0 B6R0.7 CC(=O)C(C)(C)C 1458a_106744555173_200000210301 [0,0,0,0,0,0|2,0,0]=2 1 B6R0.7 CC(=O)C(C)(C)F 1458a_100000765255_200000210301 [0,0,0,0,0,0|2,0,0]=2 2 B6R0.7 CC(=O)C(C)(C)O 1458a_100000242741_200000210301 [0,0,0,0,0,0|2,0,0]=2 3 B6R0.7 CC(=O)C(F)(F)F 1458a_100000070787_200000243211 [0,0,0,0,0,0|4,0,0]=4 4 B6R0.7 CC(=O)C(F)(F)F 1458a_100015355933_200000210301 [0,0,0,0,0,0|4,0,0]=4 5 B6R0.7 CC(C)(C)C(=O)[13CH3] 1458a_106744555173_200025704644 [0,0,0,0,0,0|2,0,0]=2 6 B6R0.7 CC(C)(F)C(=O)[13CH3] 1458a_100000765255_200025704644 [0,0,0,0,0,0|2,0,0]=2 7 B6R0.7 CC(C)(O)C(=O)[13CH3] 1458a_100000242741_200025704644 [0,0,0,0,0,0|2,0,0]=2 8 B6R0.7 CN(C)C(C)(C)C 269982a_100011215553_200000210301 [0,0,0,0,0,0|4,0,0]=4 9 B6R0.7 CN(C)C(C)(C)C 269982a_100102631434_100000210625 [0,0,0,0,0,0|4,0,0]=4 10 B6R0.7 CN([13CH3])C(C)(C)C 269982a_100011215553_200025704644 [0,0,0,0,0,0|4,0,0]=4 11 B6R0.7 [13CH3]C(=O)C(F)(F)F 1458a_100015355933_200025704644 [0,0,0,0,0,0|4,0,0]=4 12 B5R0.4 CC(C)(C)N[13CH3] 2230a_100000715429_200025704644 [1,0,0,0,0,0|3,0,0]=4 13 B5R0.4 CC(C)(C)O[13CH3] 34a_100015890283_200025704644 [1,0,0,0,0,0|3,0,0]=4 14 B5R0.4 CC(C)(C)O[13CH3] 7a_100015890283_200025704644 [1,0,0,0,0,0|3,0,0]=4 15 B5R0.4 CC(C)(C)S[13CH3] 62a_100000211941_200025704644 [1,0,0,0,0,0|3,0,0]=4 16 B5R0.4 CC(C)(C)S[13CH3] 62a_200025704644_100000211941 [1,0,0,0,0,0|3,0,0]=4 17 B5R0.4 CNC(C)(C)C 2230a_100000715429_200000210301 [1,0,0,0,0,0|3,0,0]=4 18 B5R0.4 CNC(C)(C)C 34a_100102657272_100000210625 [1,0,0,0,0,0|3,0,0]=4 19 B5R0.4 COC(C)(C)C 34a_100015890283_200000210301 [1,0,0,0,0,0|3,0,0]=4 20 B5R0.4 COC(C)(C)C 34a_100138415774_100000210625 [1,0,0,0,0,0|3,0,0]=4 21 B5R0.4 COC(C)(C)C 7a_100015890283_200000210301 [1,0,0,0,0,0|3,0,0]=4 22 B5R0.4 CSC(C)(C)C 62a_100000211941_200000210301 [1,0,0,0,0,0|3,0,0]=4 23 B5R0.4 CSC(C)(C)C 62a_200000210301_100000211941 [1,0,0,0,0,0|3,0,0]=4 24 B5R0.5 C=C(C)C(=O)C 1458a_100000185857_200000210301 [1,0,0,0,0,0|1,0,2]=4 25 B5R0.5 C=C(C)C(=O)[13CH3] 1458a_100000185857_200025704644 [1,0,0,0,0,0|1,0,2]=4 26 B5R0.5 CC(=O)C(C)C 1458a_100000070787_100000210206 [1,0,0,0,0,0|1,0,0]=2 27 B5R0.5 CC(=O)C(C)C 1458a_100000210198_200000210301 [1,0,0,0,0,0|1,0,0]=2 28 B5R0.5 CC(=O)C(C)F 1458a_100000062450_200000210301 [1,0,0,0,0,0|2,0,0]=3 29 B5R0.5 CC(=O)C(O)O 1458a_100000233687_200000210301 [1,0,0,0,0,0|3,0,0]=4 30 B5R0.5 CC(=O)N(C)C 11a_100102631434_100015343762 [1,0,0,0,0,0|2,0,0]=3 31 B5R0.5 CC(=O)N(C)C 1626a_100102631434_100015343762 [1,0,0,0,0,0|2,0,0]=3 32 B5R0.5 CC(=O)N(C)C 240690a_100102631434_100015343762 [1,0,0,0,0,0|2,0,0]=3 33 B5R0.5 CC(=O)N(C)C 527a_100102631434_100103153847 [1,0,0,0,0,0|2,0,0]=3 34 B5R0.5 CC(=O)[C@@H](C)O 1458a_100000717761_200000210301 [1,0,0,0,0,0|2,0,0]=3 35 B5R0.5 CC(=O)[C@H](C)O 1458a_217856618621_200000210301 [1,0,0,0,0,0|2,0,0]=3 36 B5R0.5 CC(C)C(=O)[13CH3] 1458a_100000210198_200025704644 [1,0,0,0,0,0|1,0,0]=2 37 B5R0.5 CC(C)N(C)C 2230a_100102631434_100000210206 [1,0,0,0,0,0|3,0,0]=4 38 B5R0.5 CC(C)N(C)C 269982a_100102631434_100000210206 [1,0,0,0,0,0|3,0,0]=4 39 B5R0.5 CC(C)N(C)C 269982a_200000211004_200000210301 [1,0,0,0,0,0|3,0,0]=4 40 B5R0.5 CC(C)N(C)[13CH3] 269982a_200000211004_200025704644 [1,0,0,0,0,0|3,0,0]=4 41 B5R0.5 CC(F)C(=O)[13CH3] 1458a_100000062450_200025704644 [1,0,0,0,0,0|2,0,0]=3 42 B5R0.5 C[C@@H](O)C(=O)[13CH3] 1458a_100000717761_200025704644 [1,0,0,0,0,0|2,0,0]=3 43 B5R0.5 C[C@H](O)C(=O)[13CH3] 1458a_217856618621_200025704644 [1,0,0,0,0,0|2,0,0]=3 44 B5R0.5 [13CH3]C(=O)C(O)O 1458a_100000233687_200025704644 [1,0,0,0,0,0|3,0,0]=4 45 B7R0.13 C#CC(C)(C)C(=O)C 1458a_100000070787_100000038118 [0,1,0,0,0,0|2,0,0]=3 