474 B7R0.3 CCCNC(=O)NC 512a_106832991638_100020643023 [1,0,1,0,0,0|1,0,0]=3 475 B7R0.3 CCNCC(=O)NC 2230a_100000693194_100000210202 [1,0,1,0,0,0|1,0,0]=3 476 B7R0.3 CCNCC(=O)NC 2230a_100015525214_100000183359 [1,0,1,0,0,0|1,0,0]=3 477 B7R0.3 CCNCC(=O)OC 2230a_100015525214_100000747449 [1,0,1,0,0,0|2,0,0]=4 478 B7R0.3 CCNNC(=O)NC 273464a_100102657272_100000756455 [1,0,1,0,0,0|2,0,0]=4 479 B7R0.3 CCNNC(=O)NC 512a_100000756455_100102657272 [1,0,1,0,0,0|2,0,0]=4 480 B7R0.3 CCNNC(=O)NC 512a_106832991638_100000756455 [1,0,1,0,0,0|2,0,0]=4 481 B7R0.3 CCOCC(=O)CC 1458a_100000211967_100000210202 [1,0,1,0,0,0|2,0,0]=4 482 B7R0.3 CCOCC(=O)CC 34a_100000725409_100000210202 [1,0,1,0,0,0|2,0,0]=4 483 B7R0.3 CCOCC(=O)NC 11a_106832991635_100000211967 [1,0,1,0,0,0|1,0,0]=3 484 B7R0.3 CCOCC(=O)NC 1626a_100102657272_100000211967 [1,0,1,0,0,0|1,0,0]=3 485 B7R0.3 CCOCC(=O)NC 240690a_100102657272_100000211967 [1,0,1,0,0,0|1,0,0]=3 486 B7R0.3 CCOCC(=O)NC 34a_100000750040_100000210202 [1,0,1,0,0,0|1,0,0]=3 487 B7R0.3 CCOCC(=O)NC 34a_100121572206_100000183359 [1,0,1,0,0,0|1,0,0]=3 488 B7R0.3 CCOCC(=O)NC 527a_100102657272_100000211967 [1,0,1,0,0,0|1,0,0]=3 489 B7R0.3 CCOCC(=O)OC 34a_100121572206_100000747449 [1,0,1,0,0,0|2,0,0]=4 490 B7R0.3 CCSCC(=O)CC 1458a_100000230394_100000210202 [1,0,1,0,0,0|2,0,0]=4 491 B7R0.3 CCSCC(=O)CC 62a_100000210202_100000747405 [1,0,1,0,0,0|2,0,0]=4 492 B7R0.3 CCSCC(=O)CC 62a_100000747405_100000210202 [1,0,1,0,0,0|2,0,0]=4 493 B7R0.3 CCSCC(=O)NC 11a_106832991635_100000230394 [1,0,1,0,0,0|1,0,0]=3 494 B7R0.3 CCSCC(=O)NC 1626a_100102657272_100000230394 [1,0,1,0,0,0|1,0,0]=3 495 B7R0.3 CCSCC(=O)NC 240690a_100102657272_100000230394 [1,0,1,0,0,0|1,0,0]=3 496 B7R0.3 CCSCC(=O)NC 527a_100102657272_100000230394 [1,0,1,0,0,0|1,0,0]=3 497 B7R0.3 CCSCC(=O)NC 62a_100000183359_100000210202 [1,0,1,0,0,0|1,0,0]=3 498 B7R0.3 CCSCC(=O)NC 62a_100000210202_100000183359 [1,0,1,0,0,0|1,0,0]=3 499 B7R0.3 CCSCC(=O)OC 62a_100000210202_100000747449 [1,0,1,0,0,0|2,0,0]=4 500 B7R0.3 CCSCC(=O)OC 62a_100000747449_100000210202 [1,0,1,0,0,0|2,0,0]=4 501 B7R0.3 CNC(=O)CCC#N 11a_106832991635_100011934036 [1,0,1,0,0,0|1,0,1]=4 502 B7R0.3 CNC(=O)CCC#N 1626a_100102657272_100011934036 [1,0,1,0,0,0|1,0,1]=4 503 B7R0.3 CNC(=O)CCC#N 240690a_100102657272_100011934036 [1,0,1,0,0,0|1,0,1]=4 504 B7R0.3 CNC(=O)CCC#N 527a_100102657272_100011934036 [1,0,1,0,0,0|1,0,1]=4 505 B7R0.3 CNC(=O)CCN[13CH3] 2230a_100000738227_200025704644 [1,0,1,0,0,0|1,0,0]=3 506 B7R0.3 CNC(=O)CCN[13CH3] 34a_100000738227_200025704644 [1,0,1,0,0,0|1,0,0]=3 507 B7R0.3 CNC(=O)CCOC 11a_106832991635_100000749529 [1,0,1,0,0,0|1,0,0]=3 508 B7R0.3 CNC(=O)CCOC 1626a_100102657272_100000749529 [1,0,1,0,0,0|1,0,0]=3 509 B7R0.3 CNC(=O)CCOC 240690a_100102657272_100000749529 [1,0,1,0,0,0|1,0,0]=3 510 B7R0.3 CNC(=O)CCOC 34a_100000754576_200000210301 [1,0,1,0,0,0|1,0,0]=3 511 B7R0.3 CNC(=O)CCOC 34a_100138415774_100012179268 [1,0,1,0,0,0|1,0,0]=3 512 B7R0.3 CNC(=O)CCOC 527a_100102657272_100000749529 [1,0,1,0,0,0|1,0,0]=3 513 B7R0.3 CNC(=O)CCO[13CH3] 34a_100000754576_200025704644 [1,0,1,0,0,0|1,0,0]=3 514 B7R0.3 CNC(=O)CCSC 11a_106832991635_100000174002 [1,0,1,0,0,0|1,0,0]=3 515 B7R0.3 CNC(=O)CCSC 1626a_100102657272_100000174002 [1,0,1,0,0,0|1,0,0]=3 516 B7R0.3 CNC(=O)CCSC 240690a_100102657272_100000174002 [1,0,1,0,0,0|1,0,0]=3 517 B7R0.3 CNC(=O)CCSC 527a_100102657272_100000174002 [1,0,1,0,0,0|1,0,0]=3 518 B7R0.3 CNC(=O)CCSC 62a_100000737683_200000210301 [1,0,1,0,0,0|1,0,0]=3 519 B7R0.3 CNC(=O)CCSC 62a_200000210301_100000737683 [1,0,1,0,0,0|1,0,0]=3 520 B7R0.3 CNC(=O)CCS[13CH3] 62a_100000737683_200025704644 [1,0,1,0,0,0|1,0,0]=3 521 B7R0.3 CNC(=O)CCS[13CH3] 62a_200025704644_100000737683 [1,0,1,0,0,0|1,0,0]=3 522 B7R0.3 CNC(=O)COCF 34a_100000750040_100015361967 [1,0,1,0,0,0|2,0,0]=4 523 B7R0.3 CNC(=O)CSCF 62a_100000183359_100015361967 [1,0,1,0,0,0|2,0,0]=4 524 B7R0.3 CNC(=O)CSCF 62a_100015361967_100000183359 [1,0,1,0,0,0|2,0,0]=4 525 B7R0.3 CNC(=O)NCCF 2708a_100102657272_100000724931 [1,0,1,0,0,0|2,0,0]=4 526 B7R0.3 CNC(=O)NCCF 273464a_100000724931_100102657272 [1,0,1,0,0,0|2,0,0]=4 527 B7R0.3 CNC(=O)NCCF 273464a_100102657272_100000724931 [1,0,1,0,0,0|2,0,0]=4 528 B7R0.3 CNC(=O)NCCF 512a_106832991638_100000724931 [1,0,1,0,0,0|2,0,0]=4 529 B7R0.3 CNC(=O)NCCO 2708a_100102657272_100000210304 [1,0,1,0,0,0|2,0,0]=4 530 B7R0.3 CNC(=O)NCCO 273464a_100000210304_100102657272 [1,0,1,0,0,0|2,0,0]=4 531 B7R0.3 CNC(=O)NCCO 273464a_100102657272_100000210304 [1,0,1,0,0,0|2,0,0]=4 532 B7R0.3 CNC(=O)NCCO 512a_106832991638_100000210304 [1,0,1,0,0,0|2,0,0]=4 533 B7R0.3 CNC(C)CCOC 270004a_106832991635_100000742357 [1,0,1,0,0,0|2,0,0]=4 534 B7R0.3 CNC(C)CCSC 270004a_106832991635_100011217047 [1,0,1,0,0,0|2,0,0]=4 535 B7R0.3 CNCCC(=O)NC 2230a_100000738227_200000210301 [1,0,1,0,0,0|1,0,0]=3 536 B7R0.3 CNCCC(=O)NC 2230a_106832991635_100000737683 [1,0,1,0,0,0|1,0,0]=3 537 B7R0.3 CNCCC(=O)NC 34a_100000738227_200000210301 [1,0,1,0,0,0|1,0,0]=3 538 B7R0.3 CNCCC(=O)NC 34a_100102657272_100012179268 [1,0,1,0,0,0|1,0,0]=3 539 B7R0.3 CNCCC(=O)NC 7a_106832991635_100000737683 [1,0,1,0,0,0|1,0,0]=3 540 B7R0.3 CNCCC(=O)OC 2230a_106832991635_100000204255 [1,0,1,0,0,0|2,0,0]=4 541 B7R0.3 CNCCC(=O)OC 34a_100102657272_100000742370 [1,0,1,0,0,0|2,0,0]=4 542 B7R0.3 CNCCC(=O)OC 7a_106832991635_100000204255 [1,0,1,0,0,0|2,0,0]=4 543 B7R0.3 COC(=O)CCSC 62a_100000204255_200000210301 [1,0,1,0,0,0|2,0,0]=4 544 B7R0.3 COC(=O)CCSC 62a_200000210301_100000204255 [1,0,1,0,0,0|2,0,0]=4 545 B7R0.3 COC(=O)CCS[13CH3] 62a_100000204255_200025704644 [1,0,1,0,0,0|2,0,0]=4 546 B7R0.3 COC(=O)CCS[13CH3] 62a_200025704644_100000204255 [1,0,1,0,0,0|2,0,0]=4 547 B7R0.3 COC(C)SCC=O 62a_100009879195_200015260668 [1,0,1,0,0,0|2,0,0]=4 548 B7R0.3 COC(C)SCC=O 62a_200015260668_100009879195 [1,0,1,0,0,0|2,0,0]=4 549 B7R0.3 COCCC(=O)OC 34a_100138415774_100000742370 [1,0,1,0,0,0|2,0,0]=4 550 B7R0.4 C/C=C/CNC(C)C 34a_100138425928_100102629194 [1,0,1,0,0,0|2,0,0]=4 551 B7R0.4 C/C=C/COC(C)C 34a_100000212225_100102629194 [1,0,1,0,0,0|2,0,0]=4 552 B7R0.4 C/C=C/COC(C)C 34a_100016270725_100000210206 [1,0,1,0,0,0|2,0,0]=4 553 B7R0.4 C/C=C/CSC(C)C 62a_100000210206_100102629194 [1,0,1,0,0,0|2,0,0]=4 554 B7R0.4 C/C=C/CSC(C)C 62a_100102629194_100000210206 [1,0,1,0,0,0|2,0,0]=4 555 B7R0.4 CC(C)CCCN[13CH3] 2230a_200000737386_200025704644 [1,0,1,0,0,0|0,0,1]=3 556 B7R0.4 CC(C)CCCN[13CH3] 34a_200000737386_200025704644 [1,0,1,0,0,0|0,0,1]=3 557 B7R0.4 CC(C)CCCO[13CH3] 34a_100000210774_200025704644 [1,0,1,0,0,0|1,0,1]=4 558 B7R0.4 CC(C)CCCO[13CH3] 7a_100000210774_200025704644 [1,0,1,0,0,0|1,0,1]=4 559 B7R0.4 CC(C)CCCS[13CH3] 62a_100011214892_200025704644 [1,0,1,0,0,0|1,0,1]=4 560 B7R0.4 CC(C)CCCS[13CH3] 62a_200025704644_100011214892 [1,0,1,0,0,0|1,0,1]=4 561 B7R0.4 CC(C)OCCN[13CH3] 2230a_100000701111_200025704644 [1,0,1,0,0,0|1,0,1]=4 562 B7R0.4 CC(C)OCCN[13CH3] 34a_100000701111_200025704644 [1,0,1,0,0,0|1,0,1]=4 563 B7R0.4 CC(C)SCCN[13CH3] 2230a_100000731138_200025704644 [1,0,1,0,0,0|1,0,1]=4 564 B7R0.4 CC(C)SCCN[13CH3] 34a_100000731138_200025704644 [1,0,1,0,0,0|1,0,1]=4 565 B7R0.4 CC=CCNC(C)C 2230a_100138425928_100000070051 [1,0,1,0,0,0|2,0,0]=4 566 B7R0.4 CC=CCNC(C)C 34a_100138425928_100000070051 [1,0,1,0,0,0|2,0,0]=4 567 B7R0.4 CC=CCOC(C)C 34a_100000212225_100000070051 [1,0,1,0,0,0|2,0,0]=4 568 B7R0.4 CC=CCSC(C)C 62a_100000070051_100000210206 [1,0,1,0,0,0|2,0,0]=4 569 B7R0.4 CC=CCSC(C)C 62a_100000210206_100000070051 [1,0,1,0,0,0|2,0,0]=4 570 B7R0.4 CCNCCC(C)C 2230a_100015525214_100000210312 [1,0,1,0,0,0|2,0,0]=4 571 B7R0.4 CCNCCC(C)C 269862a_100015525214_100000185833 [1,0,1,0,0,0|2,0,0]=4 572 B7R0.4 CCOCCC(C)C 34a_100000210254_100000210202 [1,0,1,0,0,0|2,0,0]=4 573 B7R0.4 CCOCCC(C)C 34a_100121572206_100000210312 [1,0,1,0,0,0|2,0,0]=4 574 B7R0.4 CCOCCC(C)C 7a_100000210254_100000210202 [1,0,1,0,0,0|2,0,0]=4 575 B7R0.4 CCSCCC(C)C 62a_100000210202_100000210312 [1,0,1,0,0,0|2,0,0]=4 576 B7R0.4 CCSCCC(C)C 62a_100000210312_100000210202 [1,0,1,0,0,0|2,0,0]=4 577 B7R0.4 CNCCCC(C)C 2230a_106832991635_100011214892 [1,0,1,0,0,0|0,0,1]=3 578 B7R0.4 CNCCCC(C)C 2230a_200000737386_200000210301 [1,0,1,0,0,0|0,0,1]=3 579 B7R0.4 CNCCCC(C)C 34a_100102657272_100011214892 [1,0,1,0,0,0|0,0,1]=3 580 B7R0.4 CNCCCC(C)C 34a_200000737386_200000210301 [1,0,1,0,0,0|0,0,1]=3 581 B7R0.4 CNCCCC(C)C 7a_106832991635_100011214892 [1,0,1,0,0,0|0,0,1]=3 582 B7R0.4 CNCCCC(C)O 2230a_106832991635_200000718107 [1,0,1,0,0,0|1,0,1]=4 583 B7R0.4 CNCCCC(C)O 34a_100102657272_200000718107 [1,0,1,0,0,0|1,0,1]=4 584 B7R0.4 CNCCCC(C)O 7a_106832991635_200000718107 [1,0,1,0,0,0|1,0,1]=4 585 B7R0.4 CNCCCN(C)C 7a_106832991635_100000757444 [1,0,1,0,0,0|1,0,1]=4 586 B7R0.4 CNCCOC(C)C 2230a_100000701111_200000210301 [1,0,1,0,0,0|1,0,1]=4 587 B7R0.4 CNCCOC(C)C 2230a_106832991635_100000211751 [1,0,1,0,0,0|1,0,1]=4 588 B7R0.4 CNCCOC(C)C 34a_100000701111_200000210301 [1,0,1,0,0,0|1,0,1]=4 589 B7R0.4 CNCCOC(C)C 34a_100102657272_100000211751 [1,0,1,0,0,0|1,0,1]=4 590 B7R0.4 CNCCOC(C)C 7a_106832991635_100000211751 [1,0,1,0,0,0|1,0,1]=4 591 B7R0.4 CNCCSC(C)C 2230a_100000731138_200000210301 [1,0,1,0,0,0|1,0,1]=4 592 B7R0.4 CNCCSC(C)C 2230a_106832991635_100000730970 [1,0,1,0,0,0|1,0,1]=4 593 B7R0.4 CNCCSC(C)C 34a_100000731138_200000210301 [1,0,1,0,0,0|1,0,1]=4 594 B7R0.4 CNCCSC(C)C 34a_100102657272_100000730970 [1,0,1,0,0,0|1,0,1]=4 595 B7R0.4 CNCCSC(C)C 7a_106832991635_100000730970 [1,0,1,0,0,0|1,0,1]=4 596 B7R0.4 COCCCC(C)C 34a_100000210774_200000210301 [1,0,1,0,0,0|1,0,1]=4 597 B7R0.4 COCCCC(C)C 34a_100138415774_100011214892 [1,0,1,0,0,0|1,0,1]=4 598 B7R0.4 COCCCC(C)C 7a_100000210774_200000210301 [1,0,1,0,0,0|1,0,1]=4 599 B7R0.4 CSCCCC(C)C 62a_100011214892_200000210301 [1,0,1,0,0,0|1,0,1]=4 600 B7R0.4 CSCCCC(C)C 62a_200000210301_100011214892 [1,0,1,0,0,0|1,0,1]=4 601 B7R0.6 C=C(C)CCC(=O)C 1458a_100000070787_100000730704 [1,0,1,0,0,0|0,0,2]=4 602 B7R0.6 C=C(C)CCC(=O)C 1458a_200000688413_200000210301 [1,0,1,0,0,0|0,0,2]=4 603 B7R0.6 C=C(C)CCC(=O)[13CH3] 1458a_200000688413_200025704644 [1,0,1,0,0,0|0,0,2]=4 604 B7R0.6 C=C(C)CCN(C)C 2230a_100102631434_100000730704 [1,0,1,0,0,0|2,0,0]=4 605 B7R0.6 C=C(C)CCN(C)C 269982a_100102631434_100000730704 [1,0,1,0,0,0|2,0,0]=4 606 B7R0.6 C=C(C)CNC(C)C 2230a_100138425928_100000748629 [1,0,1,0,0,0|2,0,0]=4 607 B7R0.6 C=C(C)CNC(C)C 34a_100138425928_100000748629 [1,0,1,0,0,0|2,0,0]=4 608 B7R0.6 C=C(C)COC(C)C 34a_100000210245_100000210206 [1,0,1,0,0,0|2,0,0]=4 609 B7R0.6 C=C(C)COC(C)C 34a_100000212225_100000748629 [1,0,1,0,0,0|2,0,0]=4 610 B7R0.6 C=C(C)CSC(C)C 62a_100000210206_100000211660 [1,0,1,0,0,0|2,0,0]=4 611 B7R0.6 C=C(C)CSC(C)C 62a_100000748629_100000210206 [1,0,1,0,0,0|2,0,0]=4 612 B7R0.6 CC(=CCC(=O)[13CH3])C 1458a_100011220947_200025704644 [1,0,1,0,0,0|0,0,2]=4 613 B7R0.6 CC(=O)C=CC(C)C 1458a_100016268746_200000210301 [1,0,1,0,0,0|0,0,2]=4 614 B7R0.6 CC(=O)CC=C(C)C 1458a_100000070787_100000761012 [1,0,1,0,0,0|0,0,2]=4 615 B7R0.6 CC(=O)CC=C(C)C 1458a_100011220947_200000210301 [1,0,1,0,0,0|0,0,2]=4 616 B7R0.6 CC(=O)CCC(=O)N 1458a_100011215257_200000210301 [1,0,1,0,0,0|1,0,1]=4 617 B7R0.6 CC(=O)CCC(C)C 1458a_100000070787_100000210312 [1,0,1,0,0,0|0,0,0]=2 618 B7R0.6 CC(=O)CCC(C)C 1458a_100000181311_200000210301 [1,0,1,0,0,0|0,0,0]=2 619 B7R0.6 CC(=O)CCC(C)O 1458a_100000070787_100012276601 [1,0,1,0,0,0|1,0,0]=3 620 B7R0.6 CC(=O)CCN(C)C 269982a_100102631434_100000053229 [1,0,1,0,0,0|1,0,0]=3 621 B7R0.6 CC(=O)CC[S+](C)C 1458a_100009452791_200000210301 [1,0,1,0,0,0|1,0,0]=3 622 B7R0.6 CC(=O)COC(C)C 1458a_100000745533_200000210301 [1,0,1,0,0,0|1,0,0]=3 623 B7R0.6 CC(=O)COC(C)C 34a_100000211253_100000210206 [1,0,1,0,0,0|1,0,0]=3 624 B7R0.6 CC(=O)CSC(C)C 1458a_100000241585_200000210301 [1,0,1,0,0,0|1,0,0]=3 625 B7R0.6 CC(=O)NCC(C)C 11a_100000210953_100015343762 [1,0,1,0,0,0|1,0,0]=3 626 B7R0.6 CC(=O)NCC(C)C 1626a_100000210953_100015343762 [1,0,1,0,0,0|1,0,0]=3 627 B7R0.6 CC(=O)NCC(C)C 240690a_100000210953_100015343762 [1,0,1,0,0,0|1,0,0]=3 628 B7R0.6 CC(=O)NCC(C)C 527a_100000210953_100103153847 [1,0,1,0,0,0|1,0,0]=3 629 B7R0.6 CC(=O)NCC(C)O 11a_100000210904_100015343762 [1,0,1,0,0,0|2,0,0]=4 630 B7R0.6 CC(=O)NCC(C)O 240690a_100000210904_100015343762 [1,0,1,0,0,0|2,0,0]=4 631 B7R0.6 CC(=O)NCC(C)O 527a_100000210904_100103153847 [1,0,1,0,0,0|2,0,0]=4 632 B7R0.6 CC(=O)NNC(C)C 22a_100000741168_100000070787 [1,0,1,0,0,0|2,0,0]=4 633 B7R0.6 CC(=O)OCN(C)C 269982a_100102631434_100000076356 [1,0,1,0,0,0|2,0,0]=4 634 B7R0.6 CC(C)C=CC(=O)[13CH3] 1458a_100016268746_200025704644 [1,0,1,0,0,0|0,0,2]=4 635 B7R0.6 CC(C)CCC(=O)[13CH3] 1458a_100000181311_200025704644 [1,0,1,0,0,0|0,0,0]=2 636 B7R0.6 CC(C)CCN(C)C 2230a_100000742789_200000210301 [1,0,1,0,0,0|2,0,0]=4 637 B7R0.6 CC(C)CCN(C)C 2230a_100102631434_100000210312 [1,0,1,0,0,0|2,0,0]=4 638 B7R0.6 CC(C)CCN(C)C 269982a_100000742789_200000210301 [1,0,1,0,0,0|2,0,0]=4 639 B7R0.6 CC(C)CCN(C)C 269982a_100102631434_100000210312 [1,0,1,0,0,0|2,0,0]=4 640 B7R0.6 CC(C)CCN(C)[13CH3] 2230a_100000742789_200025704644 [1,0,1,0,0,0|2,0,0]=4 641 B7R0.6 CC(C)CCN(C)[13CH3] 269982a_100000742789_200025704644 [1,0,1,0,0,0|2,0,0]=4 642 B7R0.6 CC(C)NCC(=O)N 2230a_100000711301_100000210206 [1,0,1,0,0,0|1,0,0]=3 643 B7R0.6 CC(C)NCC(=O)N 2230a_100138425928_100000747473 [1,0,1,0,0,0|1,0,0]=3 644 B7R0.6 CC(C)NCC(=O)N 34a_100138425928_100000187820 [1,0,1,0,0,0|1,0,0]=3 645 B7R0.6 CC(C)NCC(=O)O 269956a_100016091260_100000210206 [1,0,1,0,0,0|2,0,0]=4 646 B7R0.6 CC(C)NCC(=O)[O-] 34a_100138425928_100020667443 [1,0,1,0,0,0|2,0,0]=4 647 B7R0.6 CC(C)OCC(=O)N 34a_100000212225_100000187820 [1,0,1,0,0,0|1,0,0]=3 648 B7R0.6 CC(C)OCC(=O)[13CH3] 1458a_100000745533_200025704644 [1,0,1,0,0,0|1,0,0]=3 649 B7R0.6 CC(C)OCC(=O)[O-] 34a_100000212225_100020667443 [1,0,1,0,0,0|2,0,0]=4 650 B7R0.6 CC(C)SCC(=O)N 62a_100000210206_100000747473 [1,0,1,0,0,0|1,0,0]=3 651 B7R0.6 CC(C)SCC(=O)N 62a_100000747473_100000210206 [1,0,1,0,0,0|1,0,0]=3 652 B7R0.6 CC(C)SCC(=O)[13CH3] 1458a_100000241585_200025704644 [1,0,1,0,0,0|1,0,0]=3 653 B7R0.6 CC(C)SCC(=O)[O-] 62a_100000210206_100020667443 [1,0,1,0,0,0|2,0,0]=4 654 B7R0.6 CC(C)SCC(=O)[O-] 62a_100020667443_100000210206 [1,0,1,0,0,0|2,0,0]=4 655 B7R0.6 CN(C)CCC(=O)N 2230a_100000730477_200000210301 [1,0,1,0,0,0|1,0,0]=3 656 B7R0.6 CN(C)CCC(=O)N 2230a_100102631434_100000744528 [1,0,1,0,0,0|1,0,0]=3 657 B7R0.6 CN(C)CCC(=O)N 269982a_100102631434_100000744528 [1,0,1,0,0,0|1,0,0]=3 658 B7R0.6 CN([13CH3])CCC(=O)N 2230a_100000730477_200025704644 [1,0,1,0,0,0|1,0,0]=3 659 B7R0.6 C[S+](C)CCC(=O)[13CH3] 1458a_100009452791_200025704644 [1,0,1,0,0,0|1,0,0]=3 660 B7R0.6 [13CH3]C(=O)CCC(=O)N 1458a_100011215257_200025704644 [1,0,1,0,0,0|1,0,1]=4 661 B7R0.11 C=CCC(C)(C)OC 7a_100011995686_200000210301 [1,0,1,0,0,0|1,0,1]=4 662 B7R0.11 C=CCC(C)(C)O[13CH3] 7a_100011995686_200025704644 [1,0,1,0,0,0|1,0,1]=4 663 B7R0.11 CC(C)(CCBr)O[13CH3] 7a_100000702414_200025704644 [1,0,1,0,0,0|2,0,0]=4 664 B7R0.11 CCCC(C)(C)OC 7a_100000748436_200000210301 [1,0,1,0,0,0|1,0,1]=4 665 B7R0.11 CCCC(C)(C)O[13CH3] 7a_100000748436_200025704644 [1,0,1,0,0,0|1,0,1]=4 666 B7R0.11 CCNC(C)(C)CC 2230a_100000211385_100000210202 [1,0,1,0,0,0|1,0,1]=4 667 B7R0.11 CNC(C)(C)COC 2230a_100000752728_200000210301 [1,0,1,0,0,0|1,0,1]=4 668 B7R0.11 CNC(C)(C)CSC 2230a_100000759623_200000210301 [1,0,1,0,0,0|1,0,1]=4 669 B7R0.11 CNC(C)(C)CSC 7a_100000759623_200000210301 [1,0,1,0,0,0|1,0,1]=4 670 B7R0.11 COC(C)(C)CCBr 7a_100000702414_200000210301 [1,0,1,0,0,0|2,0,0]=4 671 B7R0.11 COCC(C)(C)N[13CH3] 2230a_100000752728_200025704644 [1,0,1,0,0,0|1,0,1]=4 672 B7R0.11 CSCC(C)(C)N[13CH3] 2230a_100000759623_200025704644 [1,0,1,0,0,0|1,0,1]=4 673 B7R0.11 CSCC(C)(C)N[13CH3] 7a_100000759623_200025704644 [1,0,1,0,0,0|1,0,1]=4 674 B7R0.13 CC(=O)C(C)(C)CF 1458a_100000138116_200000210301 [1,0,1,0,0,0|2,0,0]=4 675 B7R0.13 CC(=O)C(C)(C)CO 1458a_100000749806_200000210301 [1,0,1,0,0,0|2,0,0]=4 676 B7R0.13 CC(=O)C(C)(C)O[13CH3] 34a_100000747739_200025704644 [1,0,1,0,0,0|2,0,0]=4 677 B7R0.13 CC(=O)C(C)(C)O[13CH3] 7a_100000747739_200025704644 [1,0,1,0,0,0|2,0,0]=4 678 B7R0.13 CC(=O)C(C)(C)S[13CH3] 62a_100000075568_200025704644 [1,0,1,0,0,0|2,0,0]=4 679 B7R0.13 CC(=O)C(C)(C)S[13CH3] 62a_200025704644_100000075568 [1,0,1,0,0,0|2,0,0]=4 680 B7R0.13 CC(C)(CF)C(=O)[13CH3] 1458a_100000138116_200025704644 [1,0,1,0,0,0|2,0,0]=4 681 B7R0.13 CC(C)(CO)C(=O)[13CH3] 1458a_100000749806_200025704644 [1,0,1,0,0,0|2,0,0]=4 682 B7R0.13 CCC(C)(C)C(=O)C 1458a_100000749717_200000210301 [1,0,1,0,0,0|1,0,0]=3 683 B7R0.13 CCC(C)(C)C(=O)[13CH3] 1458a_100000749717_200025704644 [1,0,1,0,0,0|1,0,0]=3 684 B7R0.13 CCC(C)(C)N(C)C 2230a_200000755171_200000210301 [1,0,1,0,0,0|0,0,1]=3 685 B7R0.13 CCC(C)(C)N(C)C 269982a_100102631434_100000032637 [1,0,1,0,0,0|0,0,1]=3 686 B7R0.13 CCC(C)(C)N(C)C 269982a_200000755171_200000210301 [1,0,1,0,0,0|0,0,1]=3 687 B7R0.13 CCC(C)(C)N(C)[13CH3] 2230a_200000755171_200025704644 [1,0,1,0,0,0|0,0,1]=3 688 B7R0.13 CCC(C)(C)N(C)[13CH3] 269982a_200000755171_200025704644 [1,0,1,0,0,0|0,0,1]=3 689 B7R0.13 CCC(C)(O)C(=O)C 1458a_100011219770_200000210301 [1,0,1,0,0,0|2,0,0]=4 690 B7R0.13 CCC(C)(O)C(=O)[13CH3] 1458a_100011219770_200025704644 [1,0,1,0,0,0|2,0,0]=4 691 B7R0.13 CN(C)C(C)(C)CO 269982a_100015204102_200000210301 [1,0,1,0,0,0|1,0,1]=4 692 B7R0.13 CN(C)C(C)(C)S[13CH3] 62a_200025704644_217856628674 [1,0,1,0,0,0|1,0,1]=4 693 B7R0.13 CN(C)C(C)(C)S[13CH3] 62a_217856628674_200025704644 [1,0,1,0,0,0|1,0,1]=4 694 B7R0.13 CN([13CH3])C(C)(C)CO 269982a_100015204102_200025704644 [1,0,1,0,0,0|1,0,1]=4 695 B7R0.13 CNC(C)(C)C(=O)C 7a_106832991635_100000075568 [1,0,1,0,0,0|2,0,0]=4 696 B7R0.13 COC(C)(C)C(=O)C 1458a_100000753492_200000210301 [1,0,1,0,0,0|2,0,0]=4 697 B7R0.13 COC(C)(C)C(=O)C 34a_100000747739_200000210301 [1,0,1,0,0,0|2,0,0]=4 698 B7R0.13 COC(C)(C)C(=O)C 7a_100000747739_200000210301 [1,0,1,0,0,0|2,0,0]=4 699 B7R0.13 COC(C)(C)C(=O)[13CH3] 1458a_100000753492_200025704644 [1,0,1,0,0,0|2,0,0]=4 700 B7R0.13 CSC(C)(C)C(=O)C 62a_100000075568_200000210301 [1,0,1,0,0,0|2,0,0]=4 701 B7R0.13 CSC(C)(C)C(=O)C 62a_200000210301_100000075568 [1,0,1,0,0,0|2,0,0]=4 702 B7R0.13 CSC(C)(C)N(C)C 62a_200000210301_217856628674 [1,0,1,0,0,0|1,0,1]=4 703 B7R0.13 CSC(C)(C)N(C)C 62a_217856628674_200000210301 [1,0,1,0,0,0|1,0,1]=4 704 B7R0.14 CCN(C)C(C)(C)C 2230a_100011200764_200000210301 [1,0,1,0,0,0|0,0,1]=3 705 B7R0.14 CCN(C)C(C)(C)C 269982a_100000225621_100000210625 [1,0,1,0,0,0|0,0,1]=3 706 B7R0.14 CCN(C)C(C)(C)C 269982a_100011200764_200000210301 [1,0,1,0,0,0|0,0,1]=3 707 B7R0.14 CCN(C)C(C)(C)C 269982a_100011215553_100000204670 [1,0,1,0,0,0|0,0,1]=3 708 B7R0.14 CCN([13CH3])C(C)(C)C 2230a_100011200764_200025704644 [1,0,1,0,0,0|0,0,1]=3 709 B7R0.14 CCN([13CH3])C(C)(C)C 269982a_100011200764_200025704644 [1,0,1,0,0,0|0,0,1]=3 710 B7R0.14 CN(CF)C(C)(C)C 269982a_100011215553_100015361967 [1,0,1,0,0,0|1,0,1]=4 711 B7R0.14 CN[C@H](C)C(C)(C)C 2230a_100025703359_200000210301 [1,0,1,0,0,0|2,0,0]=4 712 B7R0.14 C[C@@H](N[13CH3])C(C)(C)C 2230a_100025703359_200025704644 [1,0,1,0,0,0|2,0,0]=4 713 B7R0.8 C=CCNC(C)(C)C 2230a_100000715429_100000210623 [1,0,1,0,0,0|2,0,0]=4 714 B7R0.8 C=CCOC(C)(C)C 34a_100015890283_100015514636 [1,0,1,0,0,0|2,0,0]=4 715 B7R0.8 C=CCOC(C)(C)C 34a_200000210373_100000210625 [1,0,1,0,0,0|2,0,0]=4 716 B7R0.8 C=CCOC(C)(C)C 7a_100015890283_100015514636 [1,0,1,0,0,0|2,0,0]=4 717 B7R0.8 C=CCSC(C)(C)C 62a_100000210623_100000211941 [1,0,1,0,0,0|2,0,0]=4 718 B7R0.8 C=CCSC(C)(C)C 62a_100000211941_100000210623 [1,0,1,0,0,0|2,0,0]=4 719 B7R0.8 CC(C)(C)CCN[13CH3] 2230a_100000738805_200025704644 [1,0,1,0,0,0|2,0,0]=4 720 B7R0.8 CC(C)(C)CCO[13CH3] 7a_100000765024_200025704644 [1,0,1,0,0,0|2,0,0]=4 721 B7R0.8 CC(C)(C)CCS[13CH3] 62a_100000755188_200025704644 [1,0,1,0,0,0|2,0,0]=4 722 B7R0.8 CC(C)(C)CCS[13CH3] 62a_200025704644_100000755188 [1,0,1,0,0,0|2,0,0]=4 723 B7R0.8 CC(C)(C)NCC=O 2230a_100000715429_200015260668 [1,0,1,0,0,0|1,0,0]=3 724 B7R0.8 CC(C)(C)OCC=O 34a_100015890283_200009817547 [1,0,1,0,0,0|1,0,0]=3 725 B7R0.8 CC(C)(C)OCC=O 7a_100015890283_200015260668 [1,0,1,0,0,0|1,0,0]=3 726 B7R0.8 CC(C)(C)SCC=O 62a_100000211941_200015260668 [1,0,1,0,0,0|1,0,0]=3 727 B7R0.8 CC(C)(C)SCC=O 62a_200015260668_100000211941 [1,0,1,0,0,0|1,0,0]=3 728 B7R0.8 CNCCC(C)(C)C 2230a_100000738805_200000210301 [1,0,1,0,0,0|2,0,0]=4 729 B7R0.8 CNCCC(C)(C)C 2230a_106832991635_100000755188 [1,0,1,0,0,0|2,0,0]=4 730 B7R0.8 CNCCC(C)(C)C 34a_100102657272_100000755188 [1,0,1,0,0,0|2,0,0]=4 731 B7R0.8 CNCCC(C)(C)C 7a_106832991635_100000755188 [1,0,1,0,0,0|2,0,0]=4 732 B7R0.8 COCCC(C)(C)C 34a_100138415774_100000755188 [1,0,1,0,0,0|2,0,0]=4 733 B7R0.8 COCCC(C)(C)C 7a_100000765024_200000210301 [1,0,1,0,0,0|2,0,0]=4 734 B7R0.8 CSCCC(C)(C)C 62a_100000755188_200000210301 [1,0,1,0,0,0|2,0,0]=4 735 B7R0.8 CSCCC(C)(C)C 62a_200000210301_100000755188 [1,0,1,0,0,0|2,0,0]=4 736 B7R0.9 CC(=O)CC(C)(C)C 1458a_100000211214_200000210301 [1,0,1,0,0,0|1,0,0]=3 737 B7R0.9 CC(=O)CC(C)(C)O 1458a_100000693243_200000210301 [1,0,1,0,0,0|2,0,0]=4 738 B7R0.9 CC(=O)C[N+](C)(C)C 1458a_100000033712_200000210301 [1,0,1,0,0,0|2,0,0]=4 739 B7R0.9 CC(=O)C[Si](C)(C)C 1458a_100000070787_100000233785 [1,0,1,0,0,0|1,1,0]=4 740 B7R0.9 CC(=O)C[Si](C)(C)C 1458a_100011218504_200000210301 [1,0,1,0,0,0|1,1,0]=4 741 B7R0.9 CC(=O)NC(C)(C)C 11a_100000715429_100015343762 [1,0,1,0,0,0|0,0,0]=2 742 B7R0.9 CC(=O)NC(C)(C)C 1626a_100000715429_100015343762 [1,0,1,0,0,0|0,0,0]=2 743 B7R0.9 CC(=O)NC(C)(C)C 240690a_100000715429_100015343762 [1,0,1,0,0,0|0,0,0]=2 744 B7R0.9 CC(=O)NC(C)(C)C 527a_100000715429_100103153847 [1,0,1,0,0,0|0,0,0]=2 745 B7R0.9 CC(C)(C)CC(=O)[13CH3] 1458a_100000211214_200025704644 [1,0,1,0,0,0|1,0,0]=3 746 B7R0.9 CC(C)(O)CC(=O)[13CH3] 1458a_100000693243_200025704644 [1,0,1,0,0,0|2,0,0]=4 747 B7R0.9 CC(C)NC(C)(C)C 2230a_100000715429_100000210206 [1,0,1,0,0,0|1,0,1]=4 748 B7R0.9 CC(C)NC(C)(C)C 34a_100138425928_100000210625 [1,0,1,0,0,0|1,0,1]=4 749 B7R0.9 C[N+](C)(C)CC(=O)[13CH3] 1458a_100000033712_200025704644 [1,0,1,0,0,0|2,0,0]=4 750 B7R0.9 C[Si](C)(C)CC(=O)[13CH3] 1458a_100011218504_200025704644 [1,0,1,0,0,0|1,1,0]=4 751 B7R1.4 CC1SCCN1C 2230a_200011216479_200000210301 [2,0,0,0,0,0|1,0,1]=4 752 B7R1.4 CC1SCCN1C 269982a_200011216479_200000210301 [2,0,0,0,0,0|1,0,1]=4 753 B7R1.4 CC1SCCN1C 34a_200011216479_200000210301 [2,0,0,0,0,0|1,0,1]=4 754 B7R1.4 CC1SCCN1[13CH3] 2230a_200011216479_200025704644 [2,0,0,0,0,0|1,0,1]=4 755 B7R1.4 CC1SCCN1[13CH3] 269982a_200011216479_200025704644 [2,0,0,0,0,0|1,0,1]=4 756 B7R1.4 CC1SCCN1[13CH3] 34a_200011216479_200025704644 [2,0,0,0,0,0|1,0,1]=4 757 B7R1.4 C[C@@H]1CCCN1C 2230a_100015189458_200000210301 [2,0,0,0,0,0|0,0,1]=3 758 B7R1.4 C[C@@H]1CCCN1C 269982a_100015189458_200000210301 [2,0,0,0,0,0|0,0,1]=3 759 B7R1.4 C[C@@H]1CCCN1C 34a_100015189458_200000210301 [2,0,0,0,0,0|0,0,1]=3 760 B7R1.4 C[C@@H]1CCCN1[13CH3] 2230a_100015189458_200025704644 [2,0,0,0,0,0|0,0,1]=3 761 B7R1.4 C[C@@H]1CCCN1[13CH3] 269982a_100015189458_200025704644 [2,0,0,0,0,0|0,0,1]=3 762 B7R1.4 C[C@@H]1CCCN1[13CH3] 34a_100015189458_200025704644 [2,0,0,0,0,0|0,0,1]=3 763 B7R1.4 C[C@H]1CCCN1C 2230a_100020605311_200000210301 [2,0,0,0,0,0|0,0,1]=3 764 B7R1.4 C[C@H]1CCCN1C 269982a_100020605311_200000210301 [2,0,0,0,0,0|0,0,1]=3 765 B7R1.4 C[C@H]1CCCN1[13CH3] 2230a_100020605311_200025704644 [2,0,0,0,0,0|0,0,1]=3 766 B7R1.4 C[C@H]1CCCN1[13CH3] 269982a_100020605311_200025704644 [2,0,0,0,0,0|0,0,1]=3 767 B9R0.6 C#CCC(=O)C(C)C(C)C 1458a_100000755409_100000184674 [0,1,1,0,0,0|1,0,1]=4 768 B9R0.6 C#CCC(=O)N(C)C(C)C 1626a_200000211004_100011220946 [0,1,1,0,0,0|0,0,1]=3 769 B9R0.6 C#CCC(=O)N(C)C(C)C 527a_200000211004_100011220946 [0,1,1,0,0,0|0,0,1]=3 770 B9R0.6 C=CCC(=O)C(C)C(C)C 1458a_100000755409_100000210623 [0,1,1,0,0,0|1,0,1]=4 771 B9R0.6 C=CCC(=O)N(C)C(C)C 11a_200000211004_100000210193 [0,1,1,0,0,0|0,0,1]=3 772 B9R0.6 C=CCC(=O)N(C)C(C)C 1626a_200000211004_100000210193 [0,1,1,0,0,0|0,0,1]=3 773 B9R0.6 C=CCC(=O)N(C)C(C)C 240690a_200000211004_100000210193 [0,1,1,0,0,0|0,0,1]=3 774 B9R0.6 C=CCC(=O)N(C)C(C)C 527a_200000211004_100000210193 [0,1,1,0,0,0|0,0,1]=3 775 B9R0.6 CC(C)C(C)C(=O)CC#N 1458a_100000755409_100011214920 [0,1,1,0,0,0|1,0,1]=4 776 B9R0.6 CC(C)C(C)C(=O)CCF 1458a_100000755409_100011217306 [0,1,1,0,0,0|1,0,0]=3 777 B9R0.6 CC(C)C(C)C(=O)CCO 1458a_100000755409_100000211926 [0,1,1,0,0,0|1,0,0]=3 778 B9R0.6 CC(C)N(C)C(=O)C=CBr 1626a_200000211004_100016273825 [0,1,1,0,0,0|0,0,2]=4 779 B9R0.6 CC(C)N(C)C(=O)C=CBr 240690a_200000211004_100016273825 [0,1,1,0,0,0|0,0,2]=4 780 B9R0.6 CC(C)N(C)C(=O)C=CCl 11a_200000211004_200016279998 [0,1,1,0,0,0|0,0,2]=4 781 B9R0.6 CC(C)N(C)C(=O)C=CCl 1626a_200000211004_200016279998 [0,1,1,0,0,0|0,0,2]=4 782 B9R0.6 CC(C)N(C)C(=O)C=CCl 240690a_200000211004_200016279998 [0,1,1,0,0,0|0,0,2]=4 783 B9R0.6 CC(C)N(C)C(=O)C=CI 1626a_200000211004_100016256311 [0,1,1,0,0,0|0,0,2]=4 784 B9R0.6 CC(C)N(C)C(=O)CC#N 1626a_200000211004_100051588842 [0,1,1,0,0,0|0,0,1]=3 785 B9R0.6 CC(C)N(C)C(=O)CC#N 240690a_200000211004_100051588842 [0,1,1,0,0,0|0,0,1]=3 786 B9R0.6 CC(C)N(C)C(=O)CCO 240690a_200000211004_100011216618 [0,1,1,0,0,0|0,0,0]=2 787 B9R0.6 CC(C)N(C)C(=O)CS[13CH3] 62a_100000230190_200025704644 [0,1,1,0,0,0|0,0,0]=2 788 B9R0.6 CC(C)N(C)C(=O)CS[13CH3] 62a_200025704644_100000230190 [0,1,1,0,0,0|0,0,0]=2 789 B9R0.6 CC(C)N(C)C(C)CCO 2230a_100000731037_100000210206 [0,1,1,0,0,0|1,0,1]=4 790 B9R0.6 CC(C)N(C)C(C)CCO 269982a_100000731037_100000210206 [0,1,1,0,0,0|1,0,1]=4 791 B9R0.6 CC(C)N(C)C(C)CCO 269982a_200000211004_100009893172 [0,1,1,0,0,0|1,0,1]=4 792 B9R0.6 CC(C)[C@@H](O)C(=O)CCF 1458a_100000691806_100011217306 [0,1,1,0,0,0|2,0,0]=4 793 B9R0.6 CC(C)[C@@H](O)C(=O)CCO 1458a_100000691806_100000211926 [0,1,1,0,0,0|2,0,0]=4 794 B9R0.6 CC=CC(=O)N(C)C(C)C 11a_200000211004_100000210699 [0,1,1,0,0,0|0,0,1]=3 795 B9R0.6 CC=CC(=O)N(C)C(C)C 1626a_200000211004_100000210699 [0,1,1,0,0,0|0,0,1]=3 796 B9R0.6 CC=CC(=O)N(C)C(C)C 240690a_200000211004_100000210699 [0,1,1,0,0,0|0,0,1]=3 797 B9R0.6 CCCC(=O)C(C)C(C)C 1458a_100000755409_100000210303 [0,1,1,0,0,0|1,0,0]=3 798 B9R0.6 CCCC(=O)N(C)C(C)C 11a_200000211004_100000211992 [0,1,1,0,0,0|0,0,0]=2 799 B9R0.6 CCCC(=O)N(C)C(C)C 1626a_200000211004_100000211992 [0,1,1,0,0,0|0,0,0]=2 800 B9R0.6 CCCC(=O)N(C)C(C)C 240690a_200000211004_100000211992 [0,1,1,0,0,0|0,0,0]=2 801 B9R0.6 CCCC(=O)N(C)C(C)C 527a_200000211004_100000211992 [0,1,1,0,0,0|0,0,0]=2 802 B9R0.6 CCCC(=O)[C@H](C)N(C)C 1458a_100009822176_100000210303 [0,1,1,0,0,0|2,0,0]=4 803 B9R0.6 CCCC(=O)[C@H](O)C(C)C 1458a_100000691806_100000210303 [0,1,1,0,0,0|2,0,0]=4 804 B9R0.6 CCCC(C)N(C)C(C)C 269982a_200000211004_100000766640 [0,1,1,0,0,0|1,0,1]=4 805 B9R0.6 CCCC(C)N(C)C(C)C 270004a_200000211004_100000211909 [0,1,1,0,0,0|1,0,1]=4 806 B9R0.6 CCNC(=O)C(=O)C(C)C 1458a_200011297158_100000210206 [0,1,1,0,0,0|2,0,0]=4 807 B9R0.6 CCNC(=O)C(C)C(C)C 11a_100015525214_100000755409 [0,1,1,0,0,0|1,0,0]=3 808 B9R0.6 CCNC(=O)C(C)C(C)C 240690a_100015525214_100000755409 [0,1,1,0,0,0|1,0,0]=3 809 B9R0.6 CCNC(=O)C(C)C(C)C 527a_100015525214_100000755409 [0,1,1,0,0,0|1,0,0]=3 810 B9R0.6 CCNC(=O)C(C)N(C)C 2230a_100102631434_100000230173 [0,1,1,0,0,0|2,0,0]=4 811 B9R0.6 CCNC(=O)C(C)N(C)C 269982a_100102631434_100000230173 [0,1,1,0,0,0|2,0,0]=4 812 B9R0.6 CCNC(=O)N(C)C(C)C 2708a_100015525214_200000211004 [0,1,1,0,0,0|0,0,0]=2 813 B9R0.6 CCNC(=O)N(C)C(C)C 273464a_100015525214_200000211004 [0,1,1,0,0,0|0,0,0]=2 814 B9R0.6 CCNC(=O)[C@H](C)N(C)C 240690a_100015525214_100009822176 [0,1,1,0,0,0|2,0,0]=4 815 B9R0.6 CCNC(=O)[C@H](C)N(C)C 527a_100015525214_100009822176 [0,1,1,0,0,0|2,0,0]=4 816 B9R0.6 CCNC(=O)[C@H](O)C(C)C 240690a_100015525214_100000691806 [0,1,1,0,0,0|2,0,0]=4 817 B9R0.6 CCOC(=O)C(C)N(C)C 2230a_100102631434_100011215307 [0,1,1,0,0,0|2,0,0]=4 818 B9R0.6 CCOC(=O)C(C)N(C)C 269982a_100102631434_100011216346 [0,1,1,0,0,0|2,0,0]=4 819 B9R0.6 CNCC(=O)N(C)C(C)C 2230a_106832991635_100000230190 [0,1,1,0,0,0|0,0,0]=2 820 B9R0.6 CNCC(=O)N(C)C(C)C 34a_100102657272_100000230190 [0,1,1,0,0,0|0,0,0]=2 821 B9R0.6 CNCC(=O)N(C)C(C)C 7a_106832991635_100000230190 [0,1,1,0,0,0|0,0,0]=2 822 B9R0.6 CNNC(=O)C(C)C(C)C 22a_100016993582_100000755409 [0,1,1,0,0,0|2,0,0]=4 823 B9R0.6 COCC(=O)N(C)C(C)C 11a_200000211004_100000210968 [0,1,1,0,0,0|0,0,0]=2 824 B9R0.6 COCC(=O)N(C)C(C)C 1626a_200000211004_100000210968 [0,1,1,0,0,0|0,0,0]=2 825 B9R0.6 COCC(=O)N(C)C(C)C 240690a_200000211004_100000210968 [0,1,1,0,0,0|0,0,0]=2 826 B9R0.6 COCC(=O)N(C)C(C)C 34a_100138415774_100000230190 [0,1,1,0,0,0|0,0,0]=2 827 B9R0.6 COCC(=O)N(C)C(C)C 527a_200000211004_100000210968 [0,1,1,0,0,0|0,0,0]=2 828 B9R0.6 COCC(C)N(C)C(C)C 269982a_200000211004_100000765312 [0,1,1,0,0,0|1,0,1]=4 829 B9R0.6 COCC(C)N(C)C(C)C 270004a_200000211004_100000749346 [0,1,1,0,0,0|1,0,1]=4 830 B9R0.6 CSCC(=O)N(C)C(C)C 11a_200000211004_100000184570 [0,1,1,0,0,0|0,0,0]=2 831 B9R0.6 CSCC(=O)N(C)C(C)C 1626a_200000211004_100000184570 [0,1,1,0,0,0|0,0,0]=2 832 B9R0.6 CSCC(=O)N(C)C(C)C 240690a_200000211004_100000184570 [0,1,1,0,0,0|0,0,0]=2 833 B9R0.6 CSCC(=O)N(C)C(C)C 527a_200000211004_100000184570 [0,1,1,0,0,0|0,0,0]=2 834 B9R0.6 CSCC(=O)N(C)C(C)C 62a_100000230190_200000210301 [0,1,1,0,0,0|0,0,0]=2 835 B9R0.6 CSCC(=O)N(C)C(C)C 62a_200000210301_100000230190 [0,1,1,0,0,0|0,0,0]=2 836 B9R0.6 CSCC(C)N(C)C(C)C 270004a_200000211004_100011216314 [0,1,1,0,0,0|1,0,1]=4 837 B9R0.6 C[C@@H](C(=O)CCF)N(C)C 1458a_100009822176_100011217306 [0,1,1,0,0,0|2,0,0]=4 838 B9R0.6 C[C@@H](C(=O)CCO)N(C)C 1458a_100009822176_100000211926 [0,1,1,0,0,0|2,0,0]=4 839 B9R0.25 C=CC(=O)N(C)C(C)(C)C 1626a_100011215553_100000185746 [0,1,1,0,0,0|0,0,2]=4 840 B9R0.25 C=CC(=O)N(C)C(C)(C)C 240690a_100011215553_200121576911 [0,1,1,0,0,0|0,0,2]=4 841 B9R0.25 CCC(=O)N(C)C(C)(C)C 11a_100011215553_100000210414 [0,1,1,0,0,0|0,0,0]=2 842 B9R0.25 CCC(=O)N(C)C(C)(C)C 1626a_100011215553_100000210414 [0,1,1,0,0,0|0,0,0]=2 843 B9R0.25 CCC(=O)N(C)C(C)(C)C 240690a_100011215553_100000210414 [0,1,1,0,0,0|0,0,0]=2 844 B9R0.25 CCC(=O)[C@@H](O)C(C)(C)C 1458a_100009816492_100000210202 [0,1,1,0,0,0|2,0,0]=4 845 B9R0.25 CCC(C)N(C)C(C)(C)C 269982a_100000741768_100000210625 [0,1,1,0,0,0|1,0,1]=4 846 B9R0.25 CCC(C)N(C)C(C)(C)C 269982a_100011215553_100000758301 [0,1,1,0,0,0|1,0,1]=4 847 B9R0.25 CN(C(=O)CO)C(C)(C)C 240690a_100011215553_100000210174 [0,1,1,0,0,0|1,0,0]=3 848 B9R0.25 CNC(=O)N(C)C(C)(C)C 2708a_100102657272_100011215553 [0,1,1,0,0,0|1,0,0]=3 849 B9R0.25 CNC(=O)N(C)C(C)(C)C 273464a_100102657272_100011215553 [0,1,1,0,0,0|1,0,0]=3 850 B9R0.27 C=CC(=O)N(C)C(C)CC 1626a_100000741768_100000185746 [0,1,1,0,0,0|0,0,2]=4 851 B9R0.27 C=CC(=O)N(C)C(C)CC 240690a_100000741768_200121576911 [0,1,1,0,0,0|0,0,2]=4 852 B9R0.27 C=CC(=O)N(C)C(C)CO 240690a_100000693034_200121576911 [0,1,1,0,0,0|0,0,2]=4 853 B9R0.27 CC(C#N)N(C)C(=O)CO 527a_100000745055_100000210174 [0,1,1,0,0,0|1,0,1]=4 854 B9R0.27 CC(CO)N(C)C(=O)CO 240690a_100000693034_100000210174 [0,1,1,0,0,0|1,0,0]=3 855 B9R0.27 CC(CO)N(C)C(=O)CO 527a_100000693034_100000210174 [0,1,1,0,0,0|1,0,0]=3 856 B9R0.27 CCC(=O)C(C)N(C)CC 1458a_100011281945_100000210202 [0,1,1,0,0,0|2,0,0]=4 857 B9R0.27 CCC(=O)C(C)N(C)CC 2230a_100000225621_100000742827 [0,1,1,0,0,0|2,0,0]=4 858 B9R0.27 CCC(=O)C(C)N(C)CC 269982a_100000225621_100000742827 [0,1,1,0,0,0|2,0,0]=4 859 B9R0.27 CCC(=O)N(C)C(C)C#N 11a_100000745055_100000210414 [0,1,1,0,0,0|0,0,1]=3 860 B9R0.27 CCC(=O)N(C)C(C)C#N 1626a_100000745055_100000210414 [0,1,1,0,0,0|0,0,1]=3 861 B9R0.27 CCC(=O)N(C)C(C)C#N 527a_100000745055_100000210414 [0,1,1,0,0,0|0,0,1]=3 862 B9R0.27 CCC(=O)N(C)C(C)CC 11a_100000741768_100000210414 [0,1,1,0,0,0|0,0,0]=2 863 B9R0.27 CCC(=O)N(C)C(C)CC 1626a_100000741768_100000210414 [0,1,1,0,0,0|0,0,0]=2 864 B9R0.27 CCC(=O)N(C)C(C)CC 240690a_100000741768_100000210414 [0,1,1,0,0,0|0,0,0]=2 865 B9R0.27 CCC(=O)N(C)C(C)CC 527a_100000741768_100000210414 [0,1,1,0,0,0|0,0,0]=2 866 B9R0.27 CCC(=O)N(C)C(C)CO 240690a_100000693034_100000210414 [0,1,1,0,0,0|0,0,0]=2 867 B9R0.27 CCC(=O)N(C)C(C)CO 527a_100000693034_100000210414 [0,1,1,0,0,0|0,0,0]=2 868 B9R0.27 CCC(C)N(C)C(=O)CO 240690a_100000741768_100000210174 [0,1,1,0,0,0|1,0,0]=3 869 B9R0.27 CCC(C)N(C)C(=O)CO 527a_100000741768_100000210174 [0,1,1,0,0,0|1,0,0]=3 870 B9R0.27 CCC(C)N(C)C(=O)NC 2708a_100102657272_100000741768 [0,1,1,0,0,0|1,0,0]=3 871 B9R0.27 CCC(C)N(C)C(=O)NC 273464a_100102657272_100000741768 [0,1,1,0,0,0|1,0,0]=3 872 B9R0.27 CCC(C)N(C)C(C)CC 2230a_100000741768_100000758301 [0,1,1,0,0,0|1,0,1]=4 873 B9R0.27 CCC(C)N(C)C(C)CC 269982a_100000210998_200000210301 [0,1,1,0,0,0|1,0,1]=4 874 B9R0.27 CCC(C)N(C)C(C)CC 269982a_100000741768_100000758301 [0,1,1,0,0,0|1,0,1]=4 875 B9R0.27 CCC(C)N(C)C(C)CO 2230a_100000693034_100000758301 [0,1,1,0,0,0|1,0,1]=4 876 B9R0.27 CCC(C)N(C)C(C)CO 2230a_100000741768_100012180447 [0,1,1,0,0,0|1,0,1]=4 877 B9R0.27 CCC(C)N(C)C(C)CO 269982a_100000693034_100000758301 [0,1,1,0,0,0|1,0,1]=4 878 B9R0.27 CCC(C)N(C)C(C)OC 269982a_100000741768_100009879195 [0,1,1,0,0,0|1,0,1]=4 879 B9R0.27 CCC(C)N(C)[C@H](C)CO 269982a_100000741768_100016084084 [0,1,1,0,0,0|1,0,1]=4 880 B9R0.27 CCC(C)N([13CH3])C(C)CC 269982a_100000210998_200025704644 [0,1,1,0,0,0|1,0,1]=4 881 B9R0.27 CNC(=O)N(C)C(C)C#N 2708a_100102657272_100000745055 [0,1,1,0,0,0|1,0,1]=4 882 B9R0.27 CNC(=O)N(C)C(C)C#N 273464a_100102657272_100000745055 [0,1,1,0,0,0|1,0,1]=4 883 B9R0.27 CNC(=O)N(C)C(C)CO 2708a_100102657272_100000693034 [0,1,1,0,0,0|1,0,0]=3 884 B9R0.28 CCC(=O)C(C)(C)N(C)C 1458a_100000688961_100000210202 [0,1,1,0,0,0|2,0,0]=4 885 B9R0.29 C=CC(=O)N(CC)C(C)C 1626a_100000223864_100000185746 [0,1,1,0,0,0|0,0,2]=4 886 B9R0.29 C=CC(=O)N(CC)C(C)C 240690a_100000223864_200121576911 [0,1,1,0,0,0|0,0,2]=4 887 B9R0.29 CCC(=O)C(CC)N(C)C 1458a_100000689100_100000210202 [0,1,1,0,0,0|2,0,0]=4 888 B9R0.29 CCC(=O)N(CC)C(C)C 11a_100000223864_100000210414 [0,1,1,0,0,0|0,0,0]=2 889 B9R0.29 CCC(=O)N(CC)C(C)C 1626a_100000223864_100000210414 [0,1,1,0,0,0|0,0,0]=2 890 B9R0.29 CCC(=O)N(CC)C(C)C 240690a_100000223864_100000210414 [0,1,1,0,0,0|0,0,0]=2 