46 B7R0.13 C#CC(C)(C)C(=O)C 1458a_100000079900_200000210301 [0,1,0,0,0,0|2,0,0]=3 47 B7R0.13 C#CC(C)(C)C(=O)[13CH3] 1458a_100000079900_200025704644 [0,1,0,0,0,0|2,0,0]=3 48 B7R0.13 C=CC(C)(C)C(=O)C 1458a_100012027013_200000210301 [0,1,0,0,0,0|2,0,0]=3 49 B7R0.13 C=CC(C)(C)C(=O)[13CH3] 1458a_100012027013_200025704644 [0,1,0,0,0,0|2,0,0]=3 50 B7R0.13 CC(=O)C(C)(C)C#N 1458a_100000740761_200000210301 [0,1,0,0,0,0|1,0,1]=3 51 B7R0.13 CC(=O)C(C)(C)CF 1458a_100000138116_200000210301 [0,1,0,0,0,0|2,0,0]=3 52 B7R0.13 CC(=O)C(C)(C)CO 1458a_100000749806_200000210301 [0,1,0,0,0,0|2,0,0]=3 53 B7R0.13 CC(=O)C(C)(C)O[13CH3] 34a_100000747739_200025704644 [0,1,0,0,0,0|2,0,0]=3 54 B7R0.13 CC(=O)C(C)(C)O[13CH3] 7a_100000747739_200025704644 [0,1,0,0,0,0|2,0,0]=3 55 B7R0.13 CC(=O)C(C)(C)S[13CH3] 62a_100000075568_200025704644 [0,1,0,0,0,0|2,0,0]=3 56 B7R0.13 CC(=O)C(C)(C)S[13CH3] 62a_200025704644_100000075568 [0,1,0,0,0,0|2,0,0]=3 57 B7R0.13 CC(C)(C#N)C(=O)[13CH3] 1458a_100000740761_200025704644 [0,1,0,0,0,0|1,0,1]=3 58 B7R0.13 CC(C)(CF)C(=O)[13CH3] 1458a_100000138116_200025704644 [0,1,0,0,0,0|2,0,0]=3 59 B7R0.13 CC(C)(CO)C(=O)[13CH3] 1458a_100000749806_200025704644 [0,1,0,0,0,0|2,0,0]=3 60 B7R0.13 CC(C)(N[13CH3])C(=O)N 2230a_100000743658_200025704644 [0,1,0,0,0,0|1,0,0]=2 61 B7R0.13 CC(C)(N[13CH3])C(=O)N 34a_100000743658_200025704644 [0,1,0,0,0,0|1,0,0]=2 62 B7R0.13 CC(C)(O[13CH3])C(=O)N 34a_100011626353_200025704644 [0,1,0,0,0,0|2,0,0]=3 63 B7R0.13 CC(C)(O[13CH3])C(=O)N 7a_100011626353_200025704644 [0,1,0,0,0,0|2,0,0]=3 64 B7R0.13 CC(C)(S[13CH3])C(=O)N 62a_100000702505_200025704644 [0,1,0,0,0,0|2,0,0]=3 65 B7R0.13 CC(C)(S[13CH3])C(=O)N 62a_200025704644_100000702505 [0,1,0,0,0,0|2,0,0]=3 66 B7R0.13 CC(C)(S[13CH3])[N+](=O)[O-] 62a_200009813997_200025704644 [0,1,0,0,0,0|2,0,1]=4 67 B7R0.13 CC(C)(S[13CH3])[N+](=O)[O-] 62a_200025704644_200009813997 [0,1,0,0,0,0|2,0,1]=4 68 B7R0.13 CC(C)C(C)(C)N[13CH3] 2230a_200160471154_200025704644 [0,1,0,0,0,0|2,0,1]=4 69 B7R0.13 CCC(C)(C)C(=O)C 1458a_100000749717_200000210301 [0,1,0,0,0,0|2,0,0]=3 70 B7R0.13 CCC(C)(C)C(=O)[13CH3] 1458a_100000749717_200025704644 [0,1,0,0,0,0|2,0,0]=3 71 B7R0.13 CCC(C)(O)C(=O)C 1458a_100011219770_200000210301 [0,1,0,0,0,0|2,0,0]=3 72 B7R0.13 CCC(C)(O)C(=O)[13CH3] 1458a_100011219770_200025704644 [0,1,0,0,0,0|2,0,0]=3 73 B7R0.13 CCC(F)(F)C(=O)C 1458a_100000061896_200000210301 [0,1,0,0,0,0|3,0,0]=4 74 B7R0.13 CCC(F)(F)C(=O)[13CH3] 1458a_100000061896_200025704644 [0,1,0,0,0,0|3,0,0]=4 75 B7R0.13 CNC(C)(C)C(=O)C 7a_106832991635_100000075568 [0,1,0,0,0,0|1,0,0]=2 76 B7R0.13 CNC(C)(C)C(=O)N 2230a_100000743658_200000210301 [0,1,0,0,0,0|1,0,0]=2 77 B7R0.13 CNC(C)(C)C(=O)N 2230a_106832991635_100000702505 [0,1,0,0,0,0|1,0,0]=2 78 B7R0.13 CNC(C)(C)C(=O)N 34a_100000743658_200000210301 [0,1,0,0,0,0|1,0,0]=2 79 B7R0.13 CNC(C)(C)C(=O)N 34a_100102657272_100000702505 [0,1,0,0,0,0|1,0,0]=2 80 B7R0.13 CNC(C)(C)C(=O)N 7a_106832991635_100000702505 [0,1,0,0,0,0|1,0,0]=2 81 B7R0.13 CNC(C)(C)C(C)C 2230a_200160471154_200000210301 [0,1,0,0,0,0|2,0,1]=4 82 B7R0.13 CNC(F)(F)C(=O)N 7a_106832991635_100009811971 [0,1,0,0,0,0|3,0,0]=4 83 B7R0.13 CNC(F)(F)C(=O)[O-] 34a_100102657272_100020612412 [0,1,0,0,0,0|2,0,1]=4 84 B7R0.13 COC(C)(C)C(=O)C 1458a_100000753492_200000210301 [0,1,0,0,0,0|2,0,0]=3 85 B7R0.13 COC(C)(C)C(=O)C 34a_100000747739_200000210301 [0,1,0,0,0,0|2,0,0]=3 86 B7R0.13 COC(C)(C)C(=O)C 7a_100000747739_200000210301 [0,1,0,0,0,0|2,0,0]=3 87 B7R0.13 COC(C)(C)C(=O)N 34a_100011626353_200000210301 [0,1,0,0,0,0|2,0,0]=3 88 B7R0.13 COC(C)(C)C(=O)N 34a_100138415774_100000702505 [0,1,0,0,0,0|2,0,0]=3 89 B7R0.13 COC(C)(C)C(=O)N 