891 B9R0.29 CCC(=O)N(CC)C(C)C 527a_100000223864_100000210414 [0,1,1,0,0,0|0,0,0]=2 892 B9R0.29 CCC(C)N(CC)C(C)C 2230a_100000223864_100000758301 [0,1,1,0,0,0|1,0,1]=4 893 B9R0.29 CCC(C)N(CC)C(C)C 2230a_100000732650_100000210206 [0,1,1,0,0,0|1,0,1]=4 894 B9R0.29 CCC(C)N(CC)C(C)C 269982a_100000223864_100000758301 [0,1,1,0,0,0|1,0,1]=4 895 B9R0.29 CCC(C)N(CC)C(C)C 269982a_100000732650_100000210206 [0,1,1,0,0,0|1,0,1]=4 896 B9R0.29 CCN(C(=O)CO)C(C)C 240690a_100000223864_100000210174 [0,1,1,0,0,0|1,0,0]=3 897 B9R0.29 CCN(C(=O)CO)C(C)C 527a_100000223864_100000210174 [0,1,1,0,0,0|1,0,0]=3 898 B9R0.29 CCN(C(=O)NC)C(C)C 2708a_100102657272_100000223864 [0,1,1,0,0,0|1,0,0]=3 899 B9R0.29 CCN(C(=O)NC)C(C)C 273464a_100102657272_100000223864 [0,1,1,0,0,0|1,0,0]=3 900 B9R0.29 CNC(=O)C(NC)C(C)C 2230a_100000690981_200000210301 [0,1,1,0,0,0|2,0,0]=4 901 B9R0.29 CNC(=O)C(NC)C(C)C 34a_100000690981_200000210301 [0,1,1,0,0,0|2,0,0]=4 902 B9R0.29 CNC(=O)C(N[13CH3])C(C)C 2230a_100000690981_200025704644 [0,1,1,0,0,0|2,0,0]=4 903 B9R0.29 CNC(=O)C(N[13CH3])C(C)C 34a_100000690981_200025704644 [0,1,1,0,0,0|2,0,0]=4 904 B9R0.29 CNC(C(=O)OC)C(C)C 2230a_106832991635_100000736125 [0,1,1,0,0,0|2,0,0]=4 905 B9R0.29 CNC(C(=O)OC)C(C)C 34a_100102657272_100000736125 [0,1,1,0,0,0|2,0,0]=4 906 B9R0.29 CNC(C(=O)OC)C(C)C 7a_106832991635_100000736125 [0,1,1,0,0,0|2,0,0]=4 907 B9R0.29 COC(=O)C(OC)C(C)C 34a_100138415774_100000736125 [0,1,1,0,0,0|2,0,0]=4 908 B9R0.29 COC(=O)C(SC)C(C)C 62a_100000736125_200000210301 [0,1,1,0,0,0|2,0,0]=4 909 B9R0.29 COC(=O)C(SC)C(C)C 62a_200000210301_100000736125 [0,1,1,0,0,0|2,0,0]=4 910 B9R0.29 COC(=O)C(S[13CH3])C(C)C 62a_100000736125_200025704644 [0,1,1,0,0,0|2,0,0]=4 911 B9R0.29 COC(=O)C(S[13CH3])C(C)C 62a_200025704644_100000736125 [0,1,1,0,0,0|2,0,0]=4 912 B9R0.29 COC(=O)[C@H](OC)C(C)C 34a_100009883636_200000210301 [0,1,1,0,0,0|2,0,0]=4 913 B9R0.29 COC(=O)[C@H](OC)C(C)C 7a_100009883636_200000210301 [0,1,1,0,0,0|2,0,0]=4 914 B9R0.29 COC(=O)[C@H](O[13CH3])C(C)C 34a_100009883636_200025704644 [0,1,1,0,0,0|2,0,0]=4 915 B9R0.29 COC(=O)[C@H](O[13CH3])C(C)C 7a_100009883636_200025704644 [0,1,1,0,0,0|2,0,0]=4 916 B9R0.32 CC(C)N(C)S(=O)(=O)CCl 270084a_200000211004_100000031410 [0,1,1,0,0,0|2,0,0]=4 917 B9R0.32 CC(C)N(C)S(=O)(=O)CCl 274078a_200000211004_100000031410 [0,1,1,0,0,0|2,0,0]=4 918 B9R0.32 CCC(C)(C)N(C)C(C)C 2230a_200000755171_100000210206 [0,1,1,0,0,0|1,0,1]=4 919 B9R0.32 CCC(C)(C)N(C)C(C)C 269982a_200000211004_100000032637 [0,1,1,0,0,0|1,0,1]=4 920 B9R0.32 CCC(C)(C)N(C)C(C)C 269982a_200000755171_100000210206 [0,1,1,0,0,0|1,0,1]=4 921 B9R0.32 CCS(=O)(=O)N(C)C(C)C 270084a_200000211004_100000211323 [0,1,1,0,0,0|1,0,0]=3 922 B9R0.32 CCS(=O)(=O)N(C)C(C)C 274078a_200000211004_100000211323 [0,1,1,0,0,0|1,0,0]=3 923 B9R0.32 CCS(=O)(=O)N(C)C(C)C 40a_200000211004_100000053943 [0,1,1,0,0,0|1,0,0]=3 924 B9R0.41 CCC(CC)N(C)C(C)C 2230a_100000737045_100000210206 [0,1,1,0,0,0|1,0,1]=4 925 B9R0.41 CCC(CC)N(C)C(C)C 269982a_100000737045_100000210206 [0,1,1,0,0,0|1,0,1]=4 926 B9R0.41 CCC(CC)N(C)C(C)C 269982a_200000211004_100000210505 [0,1,1,0,0,0|1,0,1]=4 927 B9R0.41 CCC(CC)N(C)C(C)C 270004a_200000211004_100000210860 [0,1,1,0,0,0|1,0,1]=4 928 B9R0.79 C=C(Br)C(=O)N(C)C(C)C 11a_200000211004_100009813364 [0,1,1,0,0,0|0,0,2]=4 929 B9R0.79 C=C(Br)C(=O)N(C)C(C)C 1626a_200000211004_100009813364 [0,1,1,0,0,0|0,0,2]=4 930 B9R0.79 C=C(C)C(=O)N(C)C(C)C 11a_200000211004_100000185857 [0,1,1,0,0,0|0,0,1]=3 931 B9R0.79 C=C(C)C(=O)N(C)C(C)C 1626a_200000211004_100000185857 [0,1,1,0,0,0|0,0,1]=3 932 B9R0.79 C=C(Cl)C(=O)N(C)C(C)C 11a_200000211004_100000039160 [0,1,1,0,0,0|0,0,2]=4 933 B9R0.79 C=C(Cl)C(=O)N(C)C(C)C 1626a_200000211004_100000039160 [0,1,1,0,0,0|0,0,2]=4 934 B9R0.79 C=C(F)C(=O)N(C)C(C)C 11a_200000211004_100000036797 [0,1,1,0,0,0|0,0,2]=4 935 B9R0.79 C=C(F)C(=O)N(C)C(C)C 1626a_200000211004_100000036797 [0,1,1,0,0,0|0,0,2]=4 936 B9R0.79 CC(C)C(=O)C(C)C(C)C 1458a_100000755409_100000210206 [0,1,1,0,0,0|1,0,0]=3 937 B9R0.79 CC(C)C(=O)C(C)N(C)C 2230a_100102631434_100009893295 [0,1,1,0,0,0|2,0,0]=4 938 B9R0.79 CC(C)C(=O)C(C)N(C)C 269982a_100102631434_100009893295 [0,1,1,0,0,0|2,0,0]=4 939 B9R0.79 CC(C)C(=O)N(C)C(C)C 11a_200000211004_100000210198 [0,1,1,0,0,0|0,0,0]=2 940 B9R0.79 CC(C)C(=O)N(C)C(C)C 1626a_200000211004_100000210198 [0,1,1,0,0,0|0,0,0]=2 941 B9R0.79 CC(C)C(=O)N(C)C(C)C 240690a_200000211004_100000210198 [0,1,1,0,0,0|0,0,0]=2 942 B9R0.79 CC(C)C(=O)N(C)C(C)C 527a_200000211004_100000210198 [0,1,1,0,0,0|0,0,0]=2 943 B9R0.79 CC(C)C(=O)[C@H](C)N(C)C 1458a_100009822176_100000210206 [0,1,1,0,0,0|2,0,0]=4 944 B9R0.79 CC(C)C(=O)[C@H](O)C(C)C 1458a_100000691806_100000210206 [0,1,1,0,0,0|2,0,0]=4 945 B9R0.79 CC(C)C(C)C(=O)N(C)C 11a_100102631434_100000755409 [0,1,1,0,0,0|2,0,0]=4 946 B9R0.79 CC(C)C(C)C(=O)N(C)C 1626a_100102631434_100000755409 [0,1,1,0,0,0|2,0,0]=4 947 B9R0.79 CC(C)C(C)C(=O)N(C)C 240690a_100102631434_100000755409 [0,1,1,0,0,0|2,0,0]=4 948 B9R0.79 CC(C)C(C)C(=O)N(C)C 527a_100102631434_100000755409 [0,1,1,0,0,0|2,0,0]=4 949 B9R0.79 CC(C)C(C)N(C)C(C)C 2230a_100000228512_100000210206 [0,1,1,0,0,0|1,0,1]=4 950 B9R0.79 CC(C)C(C)N(C)C(C)C 269982a_100000228512_100000210206 [0,1,1,0,0,0|1,0,1]=4 951 B9R0.79 CC(C)N(C)C(=O)C(=O)N 240690a_200000211004_100011215815 [0,1,1,0,0,0|1,0,1]=4 952 B9R0.79 CC(C)N(C)C(=O)C(F)F 11a_200000211004_100000210393 [0,1,1,0,0,0|1,0,0]=3 953 B9R0.79 CC(C)N(C)C(=O)C(F)F 1626a_200000211004_100000210393 [0,1,1,0,0,0|1,0,0]=3 954 B9R0.79 CC(C)N(C)C(=O)C(F)F 240690a_200000211004_100000210393 [0,1,1,0,0,0|1,0,0]=3 955 B9R0.79 CC(C)N(C)C(=O)C(F)F 527a_200000211004_100000210393 [0,1,1,0,0,0|1,0,0]=3 956 B9R0.79 CC(C)N(C)C(=O)C(O)O 240690a_200000211004_100000233687 [0,1,1,0,0,0|1,0,0]=3 957 B9R0.79 CC(C)N(C)C(=O)[C@@H](C)O 240690a_200000211004_100000717761 [0,1,1,0,0,0|0,0,0]=2 958 B9R0.79 CC(C)N(C)C(=O)[C@H](C)O 1626a_200000211004_217856618621 [0,1,1,0,0,0|0,0,0]=2 959 B9R0.79 CC(C)N(C)C(=O)[C@H](C)O 240690a_200000211004_217856618621 [0,1,1,0,0,0|0,0,0]=2 960 B9R0.79 CC(F)C(=O)N(C)C(C)C 11a_200000211004_100000062450 [0,1,1,0,0,0|0,0,0]=2 961 B9R0.79 CC(F)C(=O)N(C)C(C)C 1626a_200000211004_100000062450 [0,1,1,0,0,0|0,0,0]=2 962 B9R0.79 CC(F)C(=O)N(C)C(C)C 240690a_200000211004_100000062450 [0,1,1,0,0,0|0,0,0]=2 963 B9R0.79 CC(F)C(=O)N(C)C(C)C 527a_200000211004_100000062450 [0,1,1,0,0,0|0,0,0]=2 964 B9R0.7 C=C(C)C(=O)CCC(C)C 1458a_100000185857_100000210312 [0,1,1,0,0,0|1,0,0]=3 965 B9R0.7 C=C(C)C(=O)CCC(C)O 1458a_100000185857_100012276601 [0,1,1,0,0,0|2,0,0]=4 966 B9R0.7 C=C(C)C(=O)NCC(C)C 11a_100000210953_100000185857 [0,1,1,0,0,0|2,0,0]=4 967 B9R0.7 C=C(C)C(=O)NCC(C)C 1626a_100000210953_100000185857 [0,1,1,0,0,0|2,0,0]=4 968 B9R0.7 C=C(C)CCC(=O)N(C)C 11a_100102631434_200000688413 [0,1,1,0,0,0|0,0,2]=4 969 B9R0.7 C=C(C)CCC(=O)N(C)C 1626a_100102631434_200000688413 [0,1,1,0,0,0|0,0,2]=4 970 B9R0.7 C=C(C)CCC(=O)N(C)C 240690a_100102631434_200000688413 [0,1,1,0,0,0|0,0,2]=4 971 B9R0.7 C=C(C)CCC(=O)N(C)C 527a_100102631434_200000688413 [0,1,1,0,0,0|0,0,2]=4 972 B9R0.7 CC(=CCC(=O)N(C)C)C 11a_100102631434_100011220947 [0,1,1,0,0,0|0,0,2]=4 973 B9R0.7 CC(=CCC(=O)N(C)C)C 1626a_100102631434_100011220947 [0,1,1,0,0,0|0,0,2]=4 974 B9R0.7 CC(=CCC(=O)N(C)C)C 240690a_100102631434_100011220947 [0,1,1,0,0,0|0,0,2]=4 975 B9R0.7 CC(=CCC(=O)N(C)C)C 527a_100102631434_100011220947 [0,1,1,0,0,0|0,0,2]=4 976 B9R0.7 CC(=O)C(=O)CNC(C)C 34a_100138425928_100011261029 [0,1,1,0,0,0|2,0,0]=4 977 B9R0.7 CC(=O)C(=O)COC(C)C 34a_100000212225_100011261029 [0,1,1,0,0,0|2,0,0]=4 978 B9R0.7 CC(=O)C(=O)CSC(C)C 62a_100000210206_100011261029 [0,1,1,0,0,0|2,0,0]=4 979 B9R0.7 CC(=O)C(=O)CSC(C)C 62a_100011261029_100000210206 [0,1,1,0,0,0|2,0,0]=4 980 B9R0.7 CC(=O)C(=O)NCC(C)C 1458a_200011297155_200000210301 [0,1,1,0,0,0|2,0,0]=4 981 B9R0.7 CC(=O)CCC(=O)N(C)C 1458a_100011200748_200000210301 [0,1,1,0,0,0|1,0,1]=4 982 B9R0.7 CC(C)C(=O)CC[S+](C)C 1458a_100009452791_100000210206 [0,1,1,0,0,0|2,0,0]=4 983 B9R0.7 CC(C)C=CC(=O)N(C)C 11a_100102631434_100016268746 [0,1,1,0,0,0|0,0,2]=4 984 B9R0.7 CC(C)C=CC(=O)N(C)C 1626a_100102631434_100016268746 [0,1,1,0,0,0|0,0,2]=4 985 B9R0.7 CC(C)C=CC(=O)N(C)C 240690a_100102631434_100016268746 [0,1,1,0,0,0|0,0,2]=4 986 B9R0.7 CC(C)CCC(=O)C(C)C 1458a_100000181311_100000210206 [0,1,1,0,0,0|1,0,0]=3 987 B9R0.7 CC(C)CCC(=O)C(C)C 1458a_100000210198_100000210312 [0,1,1,0,0,0|1,0,0]=3 988 B9R0.7 CC(C)CCC(=O)C(C)F 1458a_100000062450_100000210312 [0,1,1,0,0,0|1,0,0]=3 989 B9R0.7 CC(C)CCC(=O)C(O)O 1458a_100000233687_100000210312 [0,1,1,0,0,0|2,0,0]=4 990 B9R0.7 CC(C)CCC(=O)N(C)C 11a_100102631434_100000181311 [0,1,1,0,0,0|0,0,0]=2 991 B9R0.7 CC(C)CCC(=O)N(C)C 1626a_100102631434_100000181311 [0,1,1,0,0,0|0,0,0]=2 992 B9R0.7 CC(C)CCC(=O)N(C)C 240690a_100102631434_100000181311 [0,1,1,0,0,0|0,0,0]=2 993 B9R0.7 CC(C)CCC(=O)N(C)C 527a_100102631434_100000181311 [0,1,1,0,0,0|0,0,0]=2 994 B9R0.7 CC(C)CCC(=O)[C@@H](C)O 1458a_100000717761_100000210312 [0,1,1,0,0,0|1,0,0]=3 995 B9R0.7 CC(C)CCC(=O)[C@H](C)O 1458a_217856618621_100000210312 [0,1,1,0,0,0|1,0,0]=3 996 B9R0.7 CC(C)CCC(C)N(C)C 2230a_100102631434_100011261404 [0,1,1,0,0,0|1,0,1]=4 997 B9R0.7 CC(C)CCC(C)N(C)C 269982a_100102631434_100011261404 [0,1,1,0,0,0|1,0,1]=4 998 B9R0.7 CC(C)CCC(C)N(C)C 270004a_100102631434_100000210476 [0,1,1,0,0,0|1,0,1]=4 999 B9R0.7 CC(C)CNC(=O)C(=O)[13CH3] 1458a_200011297155_200025704644 [0,1,1,0,0,0|2,0,0]=4 1000 B9R0.7 CC(C)CNC(=O)C(C)C 11a_100000210953_100000210198 [0,1,1,0,0,0|2,0,0]=4 1001 B9R0.7 CC(C)CNC(=O)C(C)C 1626a_100000210953_100000210198 [0,1,1,0,0,0|2,0,0]=4 1002 B9R0.7 CC(C)CNC(=O)C(C)C 240690a_100000210953_100000210198 [0,1,1,0,0,0|2,0,0]=4 1003 B9R0.7 CC(C)CNC(=O)C(C)C 527a_100000210953_100000210198 [0,1,1,0,0,0|2,0,0]=4 1004 B9R0.7 CC(C)CNC(=O)C(C)F 11a_100000210953_100000062450 [0,1,1,0,0,0|2,0,0]=4 1005 B9R0.7 CC(C)CNC(=O)C(C)F 1626a_100000210953_100000062450 [0,1,1,0,0,0|2,0,0]=4 1006 B9R0.7 CC(C)CNC(=O)C(C)F 240690a_100000210953_100000062450 [0,1,1,0,0,0|2,0,0]=4 1007 B9R0.7 CC(C)CNC(=O)C(C)F 527a_100000210953_100000062450 [0,1,1,0,0,0|2,0,0]=4 1008 B9R0.7 CC(C)CNC(=O)N(C)C 2708a_100000210953_100102631434 [0,1,1,0,0,0|1,0,0]=3 1009 B9R0.7 CC(C)CNC(=O)[C@@H](C)O 240690a_100000210953_100000717761 [0,1,1,0,0,0|2,0,0]=4 1010 B9R0.7 CC(C)CNC(=O)[C@H](C)O 1626a_100000210953_217856618621 [0,1,1,0,0,0|2,0,0]=4 1011 B9R0.7 CC(C)CNC(=O)[C@H](C)O 240690a_100000210953_217856618621 [0,1,1,0,0,0|2,0,0]=4 1012 B9R0.7 CC(C)NCC(=O)C(C)C 2230a_100138425928_100000753385 [0,1,1,0,0,0|2,0,0]=4 1013 B9R0.7 CC(C)NCC(=O)C(C)C 34a_100138425928_100000753385 [0,1,1,0,0,0|2,0,0]=4 1014 B9R0.7 CC(C)NCC(=O)N(C)C 2230a_100015183351_100000210206 [0,1,1,0,0,0|1,0,0]=3 1015 B9R0.7 CC(C)NCC(=O)N(C)C 2230a_100138425928_100000185267 [0,1,1,0,0,0|1,0,0]=3 1016 B9R0.7 CC(C)NCC(=O)N(C)C 34a_100138425928_100000692301 [0,1,1,0,0,0|1,0,0]=3 1017 B9R0.7 CC(C)OCC(=O)C(C)C 1458a_100000745533_100000210206 [0,1,1,0,0,0|2,0,0]=4 1018 B9R0.7 CC(C)OCC(=O)C(C)C 34a_100000212225_100000753385 [0,1,1,0,0,0|2,0,0]=4 1019 B9R0.7 CC(C)OCC(=O)N(C)C 11a_100102631434_100000745533 [0,1,1,0,0,0|1,0,0]=3 1020 B9R0.7 CC(C)OCC(=O)N(C)C 1626a_100102631434_100000745533 [0,1,1,0,0,0|1,0,0]=3 1021 B9R0.7 CC(C)OCC(=O)N(C)C 240690a_100102631434_100000745533 [0,1,1,0,0,0|1,0,0]=3 1022 B9R0.7 CC(C)OCC(=O)N(C)C 34a_100000212225_100000692301 [0,1,1,0,0,0|1,0,0]=3 1023 B9R0.7 CC(C)OCC(=O)N(C)C 527a_100102631434_100000745533 [0,1,1,0,0,0|1,0,0]=3 1024 B9R0.7 CC(C)SCC(=O)C(C)C 1458a_100000241585_100000210206 [0,1,1,0,0,0|2,0,0]=4 1025 B9R0.7 CC(C)SCC(=O)C(C)C 62a_100000210206_100000753385 [0,1,1,0,0,0|2,0,0]=4 1026 B9R0.7 CC(C)SCC(=O)C(C)C 62a_100000753385_100000210206 [0,1,1,0,0,0|2,0,0]=4 1027 B9R0.7 CC(C)SCC(=O)N(C)C 11a_100102631434_100000241585 [0,1,1,0,0,0|1,0,0]=3 1028 B9R0.7 CC(C)SCC(=O)N(C)C 1626a_100102631434_100000241585 [0,1,1,0,0,0|1,0,0]=3 1029 B9R0.7 CC(C)SCC(=O)N(C)C 240690a_100102631434_100000241585 [0,1,1,0,0,0|1,0,0]=3 1030 B9R0.7 CC(C)SCC(=O)N(C)C 527a_100102631434_100000241585 [0,1,1,0,0,0|1,0,0]=3 1031 B9R0.7 CC(C)SCC(=O)N(C)C 62a_100000210206_100000692301 [0,1,1,0,0,0|1,0,0]=3 1032 B9R0.7 CC(C)SCC(=O)N(C)C 62a_100000692301_100000210206 [0,1,1,0,0,0|1,0,0]=3 1033 B9R0.7 CC(O)CCC(=O)C(C)C 1458a_100000210198_100012276601 [0,1,1,0,0,0|2,0,0]=4 1034 B9R0.7 CC(O)CCC(=O)C(C)F 1458a_100000062450_100012276601 [0,1,1,0,0,0|2,0,0]=4 1035 B9R0.7 CC(O)CCC(=O)N(C)C 1626a_100102631434_100000718519 [0,1,1,0,0,0|1,0,0]=3 1036 B9R0.7 CC(O)CCC(=O)[C@@H](C)O 1458a_100000717761_100012276601 [0,1,1,0,0,0|2,0,0]=4 1037 B9R0.7 CC(O)CCC(=O)[C@H](C)O 1458a_217856618621_100012276601 [0,1,1,0,0,0|2,0,0]=4 1038 B9R0.7 CN(C)C(=O)CCC(=O)[13CH3] 1458a_100011200748_200025704644 [0,1,1,0,0,0|1,0,1]=4 1039 B9R0.7 CN(C)C(=O)CC[S+](C)C 11a_100102631434_100009452791 [0,1,1,0,0,0|1,0,0]=3 1040 B9R0.7 CN(C)C(=O)CC[S+](C)C 1626a_100102631434_100009452791 [0,1,1,0,0,0|1,0,0]=3 1041 B9R0.7 CN(C)C(=O)CC[S+](C)C 240690a_100102631434_100009452791 [0,1,1,0,0,0|1,0,0]=3 1042 B9R0.7 CN(C)CCC(=O)N(C)C 11a_100102631434_100000689311 [0,1,1,0,0,0|1,0,0]=3 1043 B9R0.7 CN(C)CCC(=O)N(C)C 2230a_100102631434_100000737620 [0,1,1,0,0,0|1,0,0]=3 1044 B9R0.7 CN(C)CCC(=O)N(C)C 240690a_100102631434_100000689311 [0,1,1,0,0,0|1,0,0]=3 1045 B9R0.7 CN(C)CCC(=O)N(C)C 269982a_100102631434_100000737620 [0,1,1,0,0,0|1,0,0]=3 1046 B9R0.7 CN(C)CCC(=O)N(C)C 527a_100102631434_100000689311 [0,1,1,0,0,0|1,0,0]=3 1047 B9R0.21 C#CC(=O)CCC(C)(C)C 1458a_100000211873_100000755188 [0,1,1,0,0,0|1,0,1]=4 1048 B9R0.21 C=CC(=O)CCC(C)(C)C 1458a_100000185746_100000755188 [0,1,1,0,0,0|1,0,1]=4 1049 B9R0.21 CC(C)(C)CCC(=O)CF 1458a_100000757465_100015361967 [0,1,1,0,0,0|2,0,0]=4 1050 B9R0.21 CC(C)(C)CCC(=O)CO 1458a_100000210174_100000755188 [0,1,1,0,0,0|2,0,0]=4 1051 B9R0.21 CCC(=O)CCC(C)(C)C 1458a_100000210414_100000755188 [0,1,1,0,0,0|1,0,0]=3 1052 B9R0.21 CCC(=O)CCC(C)(C)C 1458a_100000757465_100000210202 [0,1,1,0,0,0|1,0,0]=3 1053 B9R0.21 CCC(=O)CCC(C)(F)F 1458a_100000030992_100000210202 [0,1,1,0,0,0|2,0,0]=4 1054 B9R0.21 CCC(=O)CC[N+](C)(C)C 1458a_100000210414_100000085578 [0,1,1,0,0,0|2,0,0]=4 1055 B9R0.21 CCC(=O)CC[Si](C)(C)C 1458a_100000210414_200000733723 [0,1,1,0,0,0|1,1,0]=4 1056 B9R0.21 CCC(=O)CC[Si](C)(C)C 1458a_100011215282_100000210202 [0,1,1,0,0,0|1,1,0]=4 1057 B9R0.21 CCC(=O)COC(C)(C)C 1458a_100000686494_100000210202 [0,1,1,0,0,0|2,0,0]=4 1058 B9R0.21 CCC(=O)COC(C)(C)C 34a_100000725409_100000210625 [0,1,1,0,0,0|2,0,0]=4 1059 B9R0.21 CCC(=O)COC(C)(C)C 7a_100015890283_100000747405 [0,1,1,0,0,0|2,0,0]=4 1060 B9R0.21 CCC(=O)CSC(C)(C)C 62a_100000211941_100000747405 [0,1,1,0,0,0|2,0,0]=4 1061 B9R0.21 CCC(=O)CSC(C)(C)C 62a_100000747405_100000211941 [0,1,1,0,0,0|2,0,0]=4 1062 B9R0.21 CCC(=O)NCC(C)(C)C 11a_100000743828_100000210414 [0,1,1,0,0,0|2,0,0]=4 1063 B9R0.21 CCC(=O)NCC(C)(C)C 1626a_100000743828_100000210414 [0,1,1,0,0,0|2,0,0]=4 1064 B9R0.21 CCC(=O)NCC(C)(C)C 240690a_100000743828_100000210414 [0,1,1,0,0,0|2,0,0]=4 1065 B9R0.21 CCC(=O)NCC(C)(C)C 527a_100000743828_100000210414 [0,1,1,0,0,0|2,0,0]=4 1066 B9R0.21 CCC(=O)NCC(C)(C)F 11a_100020643315_100000210414 [0,1,1,0,0,0|2,0,0]=4 1067 B9R0.21 CCC(=O)NCC(C)(C)F 1626a_100020643315_100000210414 [0,1,1,0,0,0|2,0,0]=4 1068 B9R0.21 CCC(=O)NCC(C)(C)F 240690a_100020643315_100000210414 [0,1,1,0,0,0|2,0,0]=4 1069 B9R0.21 CCC(=O)NCC(C)(C)F 527a_100020643315_100000210414 [0,1,1,0,0,0|2,0,0]=4 1070 B9R0.21 CCC(=O)NCC(C)(C)O 1626a_100000751335_100000210414 [0,1,1,0,0,0|2,0,0]=4 1071 B9R0.21 CCC(=O)NCC(C)(C)O 240690a_100000751335_100000210414 [0,1,1,0,0,0|2,0,0]=4 1072 B9R0.21 CCC(=O)NCC(C)(C)O 527a_100000751335_100000210414 [0,1,1,0,0,0|2,0,0]=4 1073 B9R0.21 CNC(=O)C#CC(C)(C)C 240690a_100102657272_100011966651 [0,1,1,0,0,0|0,0,2]=4 1074 B9R0.21 CNC(=O)CCC(C)(C)C 11a_106832991635_100000757465 [0,1,1,0,0,0|0,0,0]=2 1075 B9R0.21 CNC(=O)CCC(C)(C)C 1626a_100102657272_100000757465 [0,1,1,0,0,0|0,0,0]=2 1076 B9R0.21 CNC(=O)CCC(C)(C)C 240690a_100102657272_100000757465 [0,1,1,0,0,0|0,0,0]=2 1077 B9R0.21 CNC(=O)CCC(C)(C)C 527a_100102657272_100000757465 [0,1,1,0,0,0|0,0,0]=2 1078 B9R0.21 CNC(=O)CCC(C)(F)F 11a_106832991635_100000030992 [0,1,1,0,0,0|1,0,0]=3 1079 B9R0.21 CNC(=O)CCC(C)(F)F 1626a_100102657272_100000030992 [0,1,1,0,0,0|1,0,0]=3 1080 B9R0.21 CNC(=O)CCC(C)(F)F 240690a_100102657272_100000030992 [0,1,1,0,0,0|1,0,0]=3 1081 B9R0.21 CNC(=O)CCC(C)(F)F 527a_100102657272_100000030992 [0,1,1,0,0,0|1,0,0]=3 1082 B9R0.21 CNC(=O)CCC(F)(F)F 11a_106832991635_100000755318 [0,1,1,0,0,0|2,0,0]=4 1083 B9R0.21 CNC(=O)CCC(F)(F)F 1626a_100102657272_100000755318 [0,1,1,0,0,0|2,0,0]=4 1084 B9R0.21 CNC(=O)CCC(F)(F)F 240690a_100102657272_100000755318 [0,1,1,0,0,0|2,0,0]=4 1085 B9R0.21 CNC(=O)CCC(F)(F)F 527a_100102657272_100000755318 [0,1,1,0,0,0|2,0,0]=4 1086 B9R0.21 CNC(=O)CCS(=O)(=O)C 11a_106832991635_100000737124 [0,1,1,0,0,0|2,0,0]=4 1087 B9R0.21 CNC(=O)CCS(=O)(=O)C 1626a_100102657272_100000737124 [0,1,1,0,0,0|2,0,0]=4 1088 B9R0.21 CNC(=O)CCS(=O)(=O)C 240690a_100102657272_100000737124 [0,1,1,0,0,0|2,0,0]=4 1089 B9R0.21 CNC(=O)CCS(=O)(=O)C 527a_100102657272_100000737124 [0,1,1,0,0,0|2,0,0]=4 1090 B9R0.21 CNC(=O)CC[Si](C)(C)C 1626a_100102657272_100011215282 [0,1,1,0,0,0|0,1,0]=3 1091 B9R0.21 CNC(=O)CC[Si](C)(C)C 240690a_100102657272_100011215282 [0,1,1,0,0,0|0,1,0]=3 1092 B9R0.21 CNC(=O)CC[Si](C)(C)C 527a_100102657272_100011215282 [0,1,1,0,0,0|0,1,0]=3 1093 B9R0.21 CNC(=O)CNC(C)(C)C 2230a_100000715429_100000183359 [0,1,1,0,0,0|1,0,0]=3 1094 B9R0.21 CNC(=O)COC(C)(C)C 11a_106832991635_100000686494 [0,1,1,0,0,0|1,0,0]=3 1095 B9R0.21 CNC(=O)COC(C)(C)C 1626a_100102657272_100000686494 [0,1,1,0,0,0|1,0,0]=3 1096 B9R0.21 CNC(=O)COC(C)(C)C 240690a_100102657272_100000686494 [0,1,1,0,0,0|1,0,0]=3 1097 B9R0.21 CNC(=O)COC(C)(C)C 34a_100000750040_100000210625 [0,1,1,0,0,0|1,0,0]=3 1098 B9R0.21 CNC(=O)COC(C)(C)C 34a_100015890283_100000183359 [0,1,1,0,0,0|1,0,0]=3 1099 B9R0.21 CNC(=O)COC(C)(C)C 527a_100102657272_100000686494 [0,1,1,0,0,0|1,0,0]=3 1100 B9R0.21 CNC(=O)COC(C)(C)C 7a_100015890283_100000183359 [0,1,1,0,0,0|1,0,0]=3 1101 B9R0.21 CNC(=O)CSC(C)(C)C 62a_100000183359_100000211941 [0,1,1,0,0,0|1,0,0]=3 1102 B9R0.21 CNC(=O)CSC(C)(C)C 62a_100000211941_100000183359 [0,1,1,0,0,0|1,0,0]=3 1103 B9R0.21 CNC(=O)NCC(C)(C)C 2708a_100000743828_106832991635 [0,1,1,0,0,0|1,0,0]=3 1104 B9R0.21 CNC(=O)NCC(C)(C)C 2708a_100102657272_100000743828 [0,1,1,0,0,0|1,0,0]=3 1105 B9R0.21 CNC(=O)NCC(C)(C)C 273464a_100000743828_100102657272 [0,1,1,0,0,0|1,0,0]=3 1106 B9R0.21 CNC(=O)NCC(C)(C)C 273464a_100102657272_100000743828 [0,1,1,0,0,0|1,0,0]=3 1107 B9R0.21 CNC(=O)NCC(C)(C)C 512a_100000743828_100102657272 [0,1,1,0,0,0|1,0,0]=3 1108 B9R0.21 CNC(=O)NCC(C)(C)C 512a_106832991638_100000743828 [0,1,1,0,0,0|1,0,0]=3 1109 B9R0.21 CNC(=O)NCC(C)(C)F 2708a_100020643315_106832991635 [0,1,1,0,0,0|1,0,0]=3 1110 B9R0.21 CNC(=O)NCC(C)(C)F 2708a_100102657272_100020643315 [0,1,1,0,0,0|1,0,0]=3 1111 B9R0.21 CNC(=O)NCC(C)(C)F 273464a_100020643315_100102657272 [0,1,1,0,0,0|1,0,0]=3 1112 B9R0.21 CNC(=O)NCC(C)(C)F 273464a_100102657272_100020643315 [0,1,1,0,0,0|1,0,0]=3 1113 B9R0.21 CNC(=O)NCC(C)(C)F 512a_100020643315_100102657272 [0,1,1,0,0,0|1,0,0]=3 1114 B9R0.21 CNC(=O)NCC(C)(C)F 512a_106832991638_100020643315 [0,1,1,0,0,0|1,0,0]=3 1115 B9R0.21 CNC(=O)NCC(C)(C)O 2708a_100102657272_100000751335 [0,1,1,0,0,0|1,0,0]=3 1116 B9R0.21 CNC(=O)NCC(C)(C)O 273464a_100102657272_100000751335 [0,1,1,0,0,0|1,0,0]=3 1117 B9R0.21 CNC(=O)NCC(C)(C)O 512a_100000751335_100102657272 [0,1,1,0,0,0|1,0,0]=3 1118 B9R0.21 CNC(=O)NCC(C)(C)O 512a_106832991638_100000751335 [0,1,1,0,0,0|1,0,0]=3 1119 B9R0.21 CNC(=O)NCC(C)(F)F 2708a_100102657272_100000731000 [0,1,1,0,0,0|2,0,0]=4 1120 B9R0.21 CNC(=O)NCC(C)(F)F 273464a_100000731000_100102657272 [0,1,1,0,0,0|2,0,0]=4 1121 B9R0.21 CNC(=O)NCC(C)(F)F 273464a_100102657272_100000731000 [0,1,1,0,0,0|2,0,0]=4 1122 B9R0.21 CNC(=O)NCC(C)(F)F 512a_100000731000_100102657272 [0,1,1,0,0,0|2,0,0]=4 1123 B9R0.21 CNC(=O)NCC(C)(F)F 512a_106832991638_100000731000 [0,1,1,0,0,0|2,0,0]=4 1124 B9R0.21 CNC(=O)NC[Si](C)(C)C 2708a_100102657272_102516607284 [0,1,1,0,0,0|1,1,0]=4 1125 B9R0.21 CNC(=O)NC[Si](C)(C)C 2708a_102516607284_106832991635 [0,1,1,0,0,0|1,1,0]=4 1126 B9R0.21 CNC(=O)NC[Si](C)(C)C 273464a_100102657272_102516607284 [0,1,1,0,0,0|1,1,0]=4 1127 B9R0.21 CNC(=O)NC[Si](C)(C)C 273464a_102516607284_100102657272 [0,1,1,0,0,0|1,1,0]=4 1128 B9R0.21 CNC(=O)NC[Si](C)(C)C 512a_102516607284_100102657272 [0,1,1,0,0,0|1,1,0]=4 1129 B9R0.21 CNC(=O)NC[Si](C)(C)C 512a_106832991638_102516607284 [0,1,1,0,0,0|1,1,0]=4 1130 B9R0.21 CNC(=O)NNC(C)(C)C 273464a_100102657272_100000725372 [0,1,1,0,0,0|2,0,0]=4 1131 B9R0.21 CNC(=O)NNC(C)(C)C 512a_100000725372_100102657272 [0,1,1,0,0,0|2,0,0]=4 1132 B9R0.21 CNC(=O)NNC(C)(C)C 512a_106832991638_100000725372 [0,1,1,0,0,0|2,0,0]=4 1133 B9R0.21 COC(=O)CNC(C)(C)C 2230a_100000715429_100000747449 [0,1,1,0,0,0|2,0,0]=4 1134 B9R0.21 COC(=O)COC(C)(C)C 34a_100015890283_100000747449 [0,1,1,0,0,0|2,0,0]=4 1135 B9R0.21 COC(=O)COC(C)(C)C 7a_100015890283_100000747449 [0,1,1,0,0,0|2,0,0]=4 1136 B9R0.21 COC(=O)CSC(C)(C)C 62a_100000211941_100000747449 [0,1,1,0,0,0|2,0,0]=4 1137 B9R0.21 COC(=O)CSC(C)(C)C 62a_100000747449_100000211941 [0,1,1,0,0,0|2,0,0]=4 1138 B9R0.23 C#CC(=O)C(C)CC(C)C 1458a_100000211873_100000731052 [0,1,1,0,0,0|1,0,1]=4 1139 B9R0.23 C=CC(=O)C(C)CC(C)C 1458a_100000185746_100000731052 [0,1,1,0,0,0|1,0,1]=4 1140 B9R0.23 CC(C)CC(C)C(=O)CO 1458a_100000210174_100000731052 [0,1,1,0,0,0|2,0,0]=4 1141 B9R0.23 CC(C)C[C@H](O)C(=O)CF 1458a_100012027011_100015361967 [0,1,1,0,0,0|2,0,0]=4 1142 B9R0.23 CC(C)OC(C)C(=O)NN 34a_100000725659_100000210206 [0,1,1,0,0,0|2,0,0]=4 1143 B9R0.23 CCC(=O)C(C)CC(C)C 1458a_100000210414_100000731052 [0,1,1,0,0,0|1,0,0]=3 1144 B9R0.23 CCC(=O)C(C)CN(C)C 1458a_200015186601_100000210202 [0,1,1,0,0,0|2,0,0]=4 1145 B9R0.23 CCC(=O)C(C)NC(C)C 2230a_100138425928_100000742827 [0,1,1,0,0,0|2,0,0]=4 1146 B9R0.23 CCC(=O)C(C)SC(C)C 62a_100000210206_100000742827 [0,1,1,0,0,0|2,0,0]=4 1147 B9R0.23 CCC(=O)C(C)SC(C)C 62a_100000742827_100000210206 [0,1,1,0,0,0|2,0,0]=4 1148 B9R0.23 CCC(=O)N(C)CC(C)C 11a_100000747067_100000210414 [0,1,1,0,0,0|2,0,0]=4 1149 B9R0.23 CCC(=O)N(C)CC(C)C 1626a_100000747067_100000210414 [0,1,1,0,0,0|2,0,0]=4 1150 B9R0.23 CCC(=O)N(C)CC(C)C 240690a_100000747067_100000210414 [0,1,1,0,0,0|2,0,0]=4 1151 B9R0.23 CCC(=O)N(C)CC(C)C 527a_100000747067_100000210414 [0,1,1,0,0,0|2,0,0]=4 1152 B9R0.23 CCC(=O)[C@@H](O)CC(C)C 1458a_100012027011_100000210202 [0,1,1,0,0,0|1,0,0]=3 1153 B9R0.23 CNC(=O)C(=O)CC(C)C 1458a_100011218921_100000210624 [0,1,1,0,0,0|0,0,1]=3 1154 B9R0.23 CNC(=O)C(=O)CC(C)O 1458a_100011218921_100011218427 [0,1,1,0,0,0|1,0,1]=4 1155 B9R0.23 CNC(=O)C(=O)NC(C)C 1626a_100102657272_100011220036 [0,1,1,0,0,0|1,0,1]=4 1156 B9R0.23 CNC(=O)C(=O)NC(C)C 1626a_100138425928_100011218921 [0,1,1,0,0,0|1,0,1]=4 1157 B9R0.23 CNC(=O)C(=O)NC(C)C 240690a_100102657272_100011220036 [0,1,1,0,0,0|1,0,1]=4 1158 B9R0.23 CNC(=O)C(=O)NC(C)C 240690a_100138425928_100011218921 [0,1,1,0,0,0|1,0,1]=4 1159 B9R0.23 CNC(=O)C(=O)NC(C)C 527a_100102657272_100011220036 [0,1,1,0,0,0|1,0,1]=4 1160 B9R0.23 CNC(=O)C(=O)NC(C)C 527a_100138425928_100011218921 [0,1,1,0,0,0|1,0,1]=4 1161 B9R0.23 CNC(=O)C(C)CN(C)C 1626a_100102657272_200015186601 [0,1,1,0,0,0|1,0,0]=3 1162 B9R0.23 CNC(=O)C(C)CN(C)C 240690a_100102657272_200015186601 [0,1,1,0,0,0|1,0,0]=3 1163 B9R0.23 CNC(=O)C(C)NC(C)C 2230a_100138425928_100000731044 [0,1,1,0,0,0|1,0,0]=3 1164 B9R0.23 CNC(=O)C(C)NC(C)C 34a_100138425928_100000731044 [0,1,1,0,0,0|1,0,0]=3 1165 B9R0.23 CNC(=O)C(C)OC(C)C 34a_100000212225_100000731044 [0,1,1,0,0,0|1,0,0]=3 1166 B9R0.23 CNC(=O)C(C)SC(C)C 62a_100000209862_100000210206 [0,1,1,0,0,0|1,0,0]=3 1167 B9R0.23 CNC(=O)C(C)SC(C)C 62a_100000210206_100000731044 [0,1,1,0,0,0|1,0,0]=3 1168 B9R0.23 CNC(=O)C(F)NC(C)C 2230a_100138425928_100009813575 [0,1,1,0,0,0|1,0,0]=3 1169 B9R0.23 CNC(=O)C(F)NC(C)C 34a_100138425928_100009813575 [0,1,1,0,0,0|1,0,0]=3 1170 B9R0.23 CNC(=O)C(F)OC(C)C 34a_100000212225_100009813575 [0,1,1,0,0,0|1,0,0]=3 1171 B9R0.23 CNC(=O)C(F)SC(C)C 62a_100000210206_100009813575 [0,1,1,0,0,0|1,0,0]=3 1172 B9R0.23 CNC(=O)C(F)SC(C)C 62a_100009813575_100000210206 [0,1,1,0,0,0|1,0,0]=3 1173 B9R0.23 CNC(=O)N(C)CC(C)C 2708a_100102657272_100000747067 [0,1,1,0,0,0|1,0,0]=3 1174 B9R0.23 CNC(=O)N(C)CC(C)C 273464a_100102657272_100000747067 [0,1,1,0,0,0|1,0,0]=3 1175 B9R0.23 CNC(=O)N(C)CC(C)O 2708a_100102657272_100000227577 [0,1,1,0,0,0|2,0,0]=4 1176 B9R0.23 CNC(=O)[C@@H](C)NC(C)C 2230a_100000684985_100000210206 [0,1,1,0,0,0|1,0,0]=3 1177 B9R0.23 CNC(=O)[C@@H](C)NC(C)C 34a_100000684985_100000210206 [0,1,1,0,0,0|1,0,0]=3 1178 B9R0.23 CNC(=O)[C@@H](O)CC(C)C 1626a_100102657272_100012027011 [0,1,1,0,0,0|0,0,0]=2 1179 B9R0.23 CNC(=O)[C@@H](O)CC(C)C 240690a_100102657272_100012027011 [0,1,1,0,0,0|0,0,0]=2 1180 B9R0.23 COC(=O)C(C)CN(C)C 269982a_100102631434_100000698445 [0,1,1,0,0,0|2,0,0]=4 1181 B9R0.23 COC(=O)C(C)NC(C)C 2230a_100138425928_100000211248 [0,1,1,0,0,0|2,0,0]=4 1182 B9R0.23 COC(=O)C(C)NC(C)C 34a_100138425928_100000211248 [0,1,1,0,0,0|2,0,0]=4 1183 B9R0.23 COC(=O)C(C)OC(C)C 34a_100000212225_100000211248 [0,1,1,0,0,0|2,0,0]=4 1184 B9R0.23 COC(=O)C(C)OC(C)C 34a_100011215400_100000210206 [0,1,1,0,0,0|2,0,0]=4 1185 B9R0.23 COC(=O)C(C)SC(C)C 62a_100000210206_100000211248 [0,1,1,0,0,0|2,0,0]=4 1186 B9R0.23 COC(=O)C(C)SC(C)C 62a_100000211248_100000210206 [0,1,1,0,0,0|2,0,0]=4 1187 B9R0.24 C#CC(C)NCC(=O)NC 2230a_100000707721_100000183359 [0,1,1,0,0,0|1,0,1]=4 1188 B9R0.24 C#CC(C)NCC(=O)NC 34a_100000707721_100000183359 [0,1,1,0,0,0|1,0,1]=4 1189 B9R0.24 C#CC(C)OCC(=O)NC 34a_100000750040_200000035995 [0,1,1,0,0,0|1,0,1]=4 1190 B9R0.24 C#CC(C)SCC(=O)NC 62a_200000035995_100000183359 [0,1,1,0,0,0|1,0,1]=4 1191 B9R0.24 C#C[C@@H](C)OCC(=O)NC 34a_100009815206_100000183359 [0,1,1,0,0,0|1,0,1]=4 1192 B9R0.24 C#C[C@@H](C)OCC(=O)NC 7a_100009815206_100000183359 [0,1,1,0,0,0|1,0,1]=4 1193 B9R0.24 C=CC(C)OCC(=O)NC 34a_100000695699_100000183359 [0,1,1,0,0,0|1,0,1]=4 1194 B9R0.24 C=CC(C)SCC(=O)NC 62a_100011215867_100000183359 [0,1,1,0,0,0|1,0,1]=4 1195 B9R0.24 CCC(=O)CCC(=O)NC 1458a_100011309844_100000210202 [0,1,1,0,0,0|1,0,1]=4 1196 B9R0.24 CCC(=O)CCC(C)CC 1458a_100000701222_100000210202 [0,1,1,0,0,0|1,0,0]=3 1197 B9R0.24 CCC(=O)CCN(C)CC 1458a_100000755305_100000210202 [0,1,1,0,0,0|2,0,0]=4 1198 B9R0.24 CCC(=O)COC(C)CC 34a_100000725409_100011215416 [0,1,1,0,0,0|2,0,0]=4 1199 B9R0.24 CCC(=O)COC(C)CC 7a_100000210228_100000747405 [0,1,1,0,0,0|2,0,0]=4 1200 B9R0.24 CCC(=O)COC(C)CF 7a_100016041109_100000747405 [0,1,1,0,0,0|2,0,0]=4 1201 B9R0.24 CCC(=O)COC(C)CO 34a_100000725409_100012180447 [0,1,1,0,0,0|2,0,0]=4 1202 B9R0.24 CCC(=O)CSC(C)CC 62a_100000747405_100000758301 [0,1,1,0,0,0|2,0,0]=4 1203 B9R0.24 CCC(=O)CSC(C)CC 62a_100000758301_100000747405 [0,1,1,0,0,0|2,0,0]=4 1204 B9R0.24 CCC(=O)CSC(C)CO 62a_100012180447_100000747405 [0,1,1,0,0,0|2,0,0]=4 1205 B9R0.24 CCC(=O)CSC(C)OC 62a_100000747405_100009879195 [0,1,1,0,0,0|2,0,0]=4 1206 B9R0.24 CCC(=O)CSC(C)OC 62a_100009879195_100000747405 [0,1,1,0,0,0|2,0,0]=4 1207 B9R0.24 CCC(=O)CS[C@H](C)CO 62a_100000747405_100016084084 [0,1,1,0,0,0|2,0,0]=4 1208 B9R0.24 CCC(=O)CS[C@H](C)CO 62a_100016084084_100000747405 [0,1,1,0,0,0|2,0,0]=4 1209 B9R0.24 CCC(=O)NCC(C)CC 11a_100020588543_100000210414 [0,1,1,0,0,0|2,0,0]=4 1210 B9R0.24 CCC(=O)NCC(C)CC 1626a_100020588543_100000210414 [0,1,1,0,0,0|2,0,0]=4 1211 B9R0.24 CCC(=O)NCC(C)CC 240690a_100020588543_100000210414 [0,1,1,0,0,0|2,0,0]=4 1212 B9R0.24 CCC(=O)NCC(C)CC 527a_100020588543_100000210414 [0,1,1,0,0,0|2,0,0]=4 1213 B9R0.24 CCC(=O)NCC(C)CO 240690a_100000744482_100000210414 [0,1,1,0,0,0|2,0,0]=4 1214 B9R0.24 CCC(=O)NCC(C)CO 527a_100000744482_100000210414 [0,1,1,0,0,0|2,0,0]=4 1215 B9R0.24 CCC(=O)NC[C@@H](C)OC 11a_100020591295_100000210414 [0,1,1,0,0,0|2,0,0]=4 1216 B9R0.24 CCC(=O)NC[C@@H](C)OC 1626a_100020591295_100000210414 [0,1,1,0,0,0|2,0,0]=4 1217 B9R0.24 CCC(=O)NC[C@@H](C)OC 240690a_100020591295_100000210414 [0,1,1,0,0,0|2,0,0]=4 1218 B9R0.24 CCC(=O)NC[C@@H](C)OC 527a_100020591295_100000210414 [0,1,1,0,0,0|2,0,0]=4 1219 B9R0.24 CCC(C)CCC(=O)CF 1458a_100000701222_100015361967 [0,1,1,0,0,0|2,0,0]=4 1220 B9R0.24 CCC(C)CCC(=O)NC 11a_106832991635_100000701222 [0,1,1,0,0,0|0,0,0]=2 1221 B9R0.24 CCC(C)CCC(=O)NC 1626a_100102657272_100000701222 [0,1,1,0,0,0|0,0,0]=2 1222 B9R0.24 CCC(C)CCC(=O)NC 240690a_100102657272_100000701222 [0,1,1,0,0,0|0,0,0]=2 1223 B9R0.24 CCC(C)CCC(=O)NC 527a_100102657272_100000701222 [0,1,1,0,0,0|0,0,0]=2 1224 B9R0.24 CCC(C)CNC(=O)NC 2708a_100020588543_106832991635 [0,1,1,0,0,0|1,0,0]=3 1225 B9R0.24 CCC(C)CNC(=O)NC 2708a_100102657272_100020588543 [0,1,1,0,0,0|1,0,0]=3 1226 B9R0.24 CCC(C)CNC(=O)NC 273464a_100020588543_100102657272 [0,1,1,0,0,0|1,0,0]=3 1227 B9R0.24 CCC(C)CNC(=O)NC 273464a_100102657272_100020588543 [0,1,1,0,0,0|1,0,0]=3 1228 B9R0.24 CCC(C)CNC(=O)NC 512a_100020588543_100102657272 [0,1,1,0,0,0|1,0,0]=3 1229 B9R0.24 CCC(C)CNC(=O)NC 512a_106832991638_100020588543 [0,1,1,0,0,0|1,0,0]=3 1230 B9R0.24 CCC(C)NCC(=O)NC 2230a_100000209981_100000183359 [0,1,1,0,0,0|1,0,0]=3 1231 B9R0.24 CCC(C)NCC(=O)NC 2230a_100000693194_100000758301 [0,1,1,0,0,0|1,0,0]=3 1232 B9R0.24 CCC(C)NCC(=O)OC 2230a_100000209981_100000747449 [0,1,1,0,0,0|2,0,0]=4 1233 B9R0.24 CCC(C)NNC(=O)NC 273464a_100102657272_100000718999 [0,1,1,0,0,0|2,0,0]=4 1234 B9R0.24 CCC(C)NNC(=O)NC 512a_100000718999_100102657272 [0,1,1,0,0,0|2,0,0]=4 1235 B9R0.24 CCC(C)NNC(=O)NC 512a_106832991638_100000718999 [0,1,1,0,0,0|2,0,0]=4 1236 B9R0.24 CCC(C)OCC(=O)NC 34a_100000750040_100011215416 [0,1,1,0,0,0|1,0,0]=3 1237 B9R0.24 CCC(C)OCC(=O)NC 7a_100000210228_100000183359 [0,1,1,0,0,0|1,0,0]=3 1238 B9R0.24 CCC(C)OCC(=O)OC 7a_100000210228_100000747449 [0,1,1,0,0,0|2,0,0]=4 1239 B9R0.24 CCC(C)SCC(=O)NC 62a_100000183359_100000758301 [0,1,1,0,0,0|1,0,0]=3 1240 B9R0.24 CCC(C)SCC(=O)NC 62a_100000758301_100000183359 [0,1,1,0,0,0|1,0,0]=3 1241 B9R0.24 CCC(C)SCC(=O)OC 62a_100000747449_100000758301 [0,1,1,0,0,0|2,0,0]=4 1242 B9R0.24 CCC(C)SCC(=O)OC 62a_100000758301_100000747449 [0,1,1,0,0,0|2,0,0]=4 1243 B9R0.24 CCC(O)CCC(=O)NC 1626a_100102657272_203496584001 [0,1,1,0,0,0|1,0,0]=3 1244 B9R0.24 CCC(O)CCC(=O)NC 240690a_100102657272_203496584001 [0,1,1,0,0,0|1,0,0]=3 1245 B9R0.24 CCC(O)CNC(=O)NC 2708a_100102657272_100011218483 [0,1,1,0,0,0|2,0,0]=4 1246 B9R0.24 CCC(O)CNC(=O)NC 273464a_100011218483_100102657272 [0,1,1,0,0,0|2,0,0]=4 1247 B9R0.24 CCC(O)CNC(=O)NC 273464a_100102657272_100011218483 [0,1,1,0,0,0|2,0,0]=4 1248 B9R0.24 CCC(O)CNC(=O)NC 512a_100011218483_100102657272 [0,1,1,0,0,0|2,0,0]=4 1249 B9R0.24 CCN(C)CCC(=O)NC 2230a_100000225621_100000737683 [0,1,1,0,0,0|1,0,0]=3 1250 B9R0.24 CCN(C)CCC(=O)NC 2230a_100000750875_100000210202 [0,1,1,0,0,0|1,0,0]=3 1251 B9R0.24 CCN(C)CCC(=O)NC 240690a_100102657272_100000755305 [0,1,1,0,0,0|1,0,0]=3 1252 B9R0.24 CCN(C)CCC(=O)NC 269982a_100000225621_100000737683 [0,1,1,0,0,0|1,0,0]=3 1253 B9R0.24 CCN(C)CCC(=O)NC 269982a_100000750875_100000204670 [0,1,1,0,0,0|1,0,0]=3 1254 B9R0.24 CCN(C)CCC(=O)OC 2230a_100000225621_100000204255 [0,1,1,0,0,0|2,0,0]=4 1255 B9R0.24 CCN(C)CCC(=O)OC 2230a_100000229097_200000210301 [0,1,1,0,0,0|2,0,0]=4 1256 B9R0.24 CCN(C)CCC(=O)OC 269982a_100000225621_100000204255 [0,1,1,0,0,0|2,0,0]=4 1257 B9R0.24 CCN(C)CCC(=O)OC 269982a_100000229097_200000210301 [0,1,1,0,0,0|2,0,0]=4 1258 B9R0.24 CCN(C)CCC(=O)OC 269982a_100025711912_100000204670 [0,1,1,0,0,0|2,0,0]=4 1259 B9R0.24 CCN([13CH3])CCC(=O)OC 2230a_100000229097_200025704644 [0,1,1,0,0,0|2,0,0]=4 1260 B9R0.24 CCN([13CH3])CCC(=O)OC 269982a_100000229097_200025704644 [0,1,1,0,0,0|2,0,0]=4 1261 B9R0.24 CCS(=O)CCC(=O)NC 11a_106832991635_100011387550 [0,1,1,0,0,0|2,0,0]=4 1262 B9R0.24 CCS(=O)CCC(=O)NC 1626a_100102657272_100011387550 [0,1,1,0,0,0|2,0,0]=4 1263 B9R0.24 CCS(=O)CCC(=O)NC 240690a_100102657272_100011387550 [0,1,1,0,0,0|2,0,0]=4 1264 B9R0.24 CCS(=O)CCC(=O)NC 527a_100102657272_100011387550 [0,1,1,0,0,0|2,0,0]=4 1265 B9R0.24 CNC(=O)CCC(=O)CF 1458a_100011309844_100015361967 [0,1,1,0,0,0|1,0,1]=4 1266 B9R0.24 CNC(=O)CCC(=O)NC 11a_106832991635_100011309844 [0,1,1,0,0,0|1,0,1]=4 1267 B9R0.24 CNC(=O)CCC(=O)NC 1626a_100102657272_100011309844 [0,1,1,0,0,0|1,0,1]=4 1268 B9R0.24 CNC(=O)CCC(=O)NC 240690a_100102657272_100011309844 [0,1,1,0,0,0|1,0,1]=4 1269 B9R0.24 CNC(=O)CCC(=O)NC 527a_100102657272_100011309844 [0,1,1,0,0,0|1,0,1]=4 1270 B9R0.24 CNC(=O)CCC(=O)OC 11a_106832991635_100000187943 [0,1,1,0,0,0|1,0,1]=4 1271 B9R0.24 CNC(=O)CCC(=O)OC 1626a_100102657272_100000187943 [0,1,1,0,0,0|1,0,1]=4 1272 B9R0.24 CNC(=O)CCC(=O)OC 240690a_100102657272_100000187943 [0,1,1,0,0,0|1,0,1]=4 1273 B9R0.24 CNC(=O)CCC(=O)OC 527a_100102657272_100000187943 [0,1,1,0,0,0|1,0,1]=4 1274 B9R0.24 CNC(=O)CCN(C)CF 269982a_100000750875_100015361967 [0,1,1,0,0,0|1,0,0]=3 1275 B9R0.24 CNC(=O)CNC(C)C#N 2230a_100000693194_100000184139 [0,1,1,0,0,0|1,0,1]=4 1276 B9R0.24 CNC(=O)CNC(C)C#N 2230a_100000737613_100000183359 [0,1,1,0,0,0|1,0,1]=4 1277 B9R0.24 CNC(=O)CNC(C)CO 2230a_100000693194_100012180447 [0,1,1,0,0,0|1,0,0]=3 1278 B9R0.24 CNC(=O)CN[C@H](C)CO 2230a_100000737577_100000183359 [0,1,1,0,0,0|1,0,0]=3 1279 B9R0.24 CNC(=O)COC(C)C#N 34a_100011218135_100000183359 [0,1,1,0,0,0|1,0,1]=4 1280 B9R0.24 CNC(=O)COC(C)CF 34a_100016041109_100000183359 [0,1,1,0,0,0|1,0,0]=3 1281 B9R0.24 CNC(=O)COC(C)CF 7a_100016041109_100000183359 [0,1,1,0,0,0|1,0,0]=3 1282 B9R0.24 CNC(=O)COC(C)CN 34a_100000210904_100000183359 [0,1,1,0,0,0|1,0,0]=3 1283 B9R0.24 CNC(=O)COC(C)CO 34a_100000750040_100012180447 [0,1,1,0,0,0|1,0,0]=3 1284 B9R0.24 CNC(=O)CSC(C)C#N 62a_100000183359_100000703298 [0,1,1,0,0,0|1,0,1]=4 1285 B9R0.24 CNC(=O)CSC(C)C#N 62a_100000703298_100000183359 [0,1,1,0,0,0|1,0,1]=4 1286 B9R0.24 CNC(=O)CSC(C)CO 62a_100012180447_100000183359 [0,1,1,0,0,0|1,0,0]=3 1287 B9R0.24 CNC(=O)CSC(C)OC 62a_100000183359_100009879195 [0,1,1,0,0,0|1,0,0]=3 1288 B9R0.24 CNC(=O)CSC(C)OC 62a_100009879195_100000183359 [0,1,1,0,0,0|1,0,0]=3 1289 B9R0.24 CNC(=O)CS[C@H](C)CO 62a_100000183359_100016084084 [0,1,1,0,0,0|1,0,0]=3 1290 B9R0.24 CNC(=O)CS[C@H](C)CO 62a_100016084084_100000183359 [0,1,1,0,0,0|1,0,0]=3 1291 B9R0.24 CNC(=O)NCC(C)CO 2708a_100102657272_100000744482 [0,1,1,0,0,0|1,0,0]=3 1292 B9R0.24 CNC(=O)NCC(C)CO 273464a_100000744482_100102657272 [0,1,1,0,0,0|1,0,0]=3 1293 B9R0.24 CNC(=O)NCC(C)CO 273464a_100102657272_100000744482 [0,1,1,0,0,0|1,0,0]=3 1294 B9R0.24 CNC(=O)NCC(C)CO 512a_100000744482_100102657272 [0,1,1,0,0,0|1,0,0]=3 1295 B9R0.24 CNC(=O)NCC(C)CO 512a_106832991638_100000744482 [0,1,1,0,0,0|1,0,0]=3 1296 B9R0.24 CNC(=O)NC[C@@H](C)OC 2708a_100020591295_106832991635 [0,1,1,0,0,0|1,0,0]=3 1297 B9R0.24 CNC(=O)NC[C@@H](C)OC 2708a_100102657272_100020591295 [0,1,1,0,0,0|1,0,0]=3 1298 B9R0.24 CNC(=O)NC[C@@H](C)OC 273464a_100020591295_100102657272 [0,1,1,0,0,0|1,0,0]=3 1299 B9R0.24 CNC(=O)NC[C@@H](C)OC 273464a_100102657272_100020591295 [0,1,1,0,0,0|1,0,0]=3 1300 B9R0.24 CNC(=O)NC[C@@H](C)OC 512a_100020591295_100102657272 [0,1,1,0,0,0|1,0,0]=3 1301 B9R0.24 CNC(=O)NC[C@@H](C)OC 512a_106832991638_100020591295 [0,1,1,0,0,0|1,0,0]=3 1302 B9R0.24 CNC(=O)NC[C@@H](F)CO 2708a_100102657272_100015665980 [0,1,1,0,0,0|2,0,0]=4 1303 B9R0.24 CNC(=O)NC[C@@H](F)CO 273464a_100015665980_100102657272 [0,1,1,0,0,0|2,0,0]=4 1304 B9R0.24 CNC(=O)NC[C@@H](F)CO 273464a_100102657272_100015665980 [0,1,1,0,0,0|2,0,0]=4 1305 B9R0.24 CNC(=O)NC[C@@H](F)CO 512a_100015665980_100102657272 [0,1,1,0,0,0|2,0,0]=4 1306 B9R0.24 CNC(=O)NC[C@@H](F)CO 512a_106832991638_100015665980 [0,1,1,0,0,0|2,0,0]=4 1307 B9R0.24 CNC(=O)NC[C@H](O)CO 2708a_100102657272_100020644852 [0,1,1,0,0,0|2,0,0]=4 1308 B9R0.24 CNC(=O)NC[C@H](O)CO 273464a_100020644852_100102657272 [0,1,1,0,0,0|2,0,0]=4 1309 B9R0.24 CNC(=O)NC[C@H](O)CO 273464a_100102657272_100020644852 [0,1,1,0,0,0|2,0,0]=4 1310 B9R0.24 COC(=O)CCN(C)CF 269982a_100025711912_100015361967 [0,1,1,0,0,0|2,0,0]=4 1311 B9R0.24 COC(=O)CN[C@H](C)CO 2230a_100000737577_100000747449 [0,1,1,0,0,0|2,0,0]=4 1312 B9R0.24 COC(=O)COC(C)CF 34a_100016041109_100000747449 [0,1,1,0,0,0|2,0,0]=4 1313 B9R0.24 COC(=O)COC(C)CF 7a_100016041109_100000747449 [0,1,1,0,0,0|2,0,0]=4 1314 B9R0.24 COC(=O)COC(C)CN 34a_100000210904_100000747449 [0,1,1,0,0,0|2,0,0]=4 1315 B9R0.24 COC(=O)CSC(C)CO 62a_100012180447_100000747449 [0,1,1,0,0,0|2,0,0]=4 1316 B9R0.24 COC(=O)CSC(C)OC 62a_100000747449_100009879195 [0,1,1,0,0,0|2,0,0]=4 1317 B9R0.24 COC(=O)CSC(C)OC 62a_100009879195_100000747449 [0,1,1,0,0,0|2,0,0]=4 1318 B9R0.24 COC(=O)CS[C@H](C)CO 62a_100000747449_100016084084 [0,1,1,0,0,0|2,0,0]=4 1319 B9R0.24 COC(=O)CS[C@H](C)CO 62a_100016084084_100000747449 [0,1,1,0,0,0|2,0,0]=4 1320 B9R0.42 CCC(=O)CC(=O)C(C)C 1458a_100000210198_100000747405 [0,1,1,0,0,0|1,0,1]=4 1321 B9R0.42 CCC(=O)CC(=O)C(C)C 1458a_100000210414_100000753385 [0,1,1,0,0,0|1,0,1]=4 1322 B9R0.42 CCC(=O)CC(C)N(C)C 1458a_100011311895_100000210202 [0,1,1,0,0,0|2,0,0]=4 1323 B9R0.42 CCC(=O)CN(C)C(C)C 1458a_100000743827_100000210202 [0,1,1,0,0,0|2,0,0]=4 1324 B9R0.42 CCC(=O)CN(C)C(C)C 269982a_200000211004_100000747405 [0,1,1,0,0,0|2,0,0]=4 1325 B9R0.42 CCC(=O)NC(C)C(C)C 11a_100000211541_100000210414 [0,1,1,0,0,0|2,0,0]=4 1326 B9R0.42 CCC(=O)NC(C)C(C)C 1626a_100000211541_100000210414 [0,1,1,0,0,0|2,0,0]=4 1327 B9R0.42 CCC(=O)NC(C)C(C)C 240690a_100000211541_100000210414 [0,1,1,0,0,0|2,0,0]=4 1328 B9R0.42 CCC(=O)NC(C)C(C)C 527a_100000211541_100000210414 [0,1,1,0,0,0|2,0,0]=4 1329 B9R0.42 CNC(=O)CC(=O)C(C)C 1458a_100000210198_100000183359 [0,1,1,0,0,0|0,0,1]=3 1330 B9R0.42 CNC(=O)CC(=O)C(C)F 1458a_100000062450_100000183359 [0,1,1,0,0,0|1,0,1]=4 1331 B9R0.42 CNC(=O)CC(=O)[C@@H](C)O 1458a_100000717761_100000183359 [0,1,1,0,0,0|1,0,1]=4 1332 B9R0.42 CNC(=O)CC(=O)[C@H](C)O 1458a_217856618621_100000183359 [0,1,1,0,0,0|1,0,1]=4 1333 B9R0.42 CNC(=O)CC(C)N(C)C 1626a_100102657272_100011311895 [0,1,1,0,0,0|1,0,0]=3 1334 B9R0.42 CNC(=O)CC(C)N(C)C 2230a_100015186911_200000210301 [0,1,1,0,0,0|1,0,0]=3 1335 B9R0.42 CNC(=O)CC(C)N(C)C 240690a_100102657272_100011311895 [0,1,1,0,0,0|1,0,0]=3 1336 B9R0.42 CNC(=O)CC(C)N(C)C 269982a_100015186911_200000210301 [0,1,1,0,0,0|1,0,0]=3 1337 B9R0.42 CNC(=O)CC(C)N(C)[13CH3] 2230a_100015186911_200025704644 [0,1,1,0,0,0|1,0,0]=3 1338 B9R0.42 CNC(=O)CC(C)N(C)[13CH3] 269982a_100015186911_200025704644 [0,1,1,0,0,0|1,0,0]=3 1339 B9R0.42 CNC(=O)CN(C)C(C)C 11a_106832991635_100000743827 [0,1,1,0,0,0|1,0,0]=3 1340 B9R0.42 CNC(=O)CN(C)C(C)C 1626a_100102657272_100000743827 [0,1,1,0,0,0|1,0,0]=3 1341 B9R0.42 CNC(=O)CN(C)C(C)C 2230a_100000189611_100000210206 [0,1,1,0,0,0|1,0,0]=3 1342 B9R0.42 CNC(=O)CN(C)C(C)C 240690a_100102657272_100000743827 [0,1,1,0,0,0|1,0,0]=3 1343 B9R0.42 CNC(=O)CN(C)C(C)C 269982a_200000211004_100000183359 [0,1,1,0,0,0|1,0,0]=3 1344 B9R0.42 CNC(=O)CN(C)C(C)C 527a_100102657272_100000743827 [0,1,1,0,0,0|1,0,0]=3 1345 B9R0.42 CNC(=O)NC(C)C(C)C 2708a_100000211541_106832991635 [0,1,1,0,0,0|1,0,0]=3 1346 B9R0.42 CNC(=O)NC(C)C(C)C 2708a_100102657272_100000211541 [0,1,1,0,0,0|1,0,0]=3 1347 B9R0.42 CNC(=O)NC(C)C(C)C 273464a_100000211541_100102657272 [0,1,1,0,0,0|1,0,0]=3 1348 B9R0.42 CNC(=O)NC(C)C(C)C 273464a_100102657272_100000211541 [0,1,1,0,0,0|1,0,0]=3 1349 B9R0.42 CNC(=O)NC(C)C(C)C 512a_100000211541_100102657272 [0,1,1,0,0,0|1,0,0]=3 1350 B9R0.42 CNC(=O)NC(C)C(C)C 512a_106832991638_100000211541 [0,1,1,0,0,0|1,0,0]=3 1351 B9R0.42 COC(=O)CC(=O)C(C)C 1458a_100000210198_100000747449 [0,1,1,0,0,0|1,0,1]=4 1352 B9R0.42 COC(=O)CC(=O)C(C)C 1458a_100000211351_100000210206 [0,1,1,0,0,0|1,0,1]=4 1353 B9R0.42 COC(=O)CC(C)N(C)C 2230a_100102631434_100009817358 [0,1,1,0,0,0|2,0,0]=4 1354 B9R0.42 COC(=O)CC(C)N(C)C 269982a_100102631434_100009817358 [0,1,1,0,0,0|2,0,0]=4 1355 B9R0.42 COC(=O)CN(C)C(C)C 2230a_100000198492_100000210206 [0,1,1,0,0,0|2,0,0]=4 1356 B9R0.42 COC(=O)CN(C)C(C)C 269982a_200000211004_100000747449 [0,1,1,0,0,0|2,0,0]=4 1357 B9R0.48 C#CCC(=O)CCC(C)C 1458a_100000181311_100000184674 [0,1,1,0,0,0|1,0,1]=4 1358 B9R0.48 C#CCC(=O)CCC(C)C 1458a_100011220946_100000210312 [0,1,1,0,0,0|1,0,1]=4 1359 B9R0.48 C=C(C)CCC(=O)NCC 11a_100015525214_200000688413 [0,1,1,0,0,0|0,0,2]=4 1360 B9R0.48 C=C(C)CCC(=O)NCC 240690a_100015525214_200000688413 [0,1,1,0,0,0|0,0,2]=4 1361 B9R0.48 C=C(C)CCC(=O)NCC 527a_100015525214_200000688413 [0,1,1,0,0,0|0,0,2]=4 1362 B9R0.48 C=C(C)CCC(=O)NNC 22a_100016993582_200000688413 [0,1,1,0,0,0|0,0,2]=4 1363 B9R0.48 C=CCC(=O)CCC(C)C 1458a_100000181311_100000210623 [0,1,1,0,0,0|1,0,1]=4 1364 B9R0.48 C=CCC(=O)CCC(C)C 1458a_100000210193_100000210312 [0,1,1,0,0,0|1,0,1]=4 1365 B9R0.48 CC#CC(=O)CCC(C)C 1458a_100000763181_100000210312 [0,1,1,0,0,0|1,0,0]=3 1366 B9R0.48 CC#CC(=O)CCC(C)O 1458a_100000763181_100012276601 [0,1,1,0,0,0|2,0,0]=4 1367 B9R0.48 CC(C)CCC(=O)C=CBr 1458a_100016273825_100000210312 [0,1,1,0,0,0|1,0,1]=4 1368 B9R0.48 CC(C)CCC(=O)C=CCl 1458a_200016279998_100000210312 [0,1,1,0,0,0|1,0,1]=4 1369 B9R0.48 CC(C)CCC(=O)C=CI 1458a_100016256311_100000210312 [0,1,1,0,0,0|1,0,1]=4 1370 B9R0.48 CC(C)CCC(=O)CC#N 1458a_100000181311_100011214920 [0,1,1,0,0,0|1,0,1]=4 1371 B9R0.48 CC(C)CCC(=O)CC#N 1458a_100051588842_100000210312 [0,1,1,0,0,0|1,0,1]=4 1372 B9R0.48 CC(C)CCC(=O)CCF 1458a_100000181311_100011217306 [0,1,1,0,0,0|1,0,0]=3 1373 B9R0.48 CC(C)CCC(=O)CCO 1458a_100000181311_100000211926 [0,1,1,0,0,0|1,0,0]=3 1374 B9R0.48 CC(C)CCC(=O)CCO 1458a_100011216618_100000210312 [0,1,1,0,0,0|1,0,0]=3 1375 B9R0.48 CC(C)CNC(=O)CCO 240690a_100000210953_100011216618 [0,1,1,0,0,0|2,0,0]=4 1376 B9R0.48 CC(C)CNC(=O)CS[13CH3] 62a_100000183291_200025704644 [0,1,1,0,0,0|2,0,0]=4 1377 B9R0.48 CC(C)CNC(=O)CS[13CH3] 62a_200025704644_100000183291 [0,1,1,0,0,0|2,0,0]=4 1378 B9R0.48 CC(C)NCC(=O)NCO 2230a_100138425928_100000185155 [0,1,1,0,0,0|1,0,0]=3 1379 B9R0.48 CC(C)NCC(=O)NCO 34a_100138425928_100000185155 [0,1,1,0,0,0|1,0,0]=3 1380 B9R0.48 CC(C)OCC(=O)CCF 1458a_100000745533_100011217306 [0,1,1,0,0,0|2,0,0]=4 1381 B9R0.48 CC(C)OCC(=O)CCO 1458a_100000745533_100000211926 [0,1,1,0,0,0|2,0,0]=4 1382 B9R0.48 CC(C)OCC(=O)NCO 34a_100000212225_100000185155 [0,1,1,0,0,0|1,0,0]=3 1383 B9R0.48 CC(C)SCC(=O)CCF 1458a_100000241585_100011217306 [0,1,1,0,0,0|2,0,0]=4 1384 B9R0.48 CC(C)SCC(=O)CCO 1458a_100000241585_100000211926 [0,1,1,0,0,0|2,0,0]=4 1385 B9R0.48 CC(C)SCC(=O)NCO 62a_100000185155_100000210206 [0,1,1,0,0,0|1,0,0]=3 1386 B9R0.48 CC(C)SCC(=O)NCO 62a_100000210206_100000185155 [0,1,1,0,0,0|1,0,0]=3 1387 B9R0.48 CC(O)CCC(=O)CCO 1458a_100011216618_100012276601 [0,1,1,0,0,0|2,0,0]=4 1388 B9R0.48 CC=CC(=O)CCC(C)C 1458a_100000210699_100000210312 [0,1,1,0,0,0|1,0,0]=3 1389 B9R0.48 CC=CC(=O)CCC(C)O 1458a_100000210699_100012276601 [0,1,1,0,0,0|2,0,0]=4 1390 B9R0.48 CC=CC(=O)NCC(C)C 11a_100000210953_100000210699 [0,1,1,0,0,0|2,0,0]=4 1391 B9R0.48 CC=CC(=O)NCC(C)C 1626a_100000210953_100000210699 [0,1,1,0,0,0|2,0,0]=4 1392 B9R0.48 CC=CC(=O)NCC(C)C 240690a_100000210953_100000210699 [0,1,1,0,0,0|2,0,0]=4 1393 B9R0.48 CCCC(=O)CCC(C)C 1458a_100000181311_100000210303 [0,1,1,0,0,0|1,0,0]=3 1394 B9R0.48 CCCC(=O)CCC(C)C 1458a_100000211992_100000210312 [0,1,1,0,0,0|1,0,0]=3 1395 B9R0.48 CCCC(=O)CCC(C)O 1458a_100000211992_100012276601 [0,1,1,0,0,0|2,0,0]=4 1396 B9R0.48 CCCC(=O)CC[S+](C)C 1458a_100009452791_100000210303 [0,1,1,0,0,0|2,0,0]=4 1397 B9R0.48 CCCC(=O)CNC(C)C 2230a_100138425928_100000747444 [0,1,1,0,0,0|2,0,0]=4 1398 B9R0.48 CCCC(=O)COC(C)C 1458a_100000745533_100000210303 [0,1,1,0,0,0|2,0,0]=4 1399 B9R0.48 CCCC(=O)CSC(C)C 1458a_100000241585_100000210303 [0,1,1,0,0,0|2,0,0]=4 1400 B9R0.48 CCCC(=O)CSC(C)C 62a_100000210206_100000747444 [0,1,1,0,0,0|2,0,0]=4 1401 B9R0.48 CCCC(=O)CSC(C)C 62a_100000747444_100000210206 [0,1,1,0,0,0|2,0,0]=4 1402 B9R0.48 CCCC(=O)NCC(C)C 11a_100000210953_100000211992 [0,1,1,0,0,0|2,0,0]=4 1403 B9R0.48 CCCC(=O)NCC(C)C 1626a_100000210953_100000211992 [0,1,1,0,0,0|2,0,0]=4 1404 B9R0.48 CCCC(=O)NCC(C)C 240690a_100000210953_100000211992 [0,1,1,0,0,0|2,0,0]=4 1405 B9R0.48 CCCC(=O)NCC(C)C 527a_100000210953_100000211992 [0,1,1,0,0,0|2,0,0]=4 1406 B9R0.48 CCNC(=O)C=CC(C)C 11a_100015525214_100016268746 [0,1,1,0,0,0|0,0,2]=4 1407 B9R0.48 CCNC(=O)C=CC(C)C 240690a_100015525214_100016268746 [0,1,1,0,0,0|0,0,2]=4 1408 B9R0.48 CCNC(=O)CC=C(C)C 11a_100015525214_100011220947 [0,1,1,0,0,0|0,0,2]=4 1409 B9R0.48 CCNC(=O)CC=C(C)C 240690a_100015525214_100011220947 [0,1,1,0,0,0|0,0,2]=4 1410 B9R0.48 CCNC(=O)CC=C(C)C 527a_100015525214_100011220947 [0,1,1,0,0,0|0,0,2]=4 1411 B9R0.48 CCNC(=O)CCC(=O)C 1458a_100000199579_200000210301 [0,1,1,0,0,0|1,0,1]=4 1412 B9R0.48 CCNC(=O)CCC(=O)[13CH3] 1458a_100000199579_200025704644 [0,1,1,0,0,0|1,0,1]=4 1413 B9R0.48 CCNC(=O)CCC(C)C 11a_100015525214_100000181311 [0,1,1,0,0,0|0,0,0]=2 1414 B9R0.48 CCNC(=O)CCC(C)C 240690a_100015525214_100000181311 [0,1,1,0,0,0|0,0,0]=2 1415 B9R0.48 CCNC(=O)CCC(C)C 527a_100015525214_100000181311 [0,1,1,0,0,0|0,0,0]=2 1416 B9R0.48 CCNC(=O)CCN(C)C 11a_100015525214_100000689311 [0,1,1,0,0,0|1,0,0]=3 1417 B9R0.48 CCNC(=O)CCN(C)C 2230a_100102631434_100000737597 [0,1,1,0,0,0|1,0,0]=3 1418 B9R0.48 CCNC(=O)CCN(C)C 240690a_100015525214_100000689311 [0,1,1,0,0,0|1,0,0]=3 1419 B9R0.48 CCNC(=O)CCN(C)C 269982a_100102631434_100000737597 [0,1,1,0,0,0|1,0,0]=3 1420 B9R0.48 CCNC(=O)CCN(C)C 527a_100015525214_100000689311 [0,1,1,0,0,0|1,0,0]=3 1421 B9R0.48 CCNC(=O)CC[S+](C)C 11a_100015525214_100009452791 [0,1,1,0,0,0|1,0,0]=3 1422 B9R0.48 CCNC(=O)CC[S+](C)C 240690a_100015525214_100009452791 [0,1,1,0,0,0|1,0,0]=3 1423 B9R0.48 CCNC(=O)CNC(C)C 2230a_100016988866_100000210206 [0,1,1,0,0,0|1,0,0]=3 1424 B9R0.48 CCNC(=O)CNC(C)C 2230a_100138425928_100000183381 [0,1,1,0,0,0|1,0,0]=3 1425 B9R0.48 CCNC(=O)CNC(C)C 34a_100138425928_100000183381 [0,1,1,0,0,0|1,0,0]=3 1426 B9R0.48 CCNC(=O)COC(C)C 11a_100015525214_100000745533 [0,1,1,0,0,0|1,0,0]=3 1427 B9R0.48 CCNC(=O)COC(C)C 240690a_100015525214_100000745533 [0,1,1,0,0,0|1,0,0]=3 1428 B9R0.48 CCNC(=O)COC(C)C 34a_100000212225_100000183381 [0,1,1,0,0,0|1,0,0]=3 1429 B9R0.48 CCNC(=O)COC(C)C 527a_100015525214_100000745533 [0,1,1,0,0,0|1,0,0]=3 1430 B9R0.48 CCNC(=O)CSC(C)C 11a_100015525214_100000241585 [0,1,1,0,0,0|1,0,0]=3 1431 B9R0.48 CCNC(=O)CSC(C)C 240690a_100015525214_100000241585 [0,1,1,0,0,0|1,0,0]=3 1432 B9R0.48 CCNC(=O)CSC(C)C 527a_100015525214_100000241585 [0,1,1,0,0,0|1,0,0]=3 1433 B9R0.48 CCNC(=O)CSC(C)C 62a_100000183381_100000210206 [0,1,1,0,0,0|1,0,0]=3 1434 B9R0.48 CCNC(=O)CSC(C)C 62a_100000210206_100000183381 [0,1,1,0,0,0|1,0,0]=3 1435 B9R0.48 CCNC(=O)NCC(C)C 2708a_100000210953_100015525214 [0,1,1,0,0,0|1,0,0]=3 1436 B9R0.48 CCNC(=O)NCC(C)C 2708a_100015525214_100000210953 [0,1,1,0,0,0|1,0,0]=3 1437 B9R0.48 CCNC(=O)NCC(C)C 273464a_100000210953_100015525214 [0,1,1,0,0,0|1,0,0]=3 1438 B9R0.48 CCNC(=O)NCC(C)C 273464a_100015525214_100000210953 [0,1,1,0,0,0|1,0,0]=3 1439 B9R0.48 CCNC(=O)NCC(C)C 512a_100000210953_100015525214 [0,1,1,0,0,0|1,0,0]=3 1440 B9R0.48 CCNC(=O)NCC(C)C 512a_100015525214_100000210953 [0,1,1,0,0,0|1,0,0]=3 1441 B9R0.48 CCNC(=O)NCC(C)O 2708a_100015525214_100000210904 [0,1,1,0,0,0|2,0,0]=4 1442 B9R0.48 CCNC(=O)NCC(C)O 273464a_100000210904_100015525214 [0,1,1,0,0,0|2,0,0]=4 1443 B9R0.48 CCNC(=O)NCC(C)O 273464a_100015525214_100000210904 [0,1,1,0,0,0|2,0,0]=4 1444 B9R0.48 CCNC(=O)NCC(C)O 512a_100000210904_100015525214 [0,1,1,0,0,0|2,0,0]=4 1445 B9R0.48 CCNC(=O)NCC(C)O 512a_100015525214_100000210904 [0,1,1,0,0,0|2,0,0]=4 1446 B9R0.48 CCNC(=O)NNC(C)C 273464a_100015525214_100000741168 [0,1,1,0,0,0|2,0,0]=4 1447 B9R0.48 CCNC(=O)NNC(C)C 512a_100000741168_100015525214 [0,1,1,0,0,0|2,0,0]=4 1448 B9R0.48 CCNC(=O)NNC(C)C 512a_100015525214_100000741168 [0,1,1,0,0,0|2,0,0]=4 1449 B9R0.48 CCNC(C)CCC(C)C 2230a_100015525214_100011261404 [0,1,1,0,0,0|1,0,1]=4 1450 B9R0.48 CCNC(C)CCC(C)C 2230a_100138410893_100000210202 [0,1,1,0,0,0|1,0,1]=4 1451 B9R0.48 CCNC(C)CCC(C)C 270004a_100015525214_100000210476 [0,1,1,0,0,0|1,0,1]=4 1452 B9R0.48 CCOC(=O)CCN(C)C 2230a_100000745921_200000210301 [0,1,1,0,0,0|2,0,0]=4 1453 B9R0.48 CCOC(=O)CCN(C)C 2230a_100102631434_100011206558 [0,1,1,0,0,0|2,0,0]=4 1454 B9R0.48 CCOC(=O)CCN(C)C 269982a_100000745921_200000210301 [0,1,1,0,0,0|2,0,0]=4 1455 B9R0.48 CCOC(=O)CCN(C)C 269982a_100102631434_100011206558 [0,1,1,0,0,0|2,0,0]=4 1456 B9R0.48 CCOC(=O)CCN(C)[13CH3] 2230a_100000745921_200025704644 [0,1,1,0,0,0|2,0,0]=4 1457 B9R0.48 CCOC(=O)CCN(C)[13CH3] 269982a_100000745921_200025704644 [0,1,1,0,0,0|2,0,0]=4 1458 B9R0.48 CCOC(=O)CNC(C)C 2230a_100138425928_100000188475 [0,1,1,0,0,0|2,0,0]=4 1459 B9R0.48 CCOC(=O)CNC(C)C 34a_100138425928_100000188475 [0,1,1,0,0,0|2,0,0]=4 1460 B9R0.48 CCOC(=O)COC(C)C 34a_100000212225_100000188475 [0,1,1,0,0,0|2,0,0]=4 1461 B9R0.48 CCOC(=O)CSC(C)C 62a_100000188475_100000210206 [0,1,1,0,0,0|2,0,0]=4 1462 B9R0.48 CCOC(=O)CSC(C)C 62a_100000210206_100000188475 [0,1,1,0,0,0|2,0,0]=4 1463 B9R0.48 CNCC(=O)NCC(C)C 2230a_106832991635_100000183291 [0,1,1,0,0,0|1,0,0]=3 1464 B9R0.48 CNCC(=O)NCC(C)C 34a_100102657272_100000183291 [0,1,1,0,0,0|1,0,0]=3 1465 B9R0.48 CNCC(=O)NCC(C)C 7a_106832991635_100000183291 [0,1,1,0,0,0|1,0,0]=3 1466 B9R0.48 CNNC(=O)C=CC(C)C 22a_100016993582_100016268746 [0,1,1,0,0,0|0,0,2]=4 1467 B9R0.48 CNNC(=O)CC=C(C)C 22a_100016993582_100011220947 [0,1,1,0,0,0|0,0,2]=4 1468 B9R0.48 CNNC(=O)CCC(C)C 22a_100016993582_100000181311 [0,1,1,0,0,0|0,0,0]=2 1469 B9R0.48 CNNC(=O)CCN(C)C 22a_100016993582_100000689311 [0,1,1,0,0,0|1,0,0]=3 1470 B9R0.48 CNNC(=O)CC[S+](C)C 22a_100016993582_100009452791 [0,1,1,0,0,0|1,0,0]=3 1471 B9R0.48 CNNC(=O)COC(C)C 22a_100016993582_100000745533 [0,1,1,0,0,0|1,0,0]=3 1472 B9R0.48 CNNC(=O)CSC(C)C 22a_100016993582_100000241585 [0,1,1,0,0,0|1,0,0]=3 1473 B9R0.48 CNNC(=O)NCC(C)C 273464a_100000210953_100016993582 [0,1,1,0,0,0|1,0,0]=3 1474 B9R0.48 CNNC(=O)NCC(C)C 512a_100000210953_100016993582 [0,1,1,0,0,0|1,0,0]=3 1475 B9R0.48 CNNC(=O)NCC(C)C 512a_100016993582_100000210953 [0,1,1,0,0,0|1,0,0]=3 1476 B9R0.48 CNNC(=O)NCC(C)O 273464a_100000210904_100016993582 [0,1,1,0,0,0|2,0,0]=4 1477 B9R0.48 CNNC(=O)NCC(C)O 512a_100000210904_100016993582 [0,1,1,0,0,0|2,0,0]=4 1478 B9R0.48 CNNC(=O)NCC(C)O 512a_100016993582_100000210904 [0,1,1,0,0,0|2,0,0]=4 1479 B9R0.48 CNNC(=O)NNC(C)C 512a_100000741168_100016993582 [0,1,1,0,0,0|2,0,0]=4 1480 B9R0.48 CNNC(=O)NNC(C)C 512a_100016993582_100000741168 [0,1,1,0,0,0|2,0,0]=4 1481 B9R0.48 COCC(=O)CCC(C)C 1458a_100000210968_100000210312 [0,1,1,0,0,0|1,0,0]=3 1482 B9R0.48 COCC(=O)CCC(C)O 1458a_100000210968_100012276601 [0,1,1,0,0,0|2,0,0]=4 1483 B9R0.48 COCC(=O)NCC(C)C 11a_100000210953_100000210968 [0,1,1,0,0,0|2,0,0]=4 1484 B9R0.48 COCC(=O)NCC(C)C 1626a_100000210953_100000210968 [0,1,1,0,0,0|2,0,0]=4 1485 B9R0.48 COCC(=O)NCC(C)C 240690a_100000210953_100000210968 [0,1,1,0,0,0|2,0,0]=4 1486 B9R0.48 COCC(=O)NCC(C)C 34a_100138415774_100000183291 [0,1,1,0,0,0|2,0,0]=4 1487 B9R0.48 COCC(=O)NCC(C)C 527a_100000210953_100000210968 [0,1,1,0,0,0|2,0,0]=4 1488 B9R0.48 CSCC(=O)CCC(C)C 1458a_100000184570_100000210312 [0,1,1,0,0,0|1,0,0]=3 1489 B9R0.48 CSCC(=O)CCC(C)O 1458a_100000184570_100012276601 [0,1,1,0,0,0|2,0,0]=4 1490 B9R0.48 CSCC(=O)NCC(C)C 11a_100000210953_100000184570 [0,1,1,0,0,0|2,0,0]=4 1491 B9R0.48 CSCC(=O)NCC(C)C 1626a_100000210953_100000184570 [0,1,1,0,0,0|2,0,0]=4 1492 B9R0.48 CSCC(=O)NCC(C)C 240690a_100000210953_100000184570 [0,1,1,0,0,0|2,0,0]=4 1493 B9R0.48 CSCC(=O)NCC(C)C 527a_100000210953_100000184570 [0,1,1,0,0,0|2,0,0]=4 1494 B9R0.48 CSCC(=O)NCC(C)C 62a_100000183291_200000210301 [0,1,1,0,0,0|2,0,0]=4 1495 B9R0.48 CSCC(=O)NCC(C)C 62a_200000210301_100000183291 [0,1,1,0,0,0|2,0,0]=4 1496 B9R0.48 C[S+](C)CCC(=O)CCF 1458a_100009452791_100011217306 [0,1,1,0,0,0|2,0,0]=4 1497 B9R0.48 C[S+](C)CCC(=O)CCO 1458a_100009452791_100000211926 [0,1,1,0,0,0|2,0,0]=4 1498 B9R0.64 CNC(C)(C)CCC(C)C 34a_100102657272_200000037585 [0,1,1,0,0,0|1,0,1]=4 1499 B9R0.64 CNS(=O)(=O)CCC(C)C 270084a_100102657272_100000750698 [0,1,1,0,0,0|1,0,0]=3 1500 B9R0.64 CNS(=O)(=O)CCC(C)C 274078a_100102657272_100000750698 [0,1,1,0,0,0|1,0,0]=3 1501 B9R0.19 C#CCN(C)C(C)(C)CC 2230a_200000755171_100000038162 [0,1,1,0,0,0|1,0,1]=4 1502 B9R0.19 C=CCN(C)C(C)(C)CC 2230a_200000755171_100000210623 [0,1,1,0,0,0|1,0,0]=3 1503 B9R0.19 C=CCN(C)C(C)(C)CC 269982a_100000225617_100000032637 [0,1,1,0,0,0|1,0,0]=3 1504 B9R0.19 C=CCN(C)C(C)(C)CC 269982a_200000755171_100000210623 [0,1,1,0,0,0|1,0,0]=3 1505 B9R0.19 C=CCN(C)C(C)(C)CO 269982a_100015204102_100000210623 [0,1,1,0,0,0|2,0,0]=4 1506 B9R0.19 CCC(C)(C)N(C)CC#N 2230a_200000755171_100011215382 [0,1,1,0,0,0|1,0,1]=4 1507 B9R0.19 CCC(C)(C)N(C)CC#N 269982a_200000755171_100011214920 [0,1,1,0,0,0|1,0,1]=4 1508 B9R0.19 CCC(C)(C)N(C)CC=O 2230a_200000755171_200015260668 [0,1,1,0,0,0|0,0,0]=2 1509 B9R0.19 CCC(C)(C)N(C)CC=O 269982a_200000755171_200015260668 [0,1,1,0,0,0|0,0,0]=2 1510 B9R0.19 CCC(C)(C)N(C)CCF 2230a_200000755171_100011217306 [0,1,1,0,0,0|1,0,1]=4 1511 B9R0.19 CCC(C)(C)N(C)CCF 269982a_200000755171_100011217306 [0,1,1,0,0,0|1,0,1]=4 1512 B9R0.19 CCC(C)(C)N(C)CCO 2230a_200000755171_100000211926 [0,1,1,0,0,0|0,0,2]=4 1513 B9R0.19 CCC(C)(C)N(C)CCO 269982a_100000210263_100000032637 [0,1,1,0,0,0|0,0,2]=4 1514 B9R0.19 CCC(C)(C)N(C)CCO 269982a_200000755171_100000211926 [0,1,1,0,0,0|0,0,2]=4 1515 B9R0.19 CCC(C)(C)N(C)COC 2230a_200000755171_100000766300 [0,1,1,0,0,0|0,0,2]=4 1516 B9R0.19 CCC(C)(C)N(C)COC 269982a_200000755171_100000766300 [0,1,1,0,0,0|0,0,2]=4 1517 B9R0.19 CCC(C)(C)N(C)CSC 2230a_200000755171_100011218213 [0,1,1,0,0,0|0,1,1]=4 1518 B9R0.19 CCC(C)(C)N(C)CSC 269982a_200000755171_100011218213 [0,1,1,0,0,0|0,1,1]=4 1519 B9R0.19 CCCN(C)C(C)(C)CC 2230a_200000755171_100000210303 [0,1,1,0,0,0|1,0,1]=4 1520 B9R0.19 CCCN(C)C(C)(C)CC 269982a_100000747261_100000032637 [0,1,1,0,0,0|1,0,1]=4 1521 B9R0.19 CCCN(C)C(C)(C)CC 269982a_200000755171_100000210303 [0,1,1,0,0,0|1,0,1]=4 1522 B9R0.19 CN(CC=O)C(C)(C)CO 269982a_100015204102_200015260668 [0,1,1,0,0,0|1,0,0]=3 1523 B9R0.60 CCN(C)C(C)(C)COC 2230a_100000734271_100000210202 [0,1,1,0,0,0|1,0,1]=4 1524 B9R0.60 CCN(C)C(C)(C)COC 269982a_100000734271_100000204670 [0,1,1,0,0,0|1,0,1]=4 1525 B9R0.60 COCC(C)(C)N(C)CF 269982a_100000734271_100015361967 [0,1,1,0,0,0|1,0,1]=4 1526 B9R0.69 CCN(C)C(C)(CC)CC 269982a_100000225621_100009817345 [0,1,1,0,0,0|1,0,1]=4 1527 B9R0.71 CCN(CC)C(C)(C)CC 269956a_100000042499_100000032637 [0,1,1,0,0,0|1,0,1]=4 1528 B9R0.71 CCN(CC)C(C)(C)CC 269982a_100000724800_100000032637 [0,1,1,0,0,0|1,0,1]=4 1529 B9R0.20 C=CCCNC(C)(C)CC 2230a_100000211385_100000754431 [0,1,1,0,0,0|2,0,0]=4 1530 B9R0.20 C=CCCOC(C)(C)CC 7a_100000210230_100000754431 [0,1,1,0,0,0|2,0,0]=4 1531 B9R0.20 C=CCCSC(C)(C)CC 62a_100000032637_100000754431 [0,1,1,0,0,0|2,0,0]=4 1532 B9R0.20 C=CCCSC(C)(C)CC 62a_100000754431_100000032637 [0,1,1,0,0,0|2,0,0]=4 1533 B9R0.20 C=CCNCC(C)(C)OC 2230a_100000763424_100000210623 [0,1,1,0,0,0|2,0,0]=4 1534 B9R0.20 C=CCNCC(C)(C)SC 270004a_100020586998_100009845794 [0,1,1,0,0,0|2,0,0]=4 1535 B9R0.20 C=CCOCC(C)(C)CC 7a_100000765029_100015514636 [0,1,1,0,0,0|2,0,0]=4 1536 B9R0.20 C=CCOCC(C)(C)OC 34a_200000210373_100000701081 [0,1,1,0,0,0|2,0,0]=4 1537 B9R0.20 C=CCSCC(C)(C)OC 62a_100000210623_100000701081 [0,1,1,0,0,0|2,0,0]=4 1538 B9R0.20 C=CCSCC(C)(C)OC 62a_100000701081_100000210623 [0,1,1,0,0,0|2,0,0]=4 1539 B9R0.20 CC(C)(CCl)COCC=O 7a_100011217199_200015260668 [0,1,1,0,0,0|2,0,0]=4 1540 B9R0.20 CC(C)(CO)CNCC=O 2230a_100020635058_200015260668 [0,1,1,0,0,0|2,0,0]=4 1541 B9R0.20 CC(C)(CO)CSCC=O 62a_100009813988_200015260668 [0,1,1,0,0,0|2,0,0]=4 1542 B9R0.20 CC(C)(CO)CSCC=O 62a_200015260668_100009813988 [0,1,1,0,0,0|2,0,0]=4 1543 B9R0.20 CCC(C)(C)COCC=O 7a_100000765029_200015260668 [0,1,1,0,0,0|1,0,0]=3 1544 B9R0.20 COC(C)(C)CNCC=O 2230a_100000763424_200015260668 [0,1,1,0,0,0|1,0,0]=3 1545 B9R0.20 COC(C)(C)CSCC=O 62a_100000701081_200015260668 [0,1,1,0,0,0|1,0,0]=3 1546 B9R0.20 COC(C)(C)CSCC=O 62a_200015260668_100000701081 [0,1,1,0,0,0|1,0,0]=3 1547 B9R0.51 C=CCSC(C)(C)N(C)C 62a_100000210623_217856628674 [0,1,1,0,0,0|2,0,0]=4 1548 B9R0.51 C=CCSC(C)(C)N(C)C 62a_217856628674_100000210623 [0,1,1,0,0,0|2,0,0]=4 1549 B9R0.51 CC(=O)C(C)(C)OCC=O 34a_100000747739_200009817547 [0,1,1,0,0,0|2,0,0]=4 1550 B9R0.51 CC(=O)C(C)(C)OCC=O 7a_100000747739_200015260668 [0,1,1,0,0,0|2,0,0]=4 1551 B9R0.51 CC(=O)C(C)(C)SCC=O 62a_100000075568_200015260668 [0,1,1,0,0,0|2,0,0]=4 1552 B9R0.51 CC(=O)C(C)(C)SCC=O 62a_200015260668_100000075568 [0,1,1,0,0,0|2,0,0]=4 1553 B9R0.51 CC(C)C(C)(C)NCC=O 2230a_200160471154_200015260668 [0,1,1,0,0,0|2,0,0]=4 1554 B9R0.51 CC(C)C(C)(C)OCC=O 7a_100011215261_200015260668 [0,1,1,0,0,0|2,0,0]=4 1555 B9R0.51 CN(C)C(C)(C)SCC=O 62a_200015260668_217856628674 [0,1,1,0,0,0|1,0,0]=3 1556 B9R0.51 CN(C)C(C)(C)SCC=O 62a_217856628674_200015260668 [0,1,1,0,0,0|1,0,0]=3 1557 B9R0.66 CC(C)(CCBr)OCC=O 7a_100000702414_200015260668 [0,1,1,0,0,0|2,0,0]=4 1558 B9R0.66 CCCC(C)(C)OCC=O 7a_100000748436_200015260668 [0,1,1,0,0,0|2,0,0]=4 1559 B9R0.66 CNCC(C)(C)CCC#N 270004a_106832991635_100000050660 [0,1,1,0,0,0|1,0,1]=4 1560 B9R0.66 COCC(C)(C)NCC=O 2230a_100000752728_200015260668 [0,1,1,0,0,0|2,0,0]=4 1561 B9R0.66 CSCC(C)(C)NCC=O 2230a_100000759623_200015260668 [0,1,1,0,0,0|2,0,0]=4 1562 B9R0.66 CSCC(C)(C)NCC=O 7a_100000759623_200015260668 [0,1,1,0,0,0|2,0,0]=4 1563 B9R0.67 CCC(C)(CC)OCC=O 7a_100000755174_200015260668 [0,1,1,0,0,0|2,0,0]=4 1564 B9R0.67 CCC(C)(CC)SCC=O 62a_100009817345_200015260668 [0,1,1,0,0,0|2,0,0]=4 1565 B9R0.67 CCC(C)(CC)SCC=O 62a_200015260668_100009817345 [0,1,1,0,0,0|2,0,0]=4 1566 B9R0.49 CN(C(C)(C)C)C(C)(C)C 269982a_100011215553_100000210625 [0,1,1,0,0,0|1,0,1]=4 1567 B9R0.72 CC(C)(C)[C@@H](N[13CH3])C(=O)O 269956a_100000753415_200025704644 [0,1,1,0,0,0|2,0,0]=4 1568 B9R0.72 CC(C)(C)[C@H](N[13CH3])C(=O)N 2230a_100000765447_200025704644 [0,1,1,0,0,0|2,0,0]=4 1569 B9R0.72 CC(C)(C)[C@H](N[13CH3])C(=O)N 34a_100000765447_200025704644 [0,1,1,0,0,0|2,0,0]=4 1570 B9R0.72 CC(C)N(CF)C(C)(C)C 269982a_200020682127_100015361967 [0,1,1,0,0,0|1,0,1]=4 1571 B9R0.72 CCN(C(=O)C)C(C)(C)C 11a_100011200764_100015343762 [0,1,1,0,0,0|0,0,0]=2 1572 B9R0.72 CCN(C(=O)C)C(C)(C)C 1626a_100011200764_100015343762 [0,1,1,0,0,0|0,0,0]=2 1573 B9R0.72 CCN(C(=O)C)C(C)(C)C 240690a_100011200764_100015343762 [0,1,1,0,0,0|0,0,0]=2 1574 B9R0.72 CCN(C(C)C)C(C)(C)C 2230a_100011200764_100000210206 [0,1,1,0,0,0|1,0,1]=4 1575 B9R0.72 CCN(C(C)C)C(C)(C)C 269982a_100000223864_100000210625 [0,1,1,0,0,0|1,0,1]=4 1576 B9R0.72 CCN(C(C)C)C(C)(C)C 269982a_100011200764_100000210206 [0,1,1,0,0,0|1,0,1]=4 1577 B9R0.72 CCN(C(C)C)C(C)(C)C 269982a_200020682127_100000204670 [0,1,1,0,0,0|1,0,1]=4 1578 B9R0.72 CN[C@@H](C(=O)O)C(C)(C)C 269956a_100000753415_200000210301 [0,1,1,0,0,0|2,0,0]=4 1579 B9R0.72 CN[C@H](C(=O)N)C(C)(C)C 2230a_100000765447_200000210301 [0,1,1,0,0,0|2,0,0]=4 1580 B9R0.72 CN[C@H](C(=O)N)C(C)(C)C 34a_100000765447_200000210301 [0,1,1,0,0,0|2,0,0]=4 1581 B9R1.24 CC1(CCCC1O[13CH3])C 34a_100000726220_200025704644 [1,1,0,0,0,0|1,0,1]=4 1582 B9R1.24 CC1(CCCC1O[13CH3])C 7a_100000726220_200025704644 [1,1,0,0,0,0|1,0,1]=4 1583 B9R1.24 CC1(CCCN1CF)C 269982a_100000761399_100015361967 [1,1,0,0,0,0|0,0,1]=3 1584 B9R1.24 CC1(CCCN1CF)C 34a_100000761399_100015361967 [1,1,0,0,0,0|0,0,1]=3 1585 B9R1.24 CC1(COCN1CF)C 269982a_100000043020_100015361967 [1,1,0,0,0,0|1,0,1]=4 1586 B9R1.24 CC1(SCCN1CF)C 269982a_100011217261_100015361967 [1,1,0,0,0,0|1,0,1]=4 1587 B9R1.24 CC1(SCCN1CF)C 34a_100011217261_100015361967 [1,1,0,0,0,0|1,0,1]=4 1588 B9R1.24 CCN1CCCC1(C)C 2230a_100000761399_100000210202 [1,1,0,0,0,0|0,0,1]=3 1589 B9R1.24 CCN1CCCC1(C)C 269982a_100000761399_100000204670 [1,1,0,0,0,0|0,0,1]=3 1590 B9R1.24 CCN1CCCC1(C)C 34a_100000761399_100000210202 [1,1,0,0,0,0|0,0,1]=3 1591 B9R1.24 CCN1CCSC1(C)C 2230a_100011217261_100000210202 [1,1,0,0,0,0|1,0,1]=4 1592 B9R1.24 CCN1CCSC1(C)C 269982a_100011217261_100000204670 [1,1,0,0,0,0|1,0,1]=4 1593 B9R1.24 CCN1CCSC1(C)C 34a_100011217261_100000210202 [1,1,0,0,0,0|1,0,1]=4 1594 B9R1.24 CCN1COCC1(C)C 2230a_100000043020_100000210202 [1,1,0,0,0,0|1,0,1]=4 1595 B9R1.24 CCN1COCC1(C)C 269982a_100000043020_100000204670 [1,1,0,0,0,0|1,0,1]=4 1596 B9R1.24 CNC1CCCC1(C)C 269862a_106832991636_100000065263 [1,1,0,0,0,0|1,0,1]=4 1597 B9R1.24 COC1CCCC1(C)C 34a_100000726220_200000210301 [1,1,0,0,0,0|1,0,1]=4 1598 B9R1.24 COC1CCCC1(C)C 7a_100000726220_200000210301 [1,1,0,0,0,0|1,0,1]=4 1599 B9R1.106 CC1CCN(C1(C)C)C 2230a_102516457003_200000210301 [1,1,0,0,0,0|0,0,1]=3 1600 B9R1.106 CC1CCN(C1(C)C)C 269982a_102516457003_200000210301 [1,1,0,0,0,0|0,0,1]=3 1601 B9R1.106 CC1CCN(C1(C)C)C 34a_102516457003_200000210301 [1,1,0,0,0,0|0,0,1]=3 1602 B9R1.106 CC1CCN(C1(C)C)[13CH3] 2230a_102516457003_200025704644 [1,1,0,0,0,0|0,0,1]=3 1603 B9R1.106 CC1CCN(C1(C)C)[13CH3] 269982a_102516457003_200025704644 [1,1,0,0,0,0|0,0,1]=3 1604 B9R1.106 CC1CCN(C1(C)C)[13CH3] 34a_102516457003_200025704644 [1,1,0,0,0,0|0,0,1]=3 1605 B9R1.202 CN1CCC[C@@]1(C)CO 2230a_100016195882_200000210301 [1,1,0,0,0,0|0,0,1]=3 1606 B9R1.202 CN1CCC[C@@]1(C)CO 269982a_100016195882_200000210301 [1,1,0,0,0,0|0,0,1]=3 1607 B9R1.202 CN1CCC[C@@]1(C)CO 34a_100016195882_200000210301 [1,1,0,0,0,0|0,0,1]=3 1608 B9R1.202 C[C@]1(CCCN1[13CH3])CO 2230a_100016195882_200025704644 [1,1,0,0,0,0|0,0,1]=3 1609 B9R1.202 C[C@]1(CCCN1[13CH3])CO 269982a_100016195882_200025704644 [1,1,0,0,0,0|0,0,1]=3 1610 B9R1.202 C[C@]1(CCCN1[13CH3])CO 34a_100016195882_200025704644 [1,1,0,0,0,0|0,0,1]=3 1611 B9R1.27 CC1CCC(N1CF)C 269982a_100000687148_100015361967 [1,1,0,0,0,0|1,0,1]=4 1612 B9R1.27 CC1CCC(N1CF)C 34a_100000687148_100015361967 [1,1,0,0,0,0|1,0,1]=4 1613 B9R1.27 CCN1C(CCC1C)C 2230a_100000687148_100000210202 [1,1,0,0,0,0|1,0,1]=4 1614 B9R1.27 CCN1C(CCC1C)C 269982a_100000687148_100000204670 [1,1,0,0,0,0|1,0,1]=4 1615 B9R1.27 CCN1C(CCC1C)C 34a_100000687148_100000210202 [1,1,0,0,0,0|1,0,1]=4 1616 B11R1.1322 CC1(CCCC(N1[13CH3])(C)C)C 269982a_100011193410_200025704644 [0,1,0,0,0,1|1,0,1]=4 1617 B11R1.1322 CC1(CCCC(N1[13CH3])(C)C)C 34a_100011193410_200025704644 [0,1,0,0,0,1|1,0,1]=4 1618 B11R1.1322 CC1(CCCC(N1[13CH3])(C)C)C 7a_100011193410_200025704644 [0,1,0,0,0,1|1,0,1]=4 1619 B11R1.1322 CN1C(CCCC1(C)C)(C)C 269982a_100011193410_200000210301 [0,1,0,0,0,1|1,0,1]=4 1620 B11R1.1322 CN1C(CCCC1(C)C)(C)C 34a_100011193410_200000210301 [0,1,0,0,0,1|1,0,1]=4 1621 B11R1.1322 CN1C(CCCC1(C)C)(C)C 7a_100011193410_200000210301 [0,1,0,0,0,1|1,0,1]=4 1622 B11R1.304 C#CCN1C(CCC1(C)C)C 2230a_100015204717_100000038162 [0,2,0,0,0,0|1,0,1]=4 1623 B11R1.304 C#CCN1C(CCC1(C)C)C 34a_100015204717_100000184674 [0,2,0,0,0,0|1,0,1]=4 1624 B11R1.304 C=CCN1C(CCC1(C)C)C 2230a_100015204717_100000210623 [0,2,0,0,0,0|1,0,1]=4 1625 B11R1.304 C=CCN1C(CCC1(C)C)C 269982a_100015204717_100000210623 [0,2,0,0,0,0|1,0,1]=4 1626 B11R1.304 C=CCN1C(CCC1(C)C)C 34a_100015204717_100015514636 [0,2,0,0,0,0|1,0,1]=4 1627 B11R1.304 CC1(COC(=O)[C@@H]1OCF)C 34a_100009815050_100015361967 [0,2,0,0,0,0|2,0,0]=4 1628 B11R1.304 CC1(COC(=O)[C@@H]1OCF)C 7a_100009815050_100015361967 [0,2,0,0,0,0|2,0,0]=4 1629 B11R1.304 CC1CCC(N1CC#N)(C)C 2230a_100015204717_100011215382 [0,2,0,0,0,0|1,0,1]=4 1630 B11R1.304 CC1CCC(N1CC#N)(C)C 269982a_100015204717_100011214920 [0,2,0,0,0,0|1,0,1]=4 1631 B11R1.304 CC1CCC(N1CC=O)(C)C 2230a_100015204717_200015260668 [0,2,0,0,0,0|1,0,1]=4 1632 B11R1.304 CC1CCC(N1CC=O)(C)C 269982a_100015204717_200015260668 [0,2,0,0,0,0|1,0,1]=4 1633 B11R1.304 CC1CCC(N1CC=O)(C)C 34a_100015204717_200009817547 [0,2,0,0,0,0|1,0,1]=4 1634 B11R1.304 CC1CCC(N1CCF)(C)C 2230a_100015204717_100011217306 [0,2,0,0,0,0|1,0,1]=4 1635 B11R1.304 CC1CCC(N1CCF)(C)C 269982a_100015204717_100011217306 [0,2,0,0,0,0|1,0,1]=4 1636 B11R1.304 CC1CCC(N1CCF)(C)C 34a_100015204717_100011217306 [0,2,0,0,0,0|1,0,1]=4 1637 B11R1.304 CC1CCC(N1CCO)(C)C 2230a_100015204717_100000211926 [0,2,0,0,0,0|1,0,1]=4 1638 B11R1.304 CC1CCC(N1CCO)(C)C 269982a_100015204717_100000211926 [0,2,0,0,0,0|1,0,1]=4 1639 B11R1.304 CC1CCC(N1CCO)(C)C 34a_100015204717_100000211926 [0,2,0,0,0,0|1,0,1]=4 1640 B11R1.304 CCCN1C(CCC1(C)C)C 2230a_100015204717_100000210303 [0,2,0,0,0,0|1,0,1]=4 1641 B11R1.304 CCCN1C(CCC1(C)C)C 269982a_100015204717_100000210303 [0,2,0,0,0,0|1,0,1]=4 1642 B11R1.304 CCCN1C(CCC1(C)C)C 34a_100015204717_100000210303 [0,2,0,0,0,0|1,0,1]=4 1643 B11R1.304 CCO[C@H]1C(=O)OCC1(C)C 34a_100009815050_100000210202 [0,2,0,0,0,0|2,0,0]=4 1644 B11R1.304 CCO[C@H]1C(=O)OCC1(C)C 7a_100009815050_100000210202 [0,2,0,0,0,0|2,0,0]=4 1645 B11R1.304 COCN1C(CCC1(C)C)C 2230a_100015204717_100000766300 [0,2,0,0,0,0|1,0,1]=4 1646 B11R1.304 COCN1C(CCC1(C)C)C 269982a_100015204717_100000766300 [0,2,0,0,0,0|1,0,1]=4 1647 B11R1.304 CSCN1C(CCC1(C)C)C 2230a_100015204717_100011218213 [0,2,0,0,0,0|1,0,1]=4 1648 B11R1.304 CSCN1C(CCC1(C)C)C 269982a_100015204717_100011218213 [0,2,0,0,0,0|1,0,1]=4 1649 B11R1.304 CSCN1C(CCC1(C)C)C 34a_100015204717_100011218213 [0,2,0,0,0,0|1,0,1]=4 1650 B11R1.1040 CC(=O)N1C(CCC1(C)C)C 11a_100015204717_100015343762 [0,2,0,0,0,0|1,0,1]=4 1651 B11R1.1040 CC(=O)N1C(CCC1(C)C)C 1626a_100015204717_100015343762 [0,2,0,0,0,0|1,0,1]=4 1652 B11R1.1040 CC(=O)N1C(CCC1(C)C)C 240690a_100015204717_100015343762 [0,2,0,0,0,0|1,0,1]=4 1653 B11R1.1040 CC(C)N1C(CCC1(C)C)C 2230a_100015204717_100000210206 [0,2,0,0,0,0|1,0,1]=4 1654 B11R1.1040 CC(C)N1C(CCC1(C)C)C 269982a_100015204717_100000210206 [0,2,0,0,0,0|1,0,1]=4 1655 B11R1.1040 CC(C)N1C(CCC1(C)C)C 34a_100015204717_100000210206 [0,2,0,0,0,0|1,0,1]=4 1656 B11R1.515 CC(=O)N1CCC(C1C)(C)C 11a_100102837566_100015343762 [0,2,0,0,0,0|2,0,0]=4 1657 B11R1.515 CC(=O)N1CCC(C1C)(C)C 1626a_100102837566_100015343762 [0,2,0,0,0,0|2,0,0]=4 1658 B11R1.515 CC(=O)N1CCC(C1C)(C)C 240690a_100102837566_100015343762 [0,2,0,0,0,0|2,0,0]=4 1659 B11R1.515 CC(=O)N1CCC(C1C)(C)C 527a_100102837566_100103153847 [0,2,0,0,0,0|2,0,0]=4 1660 B11R1.515 CC1(SCC(N1[13CH3])C(=O)O)C 269956a_100000706825_200025704644 [0,2,0,0,0,0|1,0,1]=4 1661 B11R1.515 CN1C(CSC1(C)C)C(=O)O 269956a_100000706825_200000210301 [0,2,0,0,0,0|1,0,1]=4 1662 B11R1.761 CC1N(CCC1(C)C)CC=O 2230a_100102837566_200015260668 [0,2,0,0,0,0|2,0,0]=4 1663 B11R1.761 CC1N(CCC1(C)C)CC=O 269982a_100102837566_200015260668 [0,2,0,0,0,0|2,0,0]=4 1664 B11R1.761 CC1N(CCC1(C)C)CC=O 34a_100102837566_200009817547 [0,2,0,0,0,0|2,0,0]=4 1665 B9R1.3 CC1CCCC(N1C)C 2230a_100000210447_200000210301 [0,0,1,1,0,0|1,0,1]=4 1666 B9R1.3 CC1CCCC(N1C)C 269982a_100000210447_200000210301 [0,0,1,1,0,0|1,0,1]=4 1667 B9R1.3 CC1CCCC(N1C)C 34a_100000210447_200000210301 [0,0,1,1,0,0|1,0,1]=4 1668 B9R1.3 CC1CCCC(N1[13CH3])C 2230a_100000210447_200025704644 [0,0,1,1,0,0|1,0,1]=4 1669 B9R1.3 CC1CCCC(N1[13CH3])C 269982a_100000210447_200025704644 [0,0,1,1,0,0|1,0,1]=4 1670 B9R1.3 CC1CCCC(N1[13CH3])C 34a_100000210447_200025704644 [0,0,1,1,0,0|1,0,1]=4 1671 B9R1.41 CC(C)N1CCC[C@@H]1C 2230a_100020605311_100000210206 [0,0,1,1,0,0|1,0,1]=4 1672 B9R1.41 CC(C)N1CCC[C@@H]1C 269982a_100020605311_100000210206 [0,0,1,1,0,0|1,0,1]=4 1673 B9R1.41 CC(C)N1CCC[C@H]1C 2230a_100015189458_100000210206 [0,0,1,1,0,0|1,0,1]=4 1674 B9R1.41 CC(C)N1CCC[C@H]1C 269982a_100015189458_100000210206 [0,0,1,1,0,0|1,0,1]=4 1675 B9R1.41 CC(C)N1CCC[C@H]1C 34a_100015189458_100000210206 [0,0,1,1,0,0|1,0,1]=4 1676 B9R1.41 CN(C)C1CCCC1=O 2230a_100102631434_100000211823 [0,0,1,1,0,0|2,0,0]=4 1677 B9R1.41 CN(C)C1CCCC1=O 269982a_100102631434_100000211823 [0,0,1,1,0,0|2,0,0]=4 1678 B9R1.81 C=CC(=O)N1CCC1C 240690a_100000755817_200121576911 [0,0,1,1,0,0|0,0,2]=4 1679 B9R1.81 CC1CCN1C(=O)CO 240690a_100000755817_100000210174 [0,0,1,1,0,0|1,0,0]=3 1680 B9R1.81 CC1CCN1C(=O)CO 527a_100000755817_100000210174 [0,0,1,1,0,0|1,0,0]=3 1681 B9R1.81 CCC(=O)N1CCC1C 11a_100000755817_100000210414 [0,0,1,1,0,0|0,0,0]=2 1682 B9R1.81 CCC(=O)N1CCC1C 240690a_100000755817_100000210414 [0,0,1,1,0,0|0,0,0]=2 1683 B9R1.81 CCC(=O)N1CCC1C 527a_100000755817_100000210414 [0,0,1,1,0,0|0,0,0]=2 1684 B9R1.81 CCC(C)N1CCC1C 269982a_100000755817_100000758301 [0,0,1,1,0,0|1,0,1]=4 1685 B9R1.81 CCC(C)N1CCC1C 34a_100000755817_100011215416 [0,0,1,1,0,0|1,0,1]=4 1686 B9R1.81 CNC(=O)N1CCC1C 2708a_100102657272_100000755817 [0,0,1,1,0,0|1,0,0]=3 1687 B9R1.81 CNC(=O)N1CCC1C 273464a_100102657272_100000755817 [0,0,1,1,0,0|1,0,0]=3 1688 B9R1.101 C=CC(=O)N(C)C1CC1 1626a_100000226674_100000185746 [0,0,1,1,0,0|0,0,2]=4 1689 B9R1.101 C=CC(=O)N(C)C1CC1 240690a_100000226674_200121576911 [0,0,1,1,0,0|0,0,2]=4 1690 B9R1.101 CCC(=O)N(C)C1CC1 11a_100000226674_100000210414 [0,0,1,1,0,0|0,0,0]=2 1691 B9R1.101 CCC(=O)N(C)C1CC1 1626a_100000226674_100000210414 [0,0,1,1,0,0|0,0,0]=2 1692 B9R1.101 CCC(=O)N(C)C1CC1 240690a_100000226674_100000210414 [0,0,1,1,0,0|0,0,0]=2 1693 B9R1.101 CCC(=O)N(C)C1CC1 527a_100000226674_100000210414 [0,0,1,1,0,0|0,0,0]=2 1694 B9R1.101 CCC(C)N(C)C1CC1 2230a_100000226674_100000758301 [0,0,1,1,0,0|1,0,1]=4 1695 B9R1.101 CCC(C)N(C)C1CC1 269982a_100000226674_100000758301 [0,0,1,1,0,0|1,0,1]=4 1696 B9R1.101 CCC(C)N(C)C1CC1 269982a_100000741768_100000211595 [0,0,1,1,0,0|1,0,1]=4 1697 B9R1.101 CN(C(=O)CO)C1CC1 240690a_100000226674_100000210174 [0,0,1,1,0,0|1,0,0]=3 1698 B9R1.101 CN(C(=O)CO)C1CC1 527a_100000226674_100000210174 [0,0,1,1,0,0|1,0,0]=3 1699 B9R1.101 CNC(=O)N(C)C1CC1 2708a_100102657272_100000226674 [0,0,1,1,0,0|1,0,0]=3 1700 B9R1.101 CNC(=O)N(C)C1CC1 273464a_100102657272_100000226674 [0,0,1,1,0,0|1,0,0]=3 1701 B9R1.110 CC(C)N(C)C1CCC1 2230a_100000758072_100000210206 [0,0,1,1,0,0|1,0,1]=4 1702 B9R1.110 CC(C)N(C)C1CCC1 269982a_100000758072_100000210206 [0,0,1,1,0,0|1,0,1]=4 1703 B9R1.110 CC(C)N(C)C1CCC1 269982a_200000211004_100000749161 [0,0,1,1,0,0|1,0,1]=4 1704 B9R1.110 CC(C)N(C)C1CCC1 270004a_200000211004_100000241760 [0,0,1,1,0,0|1,0,1]=4 1705 B9R1.110 CC(C)N(C)C1CCC1 34a_100000758072_100000210206 [0,0,1,1,0,0|1,0,1]=4 1706 B9R1.185 CC1(C[C@@H]1C(=O)CF)C 1458a_100000692687_100015361967 [0,0,1,1,0,0|2,0,0]=4 1707 B9R1.185 CCC(=O)[C@H]1CC1(C)C 1458a_100000692687_100000210202 [0,0,1,1,0,0|1,0,0]=3 1708 B9R1.185 CNC(=O)[C@H]1CC1(C)C 11a_106832991635_100000692687 [0,0,1,1,0,0|2,0,0]=4 1709 B9R1.185 CNC(=O)[C@H]1CC1(C)C 1626a_100102657272_100000692687 [0,0,1,1,0,0|2,0,0]=4 1710 B9R1.185 CNC(=O)[C@H]1CC1(C)C 240690a_100102657272_100000692687 [0,0,1,1,0,0|2,0,0]=4 1711 B9R1.185 CNC(=O)[C@H]1CC1(C)C 527a_100102657272_100000692687 [0,0,1,1,0,0|2,0,0]=4 1712 B9R1.1 CNC1CCC(CC1)C 270004a_106832991635_100000185489 [0,0,1,1,0,0|1,0,1]=4 1713 B9R1.1 CNC1CCC(CC1)C 34a_100102657272_200011216234 [0,0,1,1,0,0|1,0,1]=4 1714 B9R1.1 CN[C@H]1CC[C@@H](CC1)C 2230a_100020625639_200000210301 [0,0,1,1,0,0|1,0,1]=4 1715 B9R1.1 CN[C@H]1CC[C@@H](CC1)C 34a_100020625639_200000210301 [0,0,1,1,0,0|1,0,1]=4 1716 B9R1.1 C[C@H]1CC[C@@H](CC1)N[13CH3] 2230a_100020625639_200025704644 [0,0,1,1,0,0|1,0,1]=4 1717 B9R1.1 C[C@H]1CC[C@@H](CC1)N[13CH3] 34a_100020625639_200025704644 [0,0,1,1,0,0|1,0,1]=4 1718 B9R1.35 CC(=O)C1CNC(=O)C1 1458a_100000747279_200000210301 [0,0,1,1,0,0|1,0,1]=4 1719 B9R1.35 CC(C)N1CNC(=O)C1 2230a_200000708111_100000210206 [0,0,1,1,0,0|1,0,0]=3 1720 B9R1.35 [13CH3]C(=O)C1CNC(=O)C1 1458a_100000747279_200025704644 [0,0,1,1,0,0|1,0,1]=4 1721 B9R1.49 CN1CCNC(=O)CC1 2230a_100000698595_200000210301 [0,0,1,1,0,0|1,0,0]=3 1722 B9R1.49 CN1CCNC(=O)CC1 269982a_100000698595_200000210301 [0,0,1,1,0,0|1,0,0]=3 1723 B9R1.49 [13CH3]N1CCNC(=O)CC1 2230a_100000698595_200025704644 [0,0,1,1,0,0|1,0,0]=3 1724 B9R1.49 [13CH3]N1CCNC(=O)CC1 269982a_100000698595_200025704644 [0,0,1,1,0,0|1,0,0]=3 1725 B9R1.67 CC(C)NC1CCC1=O 34a_100138425928_100009892977 [0,0,1,1,0,0|2,0,0]=4 1726 B9R1.67 CC(C)OC1CCC1=O 34a_100000212225_100009892977 [0,0,1,1,0,0|2,0,0]=4 1727 B9R1.67 CC(C)SC1CCC1=O 62a_100000210206_100009892977 [0,0,1,1,0,0|2,0,0]=4 1728 B9R1.67 CC(C)SC1CCC1=O 62a_100009892977_100000210206 [0,0,1,1,0,0|2,0,0]=4 1729 B9R1.78 CNC(=O)N[C@@H]1C[C@@H]1F 2708a_100102657272_100015190264 [0,0,1,1,0,0|2,0,0]=4 1730 B9R1.78 CNC(=O)N[C@@H]1C[C@@H]1F 273464a_100015190264_100102657272 [0,0,1,1,0,0|2,0,0]=4 1731 B9R1.78 CNC(=O)N[C@@H]1C[C@@H]1F 273464a_100102657272_100015190264 [0,0,1,1,0,0|2,0,0]=4 1732 B9R1.78 CNC(=O)N[C@@H]1C[C@@H]1F 512a_106832991638_100015190264 [0,0,1,1,0,0|2,0,0]=4 1733 B9R1.78 CNC(=O)N[C@@H]1C[C@H]1F 2708a_100102657272_100025746932 [0,0,1,1,0,0|2,0,0]=4 1734 B9R1.78 CNC(=O)N[C@@H]1C[C@H]1F 273464a_100102657272_100025746932 [0,0,1,1,0,0|2,0,0]=4 1735 B9R1.78 CNC(=O)N[C@@H]1C[C@H]1F 512a_100025746932_100102657272 [0,0,1,1,0,0|2,0,0]=4 1736 B9R1.78 CNC(=O)N[C@@H]1C[C@H]1F 512a_106832991638_100025746932 [0,0,1,1,0,0|2,0,0]=4 1737 B9R1.80 C#CC(=O)CCC1CC1 1458a_100000211873_100000694398 [0,0,1,1,0,0|1,0,1]=4 1738 B9R1.80 C=CC(=O)CCC1CC1 1458a_100000185746_100000694398 [0,0,1,1,0,0|1,0,1]=4 1739 B9R1.80 CCC(=O)CCC1CC1 1458a_100000210414_100000694398 [0,0,1,1,0,0|1,0,0]=3 1740 B9R1.80 CCC(=O)CCC1CC1 1458a_100000756386_100000210202 [0,0,1,1,0,0|1,0,0]=3 1741 B9R1.80 CCC(=O)CCC1CO1 1458a_100000210414_100000732470 [0,0,1,1,0,0|2,0,0]=4 1742 B9R1.80 CCC(=O)COC1CC1 34a_100000725409_100000211595 [0,0,1,1,0,0|2,0,0]=4 1743 B9R1.80 CCC(=O)CSC1CC1 62a_100000747405_100000211595 [0,0,1,1,0,0|2,0,0]=4 1744 B9R1.80 CCC(=O)NCC1CC1 11a_100000735609_100000210414 [0,0,1,1,0,0|2,0,0]=4 1745 B9R1.80 CCC(=O)NCC1CC1 1626a_100000735609_100000210414 [0,0,1,1,0,0|2,0,0]=4 1746 B9R1.80 CCC(=O)NCC1CC1 240690a_100000735609_100000210414 [0,0,1,1,0,0|2,0,0]=4 1747 B9R1.80 CCC(=O)NCC1CC1 527a_100000735609_100000210414 [0,0,1,1,0,0|2,0,0]=4 1748 B9R1.80 CNC(=O)C=CC1CC1 11a_106832991635_100102529529 [0,0,1,1,0,0|0,0,2]=4 1749 B9R1.80 CNC(=O)C=CC1CC1 1626a_100102657272_100102529529 [0,0,1,1,0,0|0,0,2]=4 1750 B9R1.80 CNC(=O)C=CC1CC1 240690a_100102657272_100102529529 [0,0,1,1,0,0|0,0,2]=4 1751 B9R1.80 CNC(=O)CCC1CC1 11a_106832991635_100000756386 [0,0,1,1,0,0|0,0,0]=2 1752 B9R1.80 CNC(=O)CCC1CC1 1626a_100102657272_100000756386 [0,0,1,1,0,0|0,0,0]=2 1753 B9R1.80 CNC(=O)CCC1CC1 240690a_100102657272_100000756386 [0,0,1,1,0,0|0,0,0]=2 1754 B9R1.80 CNC(=O)CCC1CC1 527a_100102657272_100000756386 [0,0,1,1,0,0|0,0,0]=2 1755 B9R1.80 CNC(=O)CNC1CC1 34a_100000212008_100000183359 [0,0,1,1,0,0|1,0,0]=3 1756 B9R1.80 CNC(=O)COC1CC1 34a_100000750040_100000211595 [0,0,1,1,0,0|1,0,0]=3 1757 B9R1.80 CNC(=O)CSC1CC1 62a_100000183359_100000211595 [0,0,1,1,0,0|1,0,0]=3 1758 B9R1.80 CNC(=O)NCC1CC1 2708a_100000735609_106832991635 [0,0,1,1,0,0|1,0,0]=3 1759 B9R1.80 CNC(=O)NCC1CC1 2708a_100102657272_100000735609 [0,0,1,1,0,0|1,0,0]=3 1760 B9R1.80 CNC(=O)NCC1CC1 273464a_100000735609_100102657272 [0,0,1,1,0,0|1,0,0]=3 1761 B9R1.80 CNC(=O)NCC1CC1 273464a_100102657272_100000735609 [0,0,1,1,0,0|1,0,0]=3 1762 B9R1.80 CNC(=O)NCC1CC1 512a_100000735609_100102657272 [0,0,1,1,0,0|1,0,0]=3 1763 B9R1.80 CNC(=O)NCC1CC1 512a_106832991638_100000735609 [0,0,1,1,0,0|1,0,0]=3 1764 B9R1.80 CNC(=O)NNC1CC1 273464a_100102657272_100000701032 [0,0,1,1,0,0|2,0,0]=4 1765 B9R1.80 CNC(=O)NNC1CC1 512a_100000701032_100102657272 [0,0,1,1,0,0|2,0,0]=4 1766 B9R1.80 CNC(=O)NNC1CC1 512a_106832991638_100000701032 [0,0,1,1,0,0|2,0,0]=4 1767 B9R1.80 COC(=O)CNC1CC1 34a_100000212008_100000747449 [0,0,1,1,0,0|2,0,0]=4 1768 B9R1.80 COC(=O)CSC1CC1 62a_100000747449_100000211595 [0,0,1,1,0,0|2,0,0]=4 1769 B9R1.80 O=C(CF)CCC1CC1 1458a_100000756386_100015361967 [0,0,1,1,0,0|2,0,0]=4 1770 B9R1.80 O=C(CO)CCC1CC1 1458a_100000210174_100000694398 [0,0,1,1,0,0|2,0,0]=4 1771 B9R1.82 C=C1CC(C1)C(=O)NC 11a_106832991635_100000065620 [0,0,1,1,0,0|0,0,2]=4 1772 B9R1.82 C=C1CC(C1)C(=O)NC 1626a_100102657272_100000065620 [0,0,1,1,0,0|0,0,2]=4 1773 B9R1.82 C=C1CC(C1)C(=O)NC 240690a_100102657272_100000065620 [0,0,1,1,0,0|0,0,2]=4 1774 B9R1.82 C=C1CC(C1)C(=O)NC 527a_100102657272_100000065620 [0,0,1,1,0,0|0,0,2]=4 1775 B9R1.82 CC1CC(C1)C(=O)CF 1458a_100000686124_100015361967 [0,0,1,1,0,0|2,0,0]=4 1776 B9R1.82 CCC(=O)C1CC(C1)C 1458a_100000686124_100000210202 [0,0,1,1,0,0|1,0,0]=3 1777 B9R1.82 CCC(=O)C1CC(C1)F 1458a_100000062598_100000210202 [0,0,1,1,0,0|2,0,0]=4 1778 B9R1.82 CCC(=O)C1CN(C1)C 1458a_100012002723_100000210202 [0,0,1,1,0,0|2,0,0]=4 1779 B9R1.82 CCC(=O)N1CC(C1)C 11a_100000702820_100000210414 [0,0,1,1,0,0|2,0,0]=4 1780 B9R1.82 CCC(=O)N1CC(C1)C 240690a_100000702820_100000210414 [0,0,1,1,0,0|2,0,0]=4 1781 B9R1.82 CCC(=O)N1CC(C1)C 527a_100000702820_100000210414 [0,0,1,1,0,0|2,0,0]=4 1782 B9R1.82 CCC(=O)[C@H]1C[C@H](C1)O 1458a_100015266633_100000210202 [0,0,1,1,0,0|2,0,0]=4 1783 B9R1.82 CNC(=O)C1CC(C1)C 11a_106832991635_100000686124 [0,0,1,1,0,0|0,0,0]=2 1784 B9R1.82 CNC(=O)C1CC(C1)C 1626a_100102657272_100000686124 [0,0,1,1,0,0|0,0,0]=2 1785 B9R1.82 CNC(=O)C1CC(C1)C 240690a_100102657272_100000686124 [0,0,1,1,0,0|0,0,0]=2 1786 B9R1.82 CNC(=O)C1CC(C1)C 527a_100102657272_100000686124 [0,0,1,1,0,0|0,0,0]=2 1787 B9R1.82 CNC(=O)C1CC(C1)F 11a_106832991635_100000062598 [0,0,1,1,0,0|1,0,0]=3 1788 B9R1.82 CNC(=O)C1CC(C1)F 1626a_100102657272_100000062598 [0,0,1,1,0,0|1,0,0]=3 1789 B9R1.82 CNC(=O)C1CC(C1)F 240690a_100102657272_100000062598 [0,0,1,1,0,0|1,0,0]=3 1790 B9R1.82 CNC(=O)C1CC(C1)F 527a_100102657272_100000062598 [0,0,1,1,0,0|1,0,0]=3 1791 B9R1.82 CNC(=O)C1CN(C1)C 240690a_100102657272_100012002723 [0,0,1,1,0,0|1,0,0]=3 1792 B9R1.82 CNC(=O)C1CN(C1)C 34a_100000703363_200000210301 [0,0,1,1,0,0|1,0,0]=3 1793 B9R1.82 CNC(=O)C1CN(C1)[13CH3] 34a_100000703363_200025704644 [0,0,1,1,0,0|1,0,0]=3 1794 B9R1.82 CNC(=O)N1CC(C1)C 2708a_100102657272_100000702820 [0,0,1,1,0,0|1,0,0]=3 1795 B9R1.82 CNC(=O)N1CC(C1)C 273464a_100102657272_100000702820 [0,0,1,1,0,0|1,0,0]=3 1796 B9R1.82 CNC(=O)N1CC(C1)F 2708a_100102657272_100000690557 [0,0,1,1,0,0|2,0,0]=4 1797 B9R1.82 CNC(=O)N1CC(C1)F 273464a_100102657272_100000690557 [0,0,1,1,0,0|2,0,0]=4 1798 B9R1.82 CNC(=O)N1CC(C1)O 2708a_100102657272_100000749847 [0,0,1,1,0,0|2,0,0]=4 1799 B9R1.82 CNC(=O)N1CC(C1)O 273464a_100102657272_100000749847 [0,0,1,1,0,0|2,0,0]=4 1800 B9R1.82 CNC(=O)[C@H]1C[C@H](C1)O 240690a_100102657272_100015266633 [0,0,1,1,0,0|1,0,0]=3 1801 B9R1.82 CNC(=O)[C@H]1C[C@H](C1)O 527a_100102657272_100015266633 [0,0,1,1,0,0|1,0,0]=3 1802 B9R1.82 COC(=O)C1CN(C1)C 269982a_100015188540_200000210301 [0,0,1,1,0,0|2,0,0]=4 1803 B9R1.82 COC(=O)C1CN(C1)[13CH3] 269982a_100015188540_200025704644 [0,0,1,1,0,0|2,0,0]=4 1804 B9R1.62 CCC(C)(C)N1CCC1 269982a_100000754969_100000032637 [0,0,1,1,0,0|1,0,1]=4 1805 B9R1.117 CC1(CCC1)NCC=O 2230a_100000692455_200015260668 [0,0,1,1,0,0|2,0,0]=4 1806 B9R1.117 CC1(CCC1)NCC=O 34a_100000692455_200009817547 [0,0,1,1,0,0|2,0,0]=4 1807 B9R1.117 CC1(CCC1)OCC=O 34a_100000759064_200009817547 [0,0,1,1,0,0|2,0,0]=4 1808 B9R1.117 CC1(CCC1)OCC=O 7a_100000759064_200015260668 [0,0,1,1,0,0|2,0,0]=4 1809 B9R1.118 CC1(CCCCC1)N[13CH3] 2230a_100000741114_200025704644 [0,0,1,1,0,0|1,0,1]=4 1810 B9R1.118 CC1(CCCCC1)N[13CH3] 34a_100000741114_200025704644 [0,0,1,1,0,0|1,0,1]=4 1811 B9R1.118 CC1(CCOCC1)N[13CH3] 2230a_100000692449_200025704644 [0,0,1,1,0,0|2,0,0]=4 1812 B9R1.118 CC1(CCOCC1)N[13CH3] 34a_100000692449_200025704644 [0,0,1,1,0,0|2,0,0]=4 1813 B9R1.118 CNC1(CCCCC1)C 2230a_100000741114_200000210301 [0,0,1,1,0,0|1,0,1]=4 1814 B9R1.118 CNC1(CCCCC1)C 34a_100000741114_200000210301 [0,0,1,1,0,0|1,0,1]=4 1815 B9R1.118 CNC1(CCOCC1)C 2230a_100000692449_200000210301 [0,0,1,1,0,0|2,0,0]=4 1816 B9R1.118 CNC1(CCOCC1)C 34a_100000692449_200000210301 [0,0,1,1,0,0|2,0,0]=4 1817 B9R1.193 CCC1(CC1)NCC=O 2230a_100000732774_200015260668 [0,0,1,1,0,0|2,0,0]=4 1818 B9R1.193 CNC1(CC1)CCOC 2230a_100020603293_200000210301 [0,0,1,1,0,0|2,0,0]=4 1819 B9R1.193 CNC1(CC1)CCOC 34a_100020603293_200000210301 [0,0,1,1,0,0|2,0,0]=4 1820 B9R1.193 COCCC1(CC1)N[13CH3] 2230a_100020603293_200025704644 [0,0,1,1,0,0|2,0,0]=4 1821 B9R1.193 COCCC1(CC1)N[13CH3] 34a_100020603293_200025704644 [0,0,1,1,0,0|2,0,0]=4 1822 B9R1.68 CC1CCN1C(C)(C)C 269982a_100000755817_100000210625 [0,0,1,1,0,0|1,0,1]=4 1823 B9R1.68 CC1CCN1C(C)(C)C 34a_100000755817_100000210625 [0,0,1,1,0,0|1,0,1]=4 1824 B9R1.102 CN(C1CC1)C(C)(C)C 269982a_100000226674_100000210625 [0,0,1,1,0,0|1,0,1]=4 1825 B9R1.102 CN(C1CC1)C(C)(C)C 269982a_100011215553_100000211595 [0,0,1,1,0,0|1,0,1]=4 1826 B9R2.5 CN1CCCC12CC2 2230a_100020620911_200000210301 [1,0,0,1,0,0|0,0,1]=3 1827 B9R2.5 CN1CCCC12CC2 269982a_100020620911_200000210301 [1,0,0,1,0,0|0,0,1]=3 1828 B9R2.5 CN1CCCC12CC2 34a_100020620911_200000210301 [1,0,0,1,0,0|0,0,1]=3 1829 B9R2.5 [13CH3]N1CCCC12CC2 2230a_100020620911_200025704644 [1,0,0,1,0,0|0,0,1]=3 1830 B9R2.5 [13CH3]N1CCCC12CC2 269982a_100020620911_200025704644 [1,0,0,1,0,0|0,0,1]=3 1831 B9R2.5 [13CH3]N1CCCC12CC2 34a_100020620911_200025704644 [1,0,0,1,0,0|0,0,1]=3 1832 B9R2.24 CN1C2CCC1CC2 2230a_100000735658_200000210301 [1,0,0,1,0,0|1,0,1]=4 1833 B9R2.24 CN1C2CCC1CC2 269982a_100000735658_200000210301 [1,0,0,1,0,0|1,0,1]=4 1834 B9R2.24 CN1C2CCC1CC2 34a_100000735658_200000210301 [1,0,0,1,0,0|1,0,1]=4 1835 B9R2.24 [13CH3]N1C2CCC1CC2 2230a_100000735658_200025704644 [1,0,0,1,0,0|1,0,1]=4 1836 B9R2.24 [13CH3]N1C2CCC1CC2 269982a_100000735658_200025704644 [1,0,0,1,0,0|1,0,1]=4 1837 B9R2.24 [13CH3]N1C2CCC1CC2 34a_100000735658_200025704644 [1,0,0,1,0,0|1,0,1]=4 1838 B9R0.1 C#CC(=O)CCCC(C)C 1458a_100000211873_100011214892 [0,0,1,0,0,1|1,0,1]=4 1839 B9R0.1 C#CC(=O)CCOC(C)C 1458a_100000211873_100000211751 [0,0,1,0,0,1|1,0,1]=4 1840 B9R0.1 C#CC(=O)CCSC(C)C 1458a_100000211873_100000730970 [0,0,1,0,0,1|1,0,1]=4 1841 B9R0.1 C=C(C)CNCC(=O)NC 2230a_100000693194_100000748629 [0,0,1,0,0,1|0,0,2]=4 1842 B9R0.1 C=C(C)COCC(=O)NC 34a_100000210245_100000183359 [0,0,1,0,0,1|0,0,2]=4 1843 B9R0.1 C=C(C)COCC(=O)NC 34a_100000750040_100000748629 [0,0,1,0,0,1|0,0,2]=4 1844 B9R0.1 C=C(C)CSCC(=O)NC 62a_100000183359_100000211660 [0,0,1,0,0,1|0,0,2]=4 1845 B9R0.1 C=C(C)CSCC(=O)NC 62a_100000748629_100000183359 [0,0,1,0,0,1|0,0,2]=4 1846 B9R0.1 C=CC(=O)CCCC(C)C 1458a_100000185746_100011214892 [0,0,1,0,0,1|1,0,1]=4 1847 B9R0.1 C=CC(=O)CCOC(C)C 1458a_100000185746_100000211751 [0,0,1,0,0,1|1,0,1]=4 1848 B9R0.1 C=CC(=O)CCSC(C)C 1458a_100000185746_100000730970 [0,0,1,0,0,1|1,0,1]=4 1849 B9R0.1 C=CC(=O)NCCC(C)C 1626a_100000210545_100000185746 [0,0,1,0,0,1|1,0,1]=4 1850 B9R0.1 C=CC(=O)NCCC(C)C 240690a_100000210545_200121576911 [0,0,1,0,0,1|1,0,1]=4 1851 B9R0.1 CC(C)CCCC(=O)CF 1458a_100011216857_100015361967 [0,0,1,0,0,1|2,0,0]=4 1852 B9R0.1 CC(C)CCCC(=O)CO 1458a_100000210174_100011214892 [0,0,1,0,0,1|2,0,0]=4 1853 B9R0.1 CC(C)CCCC(C)N[13CH3] 2230a_100000210607_200025704644 [0,0,1,0,0,1|1,0,1]=4 1854 B9R0.1 CC(C)CCNC(=O)CO 240690a_100000210545_100000210174 [0,0,1,0,0,1|2,0,0]=4 1855 B9R0.1 CC(C)CCNC(=O)CO 527a_100000210545_100000210174 [0,0,1,0,0,1|2,0,0]=4 1856 B9R0.1 CC(C)COCC(=O)CF 1458a_100011223364_100015361967 [0,0,1,0,0,1|2,0,0]=4 1857 B9R0.1 CC(C)OCCC(=O)CO 1458a_100000210174_100000211751 [0,0,1,0,0,1|2,0,0]=4 1858 B9R0.1 CC(C)SCCC(=O)CO 1458a_100000210174_100000730970 [0,0,1,0,0,1|2,0,0]=4 1859 B9R0.1 CCC(=O)C/C=C/C(C)C 1458a_100016292215_100000210202 [0,0,1,0,0,1|1,0,1]=4 1860 B9R0.1 CCC(=O)CCC=C(C)C 1458a_100000210414_100011217483 [0,0,1,0,0,1|1,0,1]=4 1861 B9R0.1 CCC(=O)CCCC(C)C 1458a_100000210414_100011214892 [0,0,1,0,0,1|1,0,0]=3 1862 B9R0.1 CCC(=O)CCCC(C)C 1458a_100011216857_100000210202 [0,0,1,0,0,1|1,0,0]=3 1863 B9R0.1 CCC(=O)CCCC(C)O 1458a_100000210414_200000718107 [0,0,1,0,0,1|2,0,0]=4 1864 B9R0.1 CCC(=O)CCCN(C)C 1458a_100000210414_100000695564 [0,0,1,0,0,1|2,0,0]=4 1865 B9R0.1 CCC(=O)CCOC(C)C 1458a_100000210414_100000211751 [0,0,1,0,0,1|1,0,0]=3 1866 B9R0.1 CCC(=O)CCSC(C)C 1458a_100000210414_100000730970 [0,0,1,0,0,1|1,0,0]=3 1867 B9R0.1 CCC(=O)COCC(C)C 1458a_100011223364_100000210202 [0,0,1,0,0,1|1,0,0]=3 1868 B9R0.1 CCC(=O)COCC(C)C 34a_100000725409_100000210624 [0,0,1,0,0,1|1,0,0]=3 1869 B9R0.1 CCC(=O)COCC(C)O 34a_100000725409_100011218427 [0,0,1,0,0,1|2,0,0]=4 1870 B9R0.1 CCC(=O)COC[C@@H](C)O 34a_100000725409_100009817552 [0,0,1,0,0,1|2,0,0]=4 1871 B9R0.1 CCC(=O)CSCC(C)C 62a_100000210624_100000747405 [0,0,1,0,0,1|1,0,0]=3 1872 B9R0.1 CCC(=O)CSCC(C)C 62a_100000747405_100000210760 [0,0,1,0,0,1|1,0,0]=3 1873 B9R0.1 CCC(=O)CSCC(C)O 62a_100000747405_100011218427 [0,0,1,0,0,1|2,0,0]=4 1874 B9R0.1 CCC(=O)CSCC(C)O 62a_100011218427_100000747405 [0,0,1,0,0,1|2,0,0]=4 1875 B9R0.1 CCC(=O)CSC[C@@H](C)O 62a_100000747405_100009817552 [0,0,1,0,0,1|2,0,0]=4 1876 B9R0.1 CCC(=O)CSC[C@@H](C)O 62a_100009817552_100000747405 [0,0,1,0,0,1|2,0,0]=4 1877 B9R0.1 CCC(=O)NCCC(C)C 11a_100000210545_100000210414 [0,0,1,0,0,1|1,0,0]=3 1878 B9R0.1 CCC(=O)NCCC(C)C 1626a_100000210545_100000210414 [0,0,1,0,0,1|1,0,0]=3 1879 B9R0.1 CCC(=O)NCCC(C)C 240690a_100000210545_100000210414 [0,0,1,0,0,1|1,0,0]=3 1880 B9R0.1 CCC(=O)NCCC(C)C 527a_100000210545_100000210414 [0,0,1,0,0,1|1,0,0]=3 1881 B9R0.1 CCC(=O)NCCC(C)O 240690a_200000755665_100000210414 [0,0,1,0,0,1|2,0,0]=4 1882 B9R0.1 CCC(=O)NCCC(C)O 527a_200000755665_100000210414 [0,0,1,0,0,1|2,0,0]=4 1883 B9R0.1 CCC(=O)NCCN(C)C 240690a_100000210585_100000210414 [0,0,1,0,0,1|2,0,0]=4 1884 B9R0.1 CCC(=O)NCCN(C)C 527a_100000210585_100000210414 [0,0,1,0,0,1|2,0,0]=4 1885 B9R0.1 CCC(=O)NNCC(C)C 22a_100000696102_100000210414 [0,0,1,0,0,1|2,0,0]=4 1886 