7a_100011626353_200000210301 [0,1,0,0,0,0|2,0,0]=3 90 B7R0.13 COC(C)(C)C(=O)[13CH3] 1458a_100000753492_200025704644 [0,1,0,0,0,0|2,0,0]=3 91 B7R0.13 COC(F)(F)C(=O)[O-] 34a_100138415774_100020612412 [0,1,0,0,0,0|2,0,1]=4 92 B7R0.13 CSC(C)(C)C(=O)C 62a_100000075568_200000210301 [0,1,0,0,0,0|2,0,0]=3 93 B7R0.13 CSC(C)(C)C(=O)C 62a_200000210301_100000075568 [0,1,0,0,0,0|2,0,0]=3 94 B7R0.13 CSC(C)(C)C(=O)N 62a_100000702505_200000210301 [0,1,0,0,0,0|2,0,0]=3 95 B7R0.13 CSC(C)(C)C(=O)N 62a_200000210301_100000702505 [0,1,0,0,0,0|2,0,0]=3 96 B7R0.13 CSC(C)(C)[N+](=O)[O-] 62a_200000210301_200009813997 [0,1,0,0,0,0|2,0,1]=4 97 B7R0.13 CSC(C)(C)[N+](=O)[O-] 62a_200009813997_200000210301 [0,1,0,0,0,0|2,0,1]=4 98 B7R0.13 CSC(F)(F)C(=O)N 62a_100009811971_200000210301 [0,1,0,0,0,0|3,0,0]=4 99 B7R0.13 CSC(F)(F)C(=O)N 62a_200000210301_100009811971 [0,1,0,0,0,0|3,0,0]=4 100 B7R0.13 CSC(F)(F)C(=O)[O-] 62a_100000745680_200000210301 [0,1,0,0,0,0|2,0,1]=4 101 B7R0.13 CSC(F)(F)C(=O)[O-] 62a_200000210301_100000745680 [0,1,0,0,0,0|2,0,1]=4 102 B7R0.13 [13CH3]SC(F)(F)C(=O)N 62a_100009811971_200025704644 [0,1,0,0,0,0|3,0,0]=4 103 B7R0.13 [13CH3]SC(F)(F)C(=O)N 62a_200025704644_100009811971 [0,1,0,0,0,0|3,0,0]=4 104 B7R0.13 [13CH3]SC(F)(F)C(=O)[O-] 62a_100000745680_200025704644 [0,1,0,0,0,0|2,0,1]=4 105 B7R0.13 [13CH3]SC(F)(F)C(=O)[O-] 62a_200025704644_100000745680 [0,1,0,0,0,0|2,0,1]=4 106 B7R0.14 CC(C)(C)C(=O)CF 1458a_106744555173_100015361967 [0,1,0,0,0,0|2,0,0]=3 107 B7R0.14 CC(C)(F)C(=O)CF 1458a_100000765255_100015361967 [0,1,0,0,0,0|2,0,0]=3 108 B7R0.14 CC(C)(O)C(=O)CF 1458a_100000242741_100015361967 [0,1,0,0,0,0|2,0,0]=3 109 B7R0.14 CCC(=O)C(C)(C)C 1458a_106744555173_100000210202 [0,1,0,0,0,0|2,0,0]=3 110 B7R0.14 CCC(=O)C(C)(C)F 1458a_100000765255_100000210202 [0,1,0,0,0,0|2,0,0]=3 111 B7R0.14 CCC(=O)C(C)(C)O 1458a_100000242741_100000210202 [0,1,0,0,0,0|2,0,0]=3 112 B7R0.14 CNC(=O)C(C)(C)C 11a_106832991635_106744555173 [0,1,0,0,0,0|2,0,0]=3 113 B7R0.14 CNC(=O)C(C)(C)C 1626a_100102657272_106744555173 [0,1,0,0,0,0|2,0,0]=3 114 B7R0.14 CNC(=O)C(C)(C)C 240690a_100102657272_106744555173 [0,1,0,0,0,0|2,0,0]=3 115 B7R0.14 CNC(=O)C(C)(C)C 527a_100102657272_106744555173 [0,1,0,0,0,0|2,0,0]=3 116 B7R0.14 CNC(=O)C(C)(C)F 11a_106832991635_100000765255 [0,1,0,0,0,0|2,0,0]=3 117 B7R0.14 CNC(=O)C(C)(C)F 1626a_100102657272_100000765255 [0,1,0,0,0,0|2,0,0]=3 118 B7R0.14 CNC(=O)C(C)(C)F 240690a_100102657272_100000765255 [0,1,0,0,0,0|2,0,0]=3 119 B7R0.14 CNC(=O)C(C)(C)F 527a_100102657272_100000765255 [0,1,0,0,0,0|2,0,0]=3 120 B7R0.14 CNC(=O)C(C)(C)O 240690a_100102657272_100000242741 [0,1,0,0,0,0|2,0,0]=3 121 B7R0.14 CNC(=O)C(C)(F)F 11a_106832991635_100000042251 [0,1,0,0,0,0|3,0,0]=4 122 B7R0.14 CNC(=O)C(C)(F)F 1626a_100102657272_100000042251 [0,1,0,0,0,0|3,0,0]=4 123 B7R0.14 CNC(=O)C(C)(F)F 240690a_100102657272_100000042251 [0,1,0,0,0,0|3,0,0]=4 124 B7R0.14 CNC(=O)C(C)(F)F 527a_100102657272_100000042251 [0,1,0,0,0,0|3,0,0]=4 125 B7R0.14 O=C(CO)C(F)(F)F 1458a_100000210174_200000243211 [0,1,0,0,0,0|3,0,0]=4 126 B7R1.19 CC(=O)C1(CC1)C 1458a_100000756474_200000210301 [0,0,0,1,0,0|2,0,0]=3 127 B7R1.19 CC(=O)C1(CC1)F 1458a_100000055089_200000210301 [0,0,0,1,0,0|2,0,0]=3 128 B7R1.19 CC(=O)C1(CC1)O 1458a_100000241761_200000210301 [0,0,0,1,0,0|2,0,0]=3 129 B7R1.19 CC1(CC1)C(=O)[13CH3] 1458a_100000756474_200025704644 [0,0,0,1,0,0|2,0,0]=3 130 B7R1.19 [13CH3]C(=O)C1(CC1)F 1458a_100000055089_200025704644 [0,0,0,1,0,0|2,0,0]=3 131 B7R1.19 [13CH3]C(=O)C1(CC1)O 1458a_100000241761_200025704644 [0,0,0,1,0,0|2,0,0]=3 132 B7R0.9 CC(=O)CC(C)(C)C 1458a_100000211214_200000210301 [0,0,0,0,0,1|2,0,0]=3 133 B7R0.9 