B9R0.1 CNC(=O)C/C=C/C(C)C 11a_106832991635_100016292215 [0,0,1,0,0,1|0,0,1]=3 1887 B9R0.1 CNC(=O)C/C=C/C(C)C 1626a_100102657272_100016292215 [0,0,1,0,0,1|0,0,1]=3 1888 B9R0.1 CNC(=O)C/C=C/C(C)C 240690a_100102657272_100016292215 [0,0,1,0,0,1|0,0,1]=3 1889 B9R0.1 CNC(=O)C=CCN(C)C 240690a_100102657272_100000754359 [0,0,1,0,0,1|1,0,1]=4 1890 B9R0.1 CNC(=O)CCCC(=O)C 1458a_100000070787_100000741757 [0,0,1,0,0,1|1,0,1]=4 1891 B9R0.1 CNC(=O)CCCC(C)C 11a_106832991635_100011216857 [0,0,1,0,0,1|0,0,0]=2 1892 B9R0.1 CNC(=O)CCCC(C)C 1626a_100102657272_100011216857 [0,0,1,0,0,1|0,0,0]=2 1893 B9R0.1 CNC(=O)CCCC(C)C 240690a_100102657272_100011216857 [0,0,1,0,0,1|0,0,0]=2 1894 B9R0.1 CNC(=O)CCCC(C)C 527a_100102657272_100011216857 [0,0,1,0,0,1|0,0,0]=2 1895 B9R0.1 CNC(=O)CCCC(C)O 1626a_100102657272_100000761597 [0,0,1,0,0,1|1,0,0]=3 1896 B9R0.1 CNC(=O)CCCC(C)O 527a_100102657272_100000761597 [0,0,1,0,0,1|1,0,0]=3 1897 B9R0.1 CNC(=O)CCCN(C)C 11a_106832991635_100000740757 [0,0,1,0,0,1|1,0,0]=3 1898 B9R0.1 CNC(=O)CCCN(C)C 2230a_100102631434_100000741757 [0,0,1,0,0,1|1,0,0]=3 1899 B9R0.1 CNC(=O)CCCN(C)C 240690a_100102657272_100000740757 [0,0,1,0,0,1|1,0,0]=3 1900 B9R0.1 CNC(=O)CCCN(C)C 269982a_100102631434_100000741757 [0,0,1,0,0,1|1,0,0]=3 1901 B9R0.1 CNC(=O)CCNC(=O)C 11a_100000738227_100015343762 [0,0,1,0,0,1|1,0,1]=4 1902 B9R0.1 CNC(=O)CCNC(=O)C 11a_106832991635_100000183196 [0,0,1,0,0,1|1,0,1]=4 1903 B9R0.1 CNC(=O)CCNC(=O)C 1626a_100102657272_100000183196 [0,0,1,0,0,1|1,0,1]=4 1904 B9R0.1 CNC(=O)CCNC(=O)C 240690a_100000738227_100015343762 [0,0,1,0,0,1|1,0,1]=4 1905 B9R0.1 CNC(=O)CCNC(=O)C 240690a_100102657272_100000183196 [0,0,1,0,0,1|1,0,1]=4 1906 B9R0.1 CNC(=O)CCNC(=O)C 527a_100000738227_100103153847 [0,0,1,0,0,1|1,0,1]=4 1907 B9R0.1 CNC(=O)CCNC(=O)C 527a_100102657272_100000183196 [0,0,1,0,0,1|1,0,1]=4 1908 B9R0.1 CNC(=O)CCNC(C)C 2230a_100000738227_100000210206 [0,0,1,0,0,1|0,0,0]=2 1909 B9R0.1 CNC(=O)CCNC(C)C 2230a_100138425928_100000737683 [0,0,1,0,0,1|0,0,0]=2 1910 B9R0.1 CNC(=O)CCNC(C)C 34a_100000738227_100000210206 [0,0,1,0,0,1|0,0,0]=2 1911 B9R0.1 CNC(=O)CCNC(C)C 34a_100138425928_100012179268 [0,0,1,0,0,1|0,0,0]=2 1912 B9R0.1 CNC(=O)CCOC(C)C 34a_100000212225_100012179268 [0,0,1,0,0,1|0,0,0]=2 1913 B9R0.1 CNC(=O)CCOC(C)C 34a_100000754576_100000210206 [0,0,1,0,0,1|0,0,0]=2 1914 B9R0.1 CNC(=O)CCSC(=O)C 1626a_100102657272_100000048949 [0,0,1,0,0,1|1,0,1]=4 1915 B9R0.1 CNC(=O)CCSC(=O)C 240690a_100102657272_100000048949 [0,0,1,0,0,1|1,0,1]=4 1916 B9R0.1 CNC(=O)CCSC(C)C 62a_100000210206_100000737683 [0,0,1,0,0,1|0,0,0]=2 1917 B9R0.1 CNC(=O)CCSC(C)C 62a_100000737683_100000210206 [0,0,1,0,0,1|0,0,0]=2 1918 B9R0.1 CNC(=O)CNCC(C)C 2230a_100000210953_100000183359 [0,0,1,0,0,1|0,0,0]=2 1919 B9R0.1 CNC(=O)CNCC(C)C 2230a_100000693194_100000210760 [0,0,1,0,0,1|0,0,0]=2 1920 B9R0.1 CNC(=O)CNCC(C)C 270004a_100000693194_100000210432 [0,0,1,0,0,1|0,0,0]=2 1921 B9R0.1 CNC(=O)CNCC(C)C 34a_100000210953_100000183359 [0,0,1,0,0,1|0,0,0]=2 1922 B9R0.1 CNC(=O)CNCC(C)O 2230a_100000210904_100000183359 [0,0,1,0,0,1|1,0,0]=3 1923 B9R0.1 CNC(=O)CNCC(C)O 2230a_100000693194_100011218427 [0,0,1,0,0,1|1,0,0]=3 1924 B9R0.1 CNC(=O)CNCC(C)O 34a_100000210904_100000183359 [0,0,1,0,0,1|1,0,0]=3 1925 B9R0.1 CNC(=O)CNCC(F)F 2230a_100000693194_100011934356 [0,0,1,0,0,1|2,0,0]=4 1926 B9R0.1 CNC(=O)CNCC(F)F 34a_100000765723_100000183359 [0,0,1,0,0,1|2,0,0]=4 1927 B9R0.1 CNC(=O)CNC[C@@H](C)O 2230a_100000693194_100009817552 [0,0,1,0,0,1|1,0,0]=3 1928 B9R0.1 CNC(=O)COCC(=O)C 34a_100000211253_100000183359 [0,0,1,0,0,1|1,0,1]=4 1929 B9R0.1 CNC(=O)COCC(C)Br 34a_100012180447_100000183359 [0,0,1,0,0,1|1,0,0]=3 1930 B9R0.1 CNC(=O)COCC(C)C 11a_106832991635_100011223364 [0,0,1,0,0,1|0,0,0]=2 1931 B9R0.1 CNC(=O)COCC(C)C 1626a_100102657272_100011223364 [0,0,1,0,0,1|0,0,0]=2 1932 B9R0.1 CNC(=O)COCC(C)C 240690a_100102657272_100011223364 [0,0,1,0,0,1|0,0,0]=2 1933 B9R0.1 CNC(=O)COCC(C)C 34a_100000210257_100000183359 [0,0,1,0,0,1|0,0,0]=2 1934 B9R0.1 CNC(=O)COCC(C)C 34a_100000750040_100000210624 [0,0,1,0,0,1|0,0,0]=2 1935 B9R0.1 CNC(=O)COCC(C)C 527a_100102657272_100011223364 [0,0,1,0,0,1|0,0,0]=2 1936 B9R0.1 CNC(=O)COCC(C)F 34a_100015925927_100000183359 [0,0,1,0,0,1|1,0,0]=3 1937 B9R0.1 CNC(=O)COCC(C)O 34a_100000750040_100011218427 [0,0,1,0,0,1|1,0,0]=3 1938 B9R0.1 CNC(=O)COCC(F)F 34a_100000743014_100000183359 [0,0,1,0,0,1|2,0,0]=4 1939 B9R0.1 CNC(=O)COCC(F)F 34a_100000750040_100011934356 [0,0,1,0,0,1|2,0,0]=4 1940 B9R0.1 CNC(=O)COC[C@@H](C)Cl 34a_100016084084_100000183359 [0,0,1,0,0,1|1,0,0]=3 1941 B9R0.1 CNC(=O)COC[C@@H](C)N 34a_100000737577_100000183359 [0,0,1,0,0,1|1,0,0]=3 1942 B9R0.1 CNC(=O)COC[C@@H](C)O 34a_100000750040_100009817552 [0,0,1,0,0,1|1,0,0]=3 1943 B9R0.1 CNC(=O)CSCC(C)C 62a_100000183359_100000210760 [0,0,1,0,0,1|0,0,0]=2 1944 B9R0.1 CNC(=O)CSCC(C)C 62a_100000210624_100000183359 [0,0,1,0,0,1|0,0,0]=2 1945 B9R0.1 CNC(=O)CSCC(C)O 62a_100000183359_100011218427 [0,0,1,0,0,1|1,0,0]=3 1946 B9R0.1 CNC(=O)CSCC(C)O 62a_100011218427_100000183359 [0,0,1,0,0,1|1,0,0]=3 1947 B9R0.1 CNC(=O)CSCC(F)F 62a_100000183359_100011934356 [0,0,1,0,0,1|2,0,0]=4 1948 B9R0.1 CNC(=O)CSCC(F)F 62a_100011934356_100000183359 [0,0,1,0,0,1|2,0,0]=4 1949 B9R0.1 CNC(=O)CSC[C@@H](C)O 62a_100000183359_100009817552 [0,0,1,0,0,1|1,0,0]=3 1950 B9R0.1 CNC(=O)CSC[C@@H](C)O 62a_100009817552_100000183359 [0,0,1,0,0,1|1,0,0]=3 1951 B9R0.1 CNC(=O)NCC=C(C)C 2708a_100000718196_106832991635 [0,0,1,0,0,1|0,0,2]=4 1952 B9R0.1 CNC(=O)NCC=C(C)C 2708a_100102657272_100000718196 [0,0,1,0,0,1|0,0,2]=4 1953 B9R0.1 CNC(=O)NCC=C(C)C 273464a_100000718196_100102657272 [0,0,1,0,0,1|0,0,2]=4 1954 B9R0.1 CNC(=O)NCC=C(C)C 273464a_100102657272_100000718196 [0,0,1,0,0,1|0,0,2]=4 1955 B9R0.1 CNC(=O)NCC=C(C)C 512a_100000718196_100102657272 [0,0,1,0,0,1|0,0,2]=4 1956 B9R0.1 CNC(=O)NCC=C(C)C 512a_106832991638_100000718196 [0,0,1,0,0,1|0,0,2]=4 1957 B9R0.1 CNC(=O)NCCC(C)C 2708a_100000210545_106832991635 [0,0,1,0,0,1|0,0,0]=2 1958 B9R0.1 CNC(=O)NCCC(C)C 2708a_100102657272_100000210545 [0,0,1,0,0,1|0,0,0]=2 1959 B9R0.1 CNC(=O)NCCC(C)C 273464a_100000210545_100102657272 [0,0,1,0,0,1|0,0,0]=2 1960 B9R0.1 CNC(=O)NCCC(C)C 273464a_100102657272_100000210545 [0,0,1,0,0,1|0,0,0]=2 1961 B9R0.1 CNC(=O)NCCC(C)C 512a_100000210545_100102657272 [0,0,1,0,0,1|0,0,0]=2 1962 B9R0.1 CNC(=O)NCCC(C)C 512a_106832991638_100000210545 [0,0,1,0,0,1|0,0,0]=2 1963 B9R0.1 CNC(=O)NCCC(C)O 2708a_100102657272_200000755665 [0,0,1,0,0,1|1,0,0]=3 1964 B9R0.1 CNC(=O)NCCC(C)O 273464a_200000755665_100102657272 [0,0,1,0,0,1|1,0,0]=3 1965 B9R0.1 CNC(=O)NCCC(C)O 512a_106832991638_200000755665 [0,0,1,0,0,1|1,0,0]=3 1966 B9R0.1 CNC(=O)NCCC(C)O 512a_200000755665_100102657272 [0,0,1,0,0,1|1,0,0]=3 1967 B9R0.1 CNC(=O)NCCN(C)C 2708a_100102657272_100000210585 [0,0,1,0,0,1|1,0,0]=3 1968 B9R0.1 CNC(=O)NCCN(C)C 273464a_100000210585_100102657272 [0,0,1,0,0,1|1,0,0]=3 1969 B9R0.1 CNC(=O)NCCN(C)C 273464a_100102657272_100000210585 [0,0,1,0,0,1|1,0,0]=3 1970 B9R0.1 CNC(=O)NCCN(C)C 512a_106832991638_100000210585 [0,0,1,0,0,1|1,0,0]=3 1971 B9R0.1 CNC(=O)NNCC(C)C 273464a_100102657272_100000696102 [0,0,1,0,0,1|1,0,0]=3 1972 B9R0.1 CNC(=O)NNCC(C)C 512a_100000696102_100102657272 [0,0,1,0,0,1|1,0,0]=3 1973 B9R0.1 CNC(=O)NNCC(C)C 512a_106832991638_100000696102 [0,0,1,0,0,1|1,0,0]=3 1974 B9R0.1 CNC(=O)NNCC(C)O 512a_106832991638_200000730056 [0,0,1,0,0,1|2,0,0]=4 1975 B9R0.1 CNC(=O)NNCC(C)O 512a_200000730056_100102657272 [0,0,1,0,0,1|2,0,0]=4 1976 B9R0.1 CNC(=O)OCCC(=O)C 1458a_100000070787_200011997002 [0,0,1,0,0,1|1,0,1]=4 1977 B9R0.1 CNC(=O)OCCN(C)C 269982a_100102631434_200011997002 [0,0,1,0,0,1|1,0,0]=3 1978 B9R0.1 CNC(C)CCCC(C)C 2230a_100000210607_200000210301 [0,0,1,0,0,1|1,0,1]=4 1979 B9R0.1 CNC(C)CCCC(C)C 270004a_106832991635_100000753411 [0,0,1,0,0,1|1,0,1]=4 1980 B9R0.1 CNC(C)CCOC(C)C 270004a_106832991635_200011219172 [0,0,1,0,0,1|1,0,1]=4 1981 B9R0.1 COC(=O)CCCN(C)C 2230a_100102631434_100011218270 [0,0,1,0,0,1|2,0,0]=4 1982 B9R0.1 COC(=O)CCCN(C)C 269982a_100000739225_200000210301 [0,0,1,0,0,1|2,0,0]=4 1983 B9R0.1 COC(=O)CCCN(C)C 269982a_100102631434_100011218270 [0,0,1,0,0,1|2,0,0]=4 1984 B9R0.1 COC(=O)CCCN(C)[13CH3] 269982a_100000739225_200025704644 [0,0,1,0,0,1|2,0,0]=4 1985 B9R0.1 COC(=O)CCNC(C)C 2230a_100138425928_100000204255 [0,0,1,0,0,1|1,0,0]=3 1986 B9R0.1 COC(=O)CCNC(C)C 34a_100138425928_100000742370 [0,0,1,0,0,1|1,0,0]=3 1987 B9R0.1 COC(=O)CCOC(C)C 34a_100000212225_100000742370 [0,0,1,0,0,1|1,0,0]=3 1988 B9R0.1 COC(=O)CCSC(C)C 62a_100000204255_100000210206 [0,0,1,0,0,1|1,0,0]=3 1989 B9R0.1 COC(=O)CCSC(C)C 62a_100000210206_100000204255 [0,0,1,0,0,1|1,0,0]=3 1990 B9R0.1 COC(=O)CNCC(C)C 2230a_100000210953_100000747449 [0,0,1,0,0,1|1,0,0]=3 1991 B9R0.1 COC(=O)CNCC(C)C 34a_100000210953_100000747449 [0,0,1,0,0,1|1,0,0]=3 1992 B9R0.1 COC(=O)CNCC(C)O 2230a_100000210904_100000747449 [0,0,1,0,0,1|2,0,0]=4 1993 B9R0.1 COC(=O)CNCC(C)O 34a_100000210904_100000747449 [0,0,1,0,0,1|2,0,0]=4 1994 B9R0.1 COC(=O)COCC(C)Br 34a_100012180447_100000747449 [0,0,1,0,0,1|2,0,0]=4 1995 B9R0.1 COC(=O)COCC(C)C 34a_100000210257_100000747449 [0,0,1,0,0,1|1,0,0]=3 1996 B9R0.1 COC(=O)COCC(C)F 34a_100015925927_100000747449 [0,0,1,0,0,1|2,0,0]=4 1997 B9R0.1 COC(=O)COC[C@@H](C)Cl 34a_100016084084_100000747449 [0,0,1,0,0,1|2,0,0]=4 1998 B9R0.1 COC(=O)COC[C@@H](C)N 34a_100000737577_100000747449 [0,0,1,0,0,1|2,0,0]=4 1999 B9R0.1 COC(=O)CSCC(C)C 62a_100000210624_100000747449 [0,0,1,0,0,1|1,0,0]=3 2000 B9R0.1 COC(=O)CSCC(C)C 62a_100000747449_100000210760 [0,0,1,0,0,1|1,0,0]=3 2001 B9R0.1 COC(=O)CSCC(C)O 62a_100000747449_100011218427 [0,0,1,0,0,1|2,0,0]=4 2002 B9R0.1 COC(=O)CSCC(C)O 62a_100011218427_100000747449 [0,0,1,0,0,1|2,0,0]=4 2003 B9R0.1 COC(=O)CSC[C@@H](C)O 62a_100000747449_100009817552 [0,0,1,0,0,1|2,0,0]=4 2004 B9R0.1 COC(=O)CSC[C@@H](C)O 62a_100009817552_100000747449 [0,0,1,0,0,1|2,0,0]=4 2005 B9R0.1 COC(=O)OCSC(C)C 62a_100000210206_100000139417 [0,0,1,0,0,1|2,0,0]=4 2006 B9R0.10 C=C(C)CN(C)C(C)(C)C 269982a_100000225649_100000210625 [0,0,1,0,0,1|1,0,0]=3 2007 B9R0.10 C=C(C)CN(C)C(C)(C)C 269982a_100011215553_100000748629 [0,0,1,0,0,1|1,0,0]=3 2008 B9R0.10 C=C(F)CN(C)C(C)(C)C 269982a_100011215553_100009893438 [0,0,1,0,0,1|1,0,1]=4 2009 B9R0.10 CC(=CC(=O)[13CH3])C(C)(C)C 1458a_100020591210_200025704644 [0,0,1,0,0,1|1,0,0]=3 2010 B9R0.10 CC(=O)C=C(C)C(C)(C)C 1458a_100020591210_200000210301 [0,0,1,0,0,1|1,0,0]=3 2011 B9R0.10 CC(=O)CC(=O)C(C)(C)C 1458a_100000070787_100000210923 [0,0,1,0,0,1|2,0,0]=4 2012 B9R0.10 CC(=O)N[C@@H](C)C(C)(C)O 11a_100025708725_100015343762 [0,0,1,0,0,1|2,0,0]=4 2013 B9R0.10 CC(=O)N[C@@H](C)C(C)(C)O 1626a_100025708725_100015343762 [0,0,1,0,0,1|2,0,0]=4 2014 B9R0.10 CC(=O)N[C@@H](C)C(C)(C)O 240690a_100025708725_100015343762 [0,0,1,0,0,1|2,0,0]=4 2015 B9R0.10 CC(=O)N[C@@H](C)C(C)(C)O 527a_100025708725_100103153847 [0,0,1,0,0,1|2,0,0]=4 2016 B9R0.10 CC(=O)N[C@H](C)C(C)(C)C 11a_100025703359_100015343762 [0,0,1,0,0,1|1,0,0]=3 2017 B9R0.10 CC(=O)N[C@H](C)C(C)(C)C 1626a_100025703359_100015343762 [0,0,1,0,0,1|1,0,0]=3 2018 B9R0.10 CC(=O)N[C@H](C)C(C)(C)C 240690a_100025703359_100015343762 [0,0,1,0,0,1|1,0,0]=3 2019 B9R0.10 CC(=O)N[C@H](C)C(C)(C)C 527a_100025703359_100103153847 [0,0,1,0,0,1|1,0,0]=3 2020 B9R0.10 CC(C)(C)N([13CH3])CC(=O)O 269956a_100000745166_200025704644 [0,0,1,0,0,1|1,0,0]=3 2021 B9R0.10 CC(C)CN(C)C(C)(C)C 2230a_100015183297_200000210301 [0,0,1,0,0,1|1,0,1]=4 2022 B9R0.10 CC(C)CN(C)C(C)(C)C 269982a_100000747067_100000210625 [0,0,1,0,0,1|1,0,1]=4 2023 B9R0.10 CC(C)CN(C)C(C)(C)C 269982a_100011215553_100000210624 [0,0,1,0,0,1|1,0,1]=4 2024 B9R0.10 CC(C)CN(C)C(C)(C)C 269982a_100015183297_200000210301 [0,0,1,0,0,1|1,0,1]=4 2025 B9R0.10 CC(C)CN(C)C(C)(C)C 270004a_100011215553_100000210432 [0,0,1,0,0,1|1,0,1]=4 2026 B9R0.10 CC(C)CN([13CH3])C(C)(C)C 2230a_100015183297_200025704644 [0,0,1,0,0,1|1,0,1]=4 2027 B9R0.10 CC(C)CN([13CH3])C(C)(C)C 269982a_100015183297_200025704644 [0,0,1,0,0,1|1,0,1]=4 2028 B9R0.10 CC(O)CN(C)C(C)(C)C 269982a_100000227577_100000210625 [0,0,1,0,0,1|0,0,2]=4 2029 B9R0.10 CC(O)CN(C)C(C)(C)C 269982a_100011215553_100011218427 [0,0,1,0,0,1|0,0,2]=4 2030 B9R0.10 CN(CC(=O)N)C(C)(C)C 269982a_100011215553_100000187820 [0,0,1,0,0,1|1,0,0]=3 2031 B9R0.10 CN(CC(=O)O)C(C)(C)C 269956a_100000745166_200000210301 [0,0,1,0,0,1|1,0,0]=3 2032 B9R0.10 CN(CC(=O)O)C(C)(C)C 269956a_100000746989_100000211941 [0,0,1,0,0,1|1,0,0]=3 2033 B9R0.10 CN(CC(=O)[O-])C(C)(C)C 269982a_100011215553_100020667443 [0,0,1,0,0,1|1,0,0]=3 2034 B9R0.10 CN(C[N+](=O)[O-])C(C)(C)C 269982a_100011215553_100000761209 [0,0,1,0,0,1|2,0,0]=4 2035 B9R0.10 C[C@@H](O)CN(C)C(C)(C)C 269982a_100011215553_100009817552 [0,0,1,0,0,1|0,0,2]=4 2036 B9R0.57 CC(=O)C(=O)NC(C)(C)C 1458a_100000238687_200000210301 [0,0,1,0,0,1|2,0,0]=4 2037 B9R0.57 CC(=O)C(C)NC(C)(C)C 2230a_100000715429_100009814033 [0,0,1,0,0,1|1,0,0]=3 2038 B9R0.57 CC(=O)C(C)OC(C)(C)C 34a_100000212229_100000210625 [0,0,1,0,0,1|1,0,0]=3 2039 B9R0.57 CC(=O)C(C)OC(C)(C)C 7a_100015890283_100000179758 [0,0,1,0,0,1|1,0,0]=3 2040 B9R0.57 CC(=O)C(C)SC(C)(C)C 62a_100000211941_100009814033 [0,0,1,0,0,1|1,0,0]=3 2041 B9R0.57 CC(=O)C(C)SC(C)(C)C 62a_100009814033_100000211941 [0,0,1,0,0,1|1,0,0]=3 2042 B9R0.57 CC(=O)N(C)CC(C)(C)C 11a_100000742839_100015343762 [0,0,1,0,0,1|0,0,0]=2 2043 B9R0.57 CC(=O)N(C)CC(C)(C)C 1626a_100000742839_100015343762 [0,0,1,0,0,1|0,0,0]=2 2044 B9R0.57 CC(=O)N(C)CC(C)(C)C 240690a_100000742839_100015343762 [0,0,1,0,0,1|0,0,0]=2 2045 B9R0.57 CC(=O)N(C)CC(C)(C)C 527a_100000742839_100103153847 [0,0,1,0,0,1|0,0,0]=2 2046 B9R0.57 CC(=O)N(C)CC(C)(C)O 1626a_100000755907_100015343762 [0,0,1,0,0,1|1,0,0]=3 2047 B9R0.57 CC(=O)N(C)CC(C)(C)O 240690a_100000755907_100015343762 [0,0,1,0,0,1|1,0,0]=3 2048 B9R0.57 CC(=O)N(C)CC(C)(C)O 527a_100000755907_100103153847 [0,0,1,0,0,1|1,0,0]=3 2049 B9R0.57 CC(=O)N(C)C[Si](C)(C)C 11a_200020589227_100015343762 [0,0,1,0,0,1|0,1,0]=3 2050 B9R0.57 CC(=O)N(C)C[Si](C)(C)C 1626a_200020589227_100015343762 [0,0,1,0,0,1|0,1,0]=3 2051 B9R0.57 CC(=O)N(C)C[Si](C)(C)C 240690a_200020589227_100015343762 [0,0,1,0,0,1|0,1,0]=3 2052 B9R0.57 CC(=O)N(C)C[Si](C)(C)C 527a_200020589227_100103153847 [0,0,1,0,0,1|0,1,0]=3 2053 B9R0.57 CC(C)(C)NC(=O)C(=O)[13CH3] 1458a_100000238687_200025704644 [0,0,1,0,0,1|2,0,0]=4 2054 B9R0.57 CC(C)N(C)CC(C)(C)C 2230a_100000742839_100000210206 [0,0,1,0,0,1|1,0,1]=4 2055 B9R0.57 CC(C)N(C)CC(C)(C)C 2230a_107254826865_200000210301 [0,0,1,0,0,1|1,0,1]=4 2056 B9R0.57 CC(C)N(C)CC(C)(C)C 269982a_100000742839_100000210206 [0,0,1,0,0,1|1,0,1]=4 2057 B9R0.57 CC(C)N(C)CC(C)(C)C 269982a_107254826865_200000210301 [0,0,1,0,0,1|1,0,1]=4 2058 B9R0.57 CC(C)N(C)CC(C)(C)C 270004a_200000211004_100011204126 [0,0,1,0,0,1|1,0,1]=4 2059 B9R0.57 CC(C)N([13CH3])CC(C)(C)C 2230a_107254826865_200025704644 [0,0,1,0,0,1|1,0,1]=4 2060 B9R0.57 CC(C)N([13CH3])CC(C)(C)C 269982a_107254826865_200025704644 [0,0,1,0,0,1|1,0,1]=4 2061 B9R0.57 CC(NC(C)(C)C)C(=O)N 2230a_100000715429_100000702099 [0,0,1,0,0,1|2,0,0]=4 2062 B9R0.57 CC(OC(C)(C)C)C(=O)N 34a_100015890283_100000702099 [0,0,1,0,0,1|2,0,0]=4 2063 B9R0.57 CC(OC(C)(C)C)C(=O)N 7a_100015890283_100000702099 [0,0,1,0,0,1|2,0,0]=4 2064 B9R0.57 CC(SC(C)(C)C)C(=O)N 62a_100000211941_100000702099 [0,0,1,0,0,1|2,0,0]=4 2065 B9R0.57 CC(SC(C)(C)C)C(=O)N 62a_100000702099_100000211941 [0,0,1,0,0,1|2,0,0]=4 2066 B9R0.57 C[C@@H](NC(C)(C)C)C(=O)N 34a_100000119354_100000210625 [0,0,1,0,0,1|2,0,0]=4 2067 B9R0.57 C[C@@H](OC(C)(C)C)C(=O)N 34a_100000731257_100000210625 [0,0,1,0,0,1|2,0,0]=4 2068 B9R0.57 C[C@H](NC(C)(C)C)C(=O)O 269956a_100000743915_100000211941 [0,0,1,0,0,1|2,0,0]=4 2069 B9R1.66 CC1(CCCN(C1)[13CH3])C 2230a_100000716857_200025704644 [1,0,0,0,0,1|0,0,1]=3 2070 B9R1.66 CC1(CCCN(C1)[13CH3])C 269982a_100000716857_200025704644 [1,0,0,0,0,1|0,0,1]=3 2071 B9R1.66 CC1(CCCN(C1)[13CH3])C 34a_100000716857_200025704644 [1,0,0,0,0,1|0,0,1]=3 2072 B9R1.66 CC1(CCCN(C1)[13CH3])O 2230a_100000695535_200025704644 [1,0,0,0,0,1|1,0,1]=4 2073 B9R1.66 CC1(CCCN(C1)[13CH3])O 269982a_100000695535_200025704644 [1,0,0,0,0,1|1,0,1]=4 2074 B9R1.66 CC1(CN(CCO1)[13CH3])C 2230a_100000738910_200025704644 [1,0,0,0,0,1|1,0,1]=4 2075 B9R1.66 CC1(CN(CCO1)[13CH3])C 269982a_100000738910_200025704644 [1,0,0,0,0,1|1,0,1]=4 2076 B9R1.66 CC1(CN(CCO1)[13CH3])C 34a_100000738910_200025704644 [1,0,0,0,0,1|1,0,1]=4 2077 B9R1.66 CN1CCCC(C1)(C)C 2230a_100000716857_200000210301 [1,0,0,0,0,1|0,0,1]=3 2078 B9R1.66 CN1CCCC(C1)(C)C 269982a_100000716857_200000210301 [1,0,0,0,0,1|0,0,1]=3 2079 B9R1.66 CN1CCCC(C1)(C)C 34a_100000716857_200000210301 [1,0,0,0,0,1|0,0,1]=3 2080 B9R1.66 CN1CCCC(C1)(C)O 2230a_100000695535_200000210301 [1,0,0,0,0,1|1,0,1]=4 2081 B9R1.66 CN1CCCC(C1)(C)O 269982a_100000695535_200000210301 [1,0,0,0,0,1|1,0,1]=4 2082 B9R1.66 CN1CCOC(C1)(C)C 2230a_100000738910_200000210301 [1,0,0,0,0,1|1,0,1]=4 2083 B9R1.66 CN1CCOC(C1)(C)C 269982a_100000738910_200000210301 [1,0,0,0,0,1|1,0,1]=4 2084 B9R1.66 CN1CCOC(C1)(C)C 34a_100000738910_200000210301 [1,0,0,0,0,1|1,0,1]=4