CC(=O)CC(C)(C)O 1458a_100000693243_200000210301 [0,0,0,0,0,1|2,0,0]=3 134 B7R0.9 CC(=O)C[N+](C)(C)C 1458a_100000033712_200000210301 [0,0,0,0,0,1|3,0,0]=4 135 B7R0.9 CC(=O)C[Si](C)(C)C 1458a_100000070787_100000233785 [0,0,0,0,0,1|2,1,0]=4 136 B7R0.9 CC(=O)C[Si](C)(C)C 1458a_100011218504_200000210301 [0,0,0,0,0,1|2,1,0]=4 137 B7R0.9 CC(=O)NC(C)(C)C 11a_100000715429_100015343762 [0,0,0,0,0,1|2,0,0]=3 138 B7R0.9 CC(=O)NC(C)(C)C 1626a_100000715429_100015343762 [0,0,0,0,0,1|2,0,0]=3 139 B7R0.9 CC(=O)NC(C)(C)C 240690a_100000715429_100015343762 [0,0,0,0,0,1|2,0,0]=3 140 B7R0.9 CC(=O)NC(C)(C)C 527a_100000715429_100103153847 [0,0,0,0,0,1|2,0,0]=3 141 B7R0.9 CC(C)(C)CC(=O)[13CH3] 1458a_100000211214_200025704644 [0,0,0,0,0,1|2,0,0]=3 142 B7R0.9 CC(C)(O)CC(=O)[13CH3] 1458a_100000693243_200025704644 [0,0,0,0,0,1|2,0,0]=3 143 B7R0.9 C[N+](C)(C)CC(=O)[13CH3] 1458a_100000033712_200025704644 [0,0,0,0,0,1|3,0,0]=4 144 B7R0.9 C[Si](C)(C)CC(=O)[13CH3] 1458a_100011218504_200025704644 [0,0,0,0,0,1|2,1,0]=4 145 B4R0.1 CC(=O)CF 1458a_100000070787_100015361967 [2,0,0,0,0,0|2,0,0]=4 146 B4R0.1 CC(=O)CO 1458a_100000210174_200000210301 [2,0,0,0,0,0|2,0,0]=4 147 B4R0.1 CC(C)N[13CH3] 2230a_100138425928_200025704644 [2,0,0,0,0,0|2,0,0]=4 148 B4R0.1 CC(C)N[13CH3] 34a_100138425928_200025704644 [2,0,0,0,0,0|2,0,0]=4 149 B4R0.1 CC(C)O[13CH3] 34a_100000212225_200025704644 [2,0,0,0,0,0|2,0,0]=4 150 B4R0.1 CC(C)S[13CH3] 62a_100000210206_200025704644 [2,0,0,0,0,0|2,0,0]=4 151 B4R0.1 CC(C)S[13CH3] 62a_200025704644_100000210206 [2,0,0,0,0,0|2,0,0]=4 152 B4R0.1 CCC(=O)C 1458a_100000070787_100000210202 [2,0,0,0,0,0|1,0,0]=3 153 B4R0.1 CCC(=O)C 1458a_100000210414_200000210301 [2,0,0,0,0,0|1,0,0]=3 154 B4R0.1 CCC(=O)[13CH3] 1458a_100000210414_200025704644 [2,0,0,0,0,0|1,0,0]=3 155 B4R0.1 CNC(=O)C 11a_106832991635_100015343762 [2,0,0,0,0,0|2,0,0]=4 156 B4R0.1 CNC(=O)C 1626a_100102657272_100015343762 [2,0,0,0,0,0|2,0,0]=4 157 B4R0.1 CNC(=O)C 240690a_100102657272_100015343762 [2,0,0,0,0,0|2,0,0]=4 158 B4R0.1 CNC(=O)C 527a_100102657272_100103153847 [2,0,0,0,0,0|2,0,0]=4 159 B4R0.1 CNC(C)C 2230a_100138425928_200000210301 [2,0,0,0,0,0|2,0,0]=4 160 B4R0.1 CNC(C)C 2230a_106832991635_100000210206 [2,0,0,0,0,0|2,0,0]=4 161 B4R0.1 CNC(C)C 34a_100102657272_100000210206 [2,0,0,0,0,0|2,0,0]=4 162 B4R0.1 CNC(C)C 34a_100138425928_200000210301 [2,0,0,0,0,0|2,0,0]=4 163 B4R0.1 CNC(C)C 7a_106832991635_100000210206 [2,0,0,0,0,0|2,0,0]=4 164 B4R0.1 COC(C)C 34a_100000212225_200000210301 [2,0,0,0,0,0|2,0,0]=4 165 B4R0.1 COC(C)C 34a_100138415774_100000210206 [2,0,0,0,0,0|2,0,0]=4 166 B4R0.1 CSC(C)C 62a_100000210206_200000210301 [2,0,0,0,0,0|2,0,0]=4 167 B4R0.1 CSC(C)C 62a_200000210301_100000210206 [2,0,0,0,0,0|2,0,0]=4 168 B4R0.1 [13CH3]C(=O)CO 1458a_100000210174_200025704644 [2,0,0,0,0,0|2,0,0]=4 169 B6R0.5 CC(C)(F)CO[13CH3] 34a_100000716592_200025704644 [1,1,0,0,0,0|1,0,1]=4 170 B6R0.5 COCC(C)(C)C 34a_100138415774_100011219605 [1,1,0,0,0,0|1,0,1]=4 171 B6R0.5 COCC(C)(C)F 34a_100000716592_200000210301 [1,1,0,0,0,0|1,0,1]=4 172 B6R0.5 COCC(C)(C)F 34a_100138415774_100011997219 [1,1,0,0,0,0|1,0,1]=4 173 B6R0.5 COCC(C)(C)O 34a_100138415774_100000764493 [1,1,0,0,0,0|1,0,1]=4 174 B6R0.8 C#CC(C)(C)NC 34a_100000054563_200000210301 [1,1,0,0,0,0|1,0,1]=4 175 B6R0.8 C#CC(C)(C)NC 34a_100102657272_100000038118 [1,1,0,0,0,0|1,0,1]=4 176 B6R0.8 C#CC(C)(C)N[13CH3] 34a_100000054563_200025704644 [1,1,0,0,0,0|1,0,1]=4 177 B6R0.8 C=CC(C)(C)OC 34a_100011215311_200000210301 [1,1,0,0,0,0|2,0,0]=4 178 B6R0.8 C=CC(C)(C)OC 7a_100011215311_200000210301 [1,1,0,0,0,0|2,0,0]=4 179 B6R0.8 C=CC(C)(C)O[13CH3] 34a_100011215311_200025704644 [1,1,0,0,0,0|2,0,0]=4 180 B6R0.8 C=CC(C)(C)O[13CH3] 7a_100011215311_200025704644 [1,1,0,0,0,0|2,0,0]=4 181 B6R0.8 CC(C)(CO)N[13CH3] 2230a_100000210608_200025704644 [1,1,0,0,0,0|0,0,1]=3 182 B6R0.8 CCC(C)(C)NC 2230a_100000211385_200000210301 [1,1,0,0,0,0|1,0,1]=4 183 B6R0.8 CCC(C)(C)NC 7a_106832991635_100000210677 [1,1,0,0,0,0|1,0,1]=4 184 B6R0.8 CCC(C)(C)N[13CH3] 2230a_100000211385_200025704644 [1,1,0,0,0,0|1,0,1]=4 185 B6R0.8 CNC(C)(C)C#N 34a_100102657272_100011162410 [1,1,0,0,0,0|1,0,1]=4 186 B6R0.8 CNC(C)(C)C#N 7a_106832991635_100011162410 [1,1,0,0,0,0|1,0,1]=4 187 B6R0.8 CNC(C)(C)CO 2230a_100000210608_200000210301 [1,1,0,0,0,0|0,0,1]=3 188 B6R0.3 C#CC(=O)C(C)C 1458a_100000211873_100000210206 [1,1,0,0,0,0|1,0,0]=3 189 B6R0.3 C#CC(C)C(=O)C 1458a_100000070787_200000035995 [1,1,0,0,0,0|1,0,1]=4 190 B6R0.3 C/C=C(\C)/C(=O)C 1458a_100020587367_200000210301 [1,1,0,0,0,0|1,0,1]=4 191 B6R0.3 C/C=C(\C)/C(=O)[13CH3] 1458a_100020587367_200025704644 [1,1,0,0,0,0|1,0,1]=4 192 B6R0.3 C=C(C)C(C)NC 269862a_106832991636_100011216138 [1,1,0,0,0,0|2,0,0]=4 193 B6R0.3 C=CC(=O)C(C)C 1458a_100000185746_100000210206 [1,1,0,0,0,0|1,0,0]=3 194 B6R0.3 C=CC(=O)N(C)C 1626a_100102631434_100000185746 [1,1,0,0,0,0|2,0,0]=4 195 B6R0.3 C=CC(=O)N(C)C 240690a_100102631434_200121576911 [1,1,0,0,0,0|2,0,0]=4 196 B6R0.3 C=CC(C)C(=O)C 1458a_100011216780_200000210301 [1,1,0,0,0,0|1,0,1]=4 197 B6R0.3 C=CC(C)C(=O)[13CH3] 1458a_100011216780_200025704644 [1,1,0,0,0,0|1,0,1]=4 198 B6R0.3 CC(=O)C(C)C#N 1458a_100000070787_100000703298 [1,1,0,0,0,0|1,0,1]=4 199 B6R0.3 CC(=O)C(C)C#N 1458a_100000753662_200000210301 [1,1,0,0,0,0|1,0,1]=4 200 B6R0.3 CC(=O)C(C)O[13CH3] 34a_100000212229_200025704644 [1,1,0,0,0,0|1,0,0]=3 201 B6R0.3 CC(=O)C(C)S[13CH3] 62a_100009814033_200025704644 [1,1,0,0,0,0|1,0,0]=3 202 B6R0.3 CC(=O)C(C)S[13CH3] 62a_200025704644_100009814033 [1,1,0,0,0,0|1,0,0]=3 203 B6R0.3 CC(=O)C(O)CO 1458a_100011215603_200000210301 [1,1,0,0,0,0|2,0,0]=4 204 B6R0.3 CC(C#N)C(=O)[13CH3] 1458a_100000753662_200025704644 [1,1,0,0,0,0|1,0,1]=4 205 B6R0.3 CC(C)C(=O)CF 1458a_100000210198_100015361967 [1,1,0,0,0,0|1,0,0]=3 206 B6R0.3 CC(C)C(=O)CO 1458a_100000210174_100000210206 [1,1,0,0,0,0|0,0,0]=2 207 B6R0.3 CC(C)C(C)O[13CH3] 7a_100000748068_200025704644 [1,1,0,0,0,0|1,0,1]=4 208 B6R0.3 CC(F)C(=O)CF 1458a_100000062450_100015361967 [1,1,0,0,0,0|2,0,0]=4 209 B6R0.3 CC(S[13CH3])C(=O)N 62a_100000702099_200025704644 [1,1,0,0,0,0|1,0,0]=3 210 B6R0.3 CC(S[13CH3])C(=O)N 62a_200025704644_100000702099 [1,1,0,0,0,0|1,0,0]=3 211 B6R0.3 CCC(=O)C(C)C 1458a_100000210198_100000210202 [1,1,0,0,0,0|1,0,0]=3 212 B6R0.3 CCC(=O)C(C)C 1458a_100000210414_100000210206 [1,1,0,0,0,0|1,0,0]=3 213 B6R0.3 CCC(=O)C(C)F 1458a_100000062450_100000210202 [1,1,0,0,0,0|2,0,0]=4 214 B6R0.3 CCC(=O)N(C)C 11a_100102631434_100000210414 [1,1,0,0,0,0|2,0,0]=4 215 B6R0.3 CCC(=O)N(C)C 1626a_100102631434_100000210414 [1,1,0,0,0,0|2,0,0]=4 216 B6R0.3 CCC(=O)N(C)C 240690a_100102631434_100000210414 [1,1,0,0,0,0|2,0,0]=4 217 B6R0.3 CCC(=O)N(C)C 527a_100102631434_100000210414 [1,1,0,0,0,0|2,0,0]=4 218 B6R0.3 CCC(=O)[C@@H](C)O 1458a_100000717761_100000210202 [1,1,0,0,0,0|2,0,0]=4 219 B6R0.3 CCC(=O)[C@H](C)O 1458a_217856618621_100000210202 [1,1,0,0,0,0|2,0,0]=4 220 B6R0.3 CCC(C)C(=O)C 1458a_100000070787_100000758301 [1,1,0,0,0,0|1,0,0]=3 221 B6R0.3 CCC(C)C(=O)C 1458a_100011192722_200000210301 [1,1,0,0,0,0|1,0,0]=3 222 B6R0.3 CCC(C)C(=O)[13CH3] 1458a_100011192722_200025704644 [1,1,0,0,0,0|1,0,0]=3 223 B6R0.3 CCC(O)C(=O)C 1458a_100011196387_200000210301 [1,1,0,0,0,0|2,0,0]=4 224 B6R0.3 CCC(O)C(=O)[13CH3] 1458a_100011196387_200025704644 [1,1,0,0,0,0|2,0,0]=4 225 B6R0.3 CCN(C)C(=O)C 11a_100000225621_100015343762 [1,1,0,0,0,0|2,0,0]=4 226 B6R0.3 CCN(C)C(=O)C 1626a_100000225621_100015343762 [1,1,0,0,0,0|2,0,0]=4 227 B6R0.3 CCN(C)C(=O)C 240690a_100000225621_100015343762 [1,1,0,0,0,0|2,0,0]=4 228 B6R0.3 CCN(C)C(=O)C 527a_100000225621_100103153847 [1,1,0,0,0,0|2,0,0]=4 229 B6R0.3 CN(C)C(=O)CO 240690a_100102631434_100000210174 [1,1,0,0,0,0|1,0,0]=3 230 B6R0.3 CN(C)C(=O)CO 527a_100102631434_100000210174 [1,1,0,0,0,0|1,0,0]=3 231 B6R0.3 CNC(=O)C(C)C 11a_106832991635_100000210198 [1,1,0,0,0,0|1,0,0]=3 232 B6R0.3 CNC(=O)C(C)C 1626a_100102657272_100000210198 [1,1,0,0,0,0|1,0,0]=3 233 B6R0.3 CNC(=O)C(C)C 240690a_100102657272_100000210198 [1,1,0,0,0,0|1,0,0]=3 234 B6R0.3 CNC(=O)C(C)C 527a_100102657272_100000210198 [1,1,0,0,0,0|1,0,0]=3 235 B6R0.3 CNC(=O)C(C)F 11a_106832991635_100000062450 [1,1,0,0,0,0|2,0,0]=4 236 B6R0.3 CNC(=O)C(C)F 1626a_100102657272_100000062450 [1,1,0,0,0,0|2,0,0]=4 237 B6R0.3 CNC(=O)C(C)F 240690a_100102657272_100000062450 [1,1,0,0,0,0|2,0,0]=4 238 B6R0.3 CNC(=O)C(C)F 527a_100102657272_100000062450 [1,1,0,0,0,0|2,0,0]=4 239 B6R0.3 CNC(=O)N(C)C 2708a_100102657272_100102631434 [1,1,0,0,0,0|2,0,0]=4 240 B6R0.3 CNC(=O)[C@@H](C)O 240690a_100102657272_100000717761 [1,1,0,0,0,0|2,0,0]=4 241 B6R0.3 CNC(=O)[C@H](C)O 1626a_100102657272_217856618621 [1,1,0,0,0,0|2,0,0]=4 242 B6R0.3 CNC(=O)[C@H](C)O 240690a_100102657272_217856618621 [1,1,0,0,0,0|2,0,0]=4 243 B6R0.3 CNC(C)C(=O)C 2230a_106832991635_100009814033 [1,1,0,0,0,0|1,0,0]=3 244 B6R0.3 CNC(C)C(=O)C 7a_106832991635_100000179758 [1,1,0,0,0,0|1,0,0]=3 245 B6R0.3 CNC(C)C(=O)N 2230a_106832991635_100000702099 [1,1,0,0,0,0|1,0,0]=3 246 B6R0.3 CNC(C)C(=O)N 34a_100102657272_100000702099 [1,1,0,0,0,0|1,0,0]=3 247 B6R0.3 CNC(C)C(=O)N 7a_106832991635_100000702099 [1,1,0,0,0,0|1,0,0]=3 248 B6R0.3 CNC(F)C(=O)N 2230a_106832991635_100009813875 [1,1,0,0,0,0|2,0,0]=4 249 B6R0.3 CNC(F)C(=O)N 34a_100102657272_100009813875 [1,1,0,0,0,0|2,0,0]=4 250 B6R0.3 CNC(F)C(=O)N 7a_106832991635_100009813875 [1,1,0,0,0,0|2,0,0]=4 251 B6R0.3 CNC(F)C(=O)[O-] 34a_100102657272_100020610796 [1,1,0,0,0,0|1,0,1]=4 252 B6R0.3 CN[C@@H](C)C(=O)O 269956a_100000743915_200000210301 [1,1,0,0,0,0|0,0,0]=2 253 B6R0.3 CN[C@H](C)C(=O)N 2230a_100000119354_200000210301 [1,1,0,0,0,0|1,0,0]=3 254 B6R0.3 CN[C@H](C)C(=O)N 34a_100000119354_200000210301 [1,1,0,0,0,0|1,0,0]=3 255 B6R0.3 COC(C)C(=O)C 1458a_100000743197_200000210301 [1,1,0,0,0,0|1,0,0]=3 256 B6R0.3 COC(C)C(=O)C 34a_100000212229_200000210301 [1,1,0,0,0,0|1,0,0]=3 257 B6R0.3 COC(C)C(=O)N 34a_100138415774_100000702099 [1,1,0,0,0,0|1,0,0]=3 258 B6R0.3 COC(C)C(=O)[13CH3] 1458a_100000743197_200025704644 [1,1,0,0,0,0|1,0,0]=3 259 B6R0.3 COC(C)C(C)C 7a_100000748068_200000210301 [1,1,0,0,0,0|1,0,1]=4 260 B6R0.3 COC(F)C(=O)N 34a_100138415774_100009813875 [1,1,0,0,0,0|2,0,0]=4 261 B6R0.3 COC(F)C(=O)[O-] 34a_100138415774_100020610796 [1,1,0,0,0,0|1,0,1]=4 262 B6R0.3 CO[C@@H](C)C(=O)[O-] 7a_217856618621_200000210301 [1,1,0,0,0,0|0,0,1]=3 263 B6R0.3 CO[C@H](C)C(=O)N 34a_100000731257_200000210301 [1,1,0,0,0,0|1,0,0]=3 264 B6R0.3 CO[C@H](C)C(=O)N 7a_100000731257_200000210301 [1,1,0,0,0,0|1,0,0]=3 265 B6R0.3 CSC(C)C(=O)C 1458a_100000149566_200000210301 [1,1,0,0,0,0|1,0,0]=3 266 B6R0.3 CSC(C)C(=O)C 62a_100009814033_200000210301 [1,1,0,0,0,0|1,0,0]=3 267 B6R0.3 CSC(C)C(=O)C 62a_200000210301_100009814033 [1,1,0,0,0,0|1,0,0]=3 268 B6R0.3 CSC(C)C(=O)N 62a_100000702099_200000210301 [1,1,0,0,0,0|1,0,0]=3 269 B6R0.3 CSC(C)C(=O)N 62a_200000210301_100000702099 [1,1,0,0,0,0|1,0,0]=3 270 B6R0.3 CSC(C)C(=O)[13CH3] 1458a_100000149566_200025704644 [1,1,0,0,0,0|1,0,0]=3 271 B6R0.3 CSC(F)C(=O)N 62a_100009813875_200000210301 [1,1,0,0,0,0|2,0,0]=4 272 B6R0.3 CSC(F)C(=O)N 62a_200000210301_100009813875 [1,1,0,0,0,0|2,0,0]=4 273 B6R0.3 CSC(F)C(=O)[O-] 62a_100020610796_200000210301 [1,1,0,0,0,0|1,0,1]=4 274 B6R0.3 CSC(F)C(=O)[O-] 62a_200000210301_100020610796 [1,1,0,0,0,0|1,0,1]=4 275 B6R0.3 C[C@@H](N[13CH3])C(=O)N 2230a_100000119354_200025704644 [1,1,0,0,0,0|1,0,0]=3 276 B6R0.3 C[C@@H](N[13CH3])C(=O)N 34a_100000119354_200025704644 [1,1,0,0,0,0|1,0,0]=3 277 B6R0.3 C[C@@H](O)C(=O)CF 1458a_100000717761_100015361967 [1,1,0,0,0,0|2,0,0]=4 278 B6R0.3 C[C@@H](O[13CH3])C(=O)N 34a_100000731257_200025704644 [1,1,0,0,0,0|1,0,0]=3 279 B6R0.3 C[C@@H](O[13CH3])C(=O)N 7a_100000731257_200025704644 [1,1,0,0,0,0|1,0,0]=3 280 B6R0.3 C[C@H](N[13CH3])C(=O)O 269956a_100000743915_200025704644 [1,1,0,0,0,0|0,0,0]=2 281 B6R0.3 C[C@H](O)C(=O)CF 1458a_217856618621_100015361967 [1,1,0,0,0,0|2,0,0]=4 282 B6R0.3 C[C@H](O[13CH3])C(=O)[O-] 7a_217856618621_200025704644 [1,1,0,0,0,0|0,0,1]=3 283 B6R0.3 [13CH3]C(=O)C(O)CO 1458a_100011215603_200025704644 [1,1,0,0,0,0|2,0,0]=4 284 B6R0.3 [13CH3]SC(F)C(=O)N 62a_100009813875_200025704644 [1,1,0,0,0,0|2,0,0]=4 285 B6R0.3 [13CH3]SC(F)C(=O)N 62a_200025704644_100009813875 [1,1,0,0,0,0|2,0,0]=4 286 B6R0.3 [13CH3]SC(F)C(=O)[O-] 62a_100020610796_200025704644 [1,1,0,0,0,0|1,0,1]=4 287 B6R0.3 [13CH3]SC(F)C(=O)[O-] 62a_200025704644_100020610796 [1,1,0,0,0,0|1,0,1]=4 288 B8R0.24 C=CC(=O)NC(C)(C)C 1626a_100000715429_100000185746 [0,1,0,0,0,1|2,0,0]=4 289 B8R0.24 C=CC(=O)NC(C)(C)C 240690a_100000715429_200121576911 [0,1,0,0,0,1|2,0,0]=4 290 B8R0.24 CC(C)(C)CC(=O)CF 1458a_100000211214_100015361967 [0,1,0,0,0,1|2,0,0]=4 291 B8R0.24 CC(C)(C)NC(=O)CO 240690a_100000715429_100000210174 [0,1,0,0,0,1|1,0,0]=3 292 B8R0.24 CC(C)(C)NC(=O)CO 527a_100000715429_100000210174 [0,1,0,0,0,1|1,0,0]=3 293 B8R0.24 CC(C)(O)CC(=O)CF 1458a_100000693243_100015361967 [0,1,0,0,0,1|2,0,0]=4 294 B8R0.24 CCC(=O)CC(C)(C)C 1458a_100000211214_100000210202 [0,1,0,0,0,1|2,0,0]=4 295 B8R0.24 CCC(=O)CC(C)(C)O 1458a_100000693243_100000210202 [0,1,0,0,0,1|2,0,0]=4 296 B8R0.24 CCC(=O)NC(C)(C)C 11a_100000715429_100000210414 [0,1,0,0,0,1|2,0,0]=4 297 B8R0.24 CCC(=O)NC(C)(C)C 1626a_100000715429_100000210414 [0,1,0,0,0,1|2,0,0]=4 298 B8R0.24 CCC(=O)NC(C)(C)C 240690a_100000715429_100000210414 [0,1,0,0,0,1|2,0,0]=4 299 B8R0.24 CCC(=O)NC(C)(C)C 527a_100000715429_100000210414 [0,1,0,0,0,1|2,0,0]=4 300 B8R0.24 CNC(=O)CC(C)(C)C 11a_106832991635_100000211214 [0,1,0,0,0,1|2,0,0]=4 301 B8R0.24 CNC(=O)CC(C)(C)C 1626a_100102657272_100000211214 [0,1,0,0,0,1|2,0,0]=4 302 B8R0.24 CNC(=O)CC(C)(C)C 240690a_100102657272_100000211214 [0,1,0,0,0,1|2,0,0]=4 303 B8R0.24 CNC(=O)CC(C)(C)C 527a_100102657272_100000211214 [0,1,0,0,0,1|2,0,0]=4 304 B8R0.24 CNC(=O)CC(C)(C)O 527a_100102657272_100000693243 [0,1,0,0,0,1|2,0,0]=4 305 B8R0.24 CNC(=O)NC(C)(C)C 2708a_100102657272_100000715429 [0,1,0,0,0,1|2,0,0]=4 306 B8R0.24 CNC(=O)NC(C)(C)C 273464a_100000715429_100102657272 [0,1,0,0,0,1|2,0,0]=4 307 B8R0.24 CNC(=O)NC(C)(C)C 273464a_100102657272_100000715429 [0,1,0,0,0,1|2,0,0]=4 308 B8R0.24 CNC(=O)NC(C)(C)C 512a_100000715429_100102657272 [0,1,0,0,0,1|2,0,0]=4 309 B8R0.24 C[Si](C)(C)CC(=O)CO 1458a_100000210174_100000233785 [0,1,0,0,0,1|1,1,0]=4 310 B8R0.27 CC(=O)N(C)C(C)(C)C 11a_100011215553_100015343762 [0,1,0,0,0,1|2,0,0]=4 311 B8R0.27 CC(=O)N(C)C(C)(C)C 1626a_100011215553_100015343762 [0,1,0,0,0,1|2,0,0]=4 312 B8R0.27 CC(=O)N(C)C(C)(C)C 240690a_100011215553_100015343762 [0,1,0,0,0,1|2,0,0]=4 313 B8R0.27 CC(=O)[C@@H](O)C(C)(C)C 1458a_100009816492_200000210301 [0,1,0,0,0,1|2,0,0]=4 314 B8R0.27 CC(C)(C)[C@H](O)C(=O)[13CH3] 1458a_100009816492_200025704644 [0,1,0,0,0,1|2,0,0]=4 315 B8R0.34 C#CC(C)(C)NC(=O)C 11a_100000054563_100015343762 [0,1,0,0,0,1|2,0,0]=4 316 B8R0.34 C#CC(C)(C)NC(=O)C 1626a_100000054563_100015343762 [0,1,0,0,0,1|2,0,0]=4 317 B8R0.34 C#CC(C)(C)NC(=O)C 240690a_100000054563_100015343762 [0,1,0,0,0,1|2,0,0]=4 318 B8R0.34 CC(=O)CC(C)(C)O[13CH3] 7a_100000210262_200025704644 [0,1,0,0,0,1|2,0,0]=4 319 B8R0.34 CC(=O)NC(C)(C)C#N 11a_100000761509_100015343762 [0,1,0,0,0,1|1,0,1]=4 320 B8R0.34 CC(=O)NC(C)(C)C#N 1626a_100000761509_100015343762 [0,1,0,0,0,1|1,0,1]=4 321 B8R0.34 CC(=O)NC(C)(C)C#N 527a_100000761509_100103153847 [0,1,0,0,0,1|1,0,1]=4 322 B8R0.34 CC(=O)NC(C)(C)CO 240690a_100000210608_100015343762 [0,1,0,0,0,1|2,0,0]=4 323 B8R0.34 CC(=O)NC(C)(C)CO 527a_100020618417_100103153847 [0,1,0,0,0,1|2,0,0]=4 324 B8R0.34 CC(C)(CC(=O)N)N[13CH3] 2230a_100000763158_200025704644 [0,1,0,0,0,1|1,0,0]=3 325 B8R0.34 CC(C)(CC(=O)O)N[13CH3] 269956a_100000755897_200025704644 [0,1,0,0,0,1|0,0,0]=2 326 B8R0.34 CCC(C)(C)CC(=O)C 1458a_200000763500_200000210301 [0,1,0,0,0,1|2,0,0]=4 327 B8R0.34 CCC(C)(C)CC(=O)[13CH3] 1458a_200000763500_200025704644 [0,1,0,0,0,1|2,0,0]=4 328 B8R0.34 CCC(C)(C)NC(=O)C 11a_100000211385_100015343762 [0,1,0,0,0,1|2,0,0]=4 329 B8R0.34 CCC(C)(C)NC(=O)C 1626a_100000211385_100015343762 [0,1,0,0,0,1|2,0,0]=4 330 B8R0.34 CCC(C)(C)NC(=O)C 240690a_100000211385_100015343762 [0,1,0,0,0,1|2,0,0]=4 331 B8R0.34 CCC(C)(C)NC(=O)C 527a_100000211385_100103153847 [0,1,0,0,0,1|2,0,0]=4 332 B8R0.34 CCC(C)(O)CC(=O)C 1458a_200011219800_200000210301 [0,1,0,0,0,1|2,0,0]=4 333 B8R0.34 CCC(C)(O)CC(=O)[13CH3] 1458a_200011219800_200025704644 [0,1,0,0,0,1|2,0,0]=4 334 B8R0.34 CNC(C)(C)CC(=O)N 2230a_100000763158_200000210301 [0,1,0,0,0,1|1,0,0]=3 335 B8R0.34 CNC(C)(C)CC(=O)O 269956a_100000755897_200000210301 [0,1,0,0,0,1|0,0,0]=2 336 B8R0.34 COC(C)(C)CC(=O)C 7a_100000210262_200000210301 [0,1,0,0,0,1|2,0,0]=4 337 B8R0.12 C=CCC(C)(C)C(=O)C 1458a_100000705796_200000210301 [0,2,0,0,0,0|2,0,0]=4 338 B8R0.12 C=CCC(C)(C)C(=O)[13CH3] 1458a_100000705796_200025704644 [0,2,0,0,0,0|2,0,0]=4 339 B8R0.12 CC(=O)C(C)(C)OCF 34a_100000747739_100015361967 [0,2,0,0,0,0|2,0,0]=4 340 B8R0.12 CC(=O)C(C)(C)OCF 7a_100000747739_100015361967 [0,2,0,0,0,0|2,0,0]=4 341 B8R0.12 CC(=O)C(C)(C)SCF 62a_100000075568_100015361967 [0,2,0,0,0,0|2,0,0]=4 342 B8R0.12 CC(=O)C(C)(C)SCF 62a_100015361967_100000075568 [0,2,0,0,0,0|2,0,0]=4 343 B8R0.12 CC(C)(CN[13CH3])C(=O)N 2230a_100000740840_200025704644 [0,2,0,0,0,0|1,0,0]=3 344 B8R0.12 CC(C)(CN[13CH3])C(=O)N 34a_100000740840_200025704644 [0,2,0,0,0,0|1,0,0]=3 345 B8R0.12 CC(C)(CN[13CH3])C(=O)O 269956a_100000693527_200025704644 [0,2,0,0,0,0|0,0,0]=2 346 B8R0.12 CC(C)(CS[13CH3])C(=O)N 62a_200009895572_200025704644 [0,2,0,0,0,0|2,0,0]=4 347 B8R0.12 CC(C)(CS[13CH3])C(=O)N 62a_200025704644_200009895572 [0,2,0,0,0,0|2,0,0]=4 348 B8R0.12 CC(C)(NCF)C(=O)N 34a_100000743658_100015361967 [0,2,0,0,0,0|1,0,0]=3 349 B8R0.12 CC(C)(OCF)C(=O)N 34a_100011626353_100015361967 [0,2,0,0,0,0|2,0,0]=4 350 B8R0.12 CC(C)(OCF)C(=O)N 7a_100011626353_100015361967 [0,2,0,0,0,0|2,0,0]=4 351 B8R0.12 CC(C)(ON[13CH3])C(=O)O 269956a_100016989451_200025704644 [0,2,0,0,0,0|0,0,0]=2 352 B8R0.12 CC(C)(SCF)C(=O)N 62a_100000702505_100015361967 [0,2,0,0,0,0|2,0,0]=4 353 B8R0.12 CC(C)(SCF)C(=O)N 62a_100015361967_100000702505 [0,2,0,0,0,0|2,0,0]=4 354 B8R0.12 CCCC(C)(C)C(=O)C 1458a_100011215034_200000210301 [0,2,0,0,0,0|2,0,0]=4 355 B8R0.12 CCCC(C)(C)C(=O)[13CH3] 1458a_100011215034_200025704644 [0,2,0,0,0,0|2,0,0]=4 356 B8R0.12 CCNC(C)(C)C(=O)N 2230a_100000743658_100000210202 [0,2,0,0,0,0|1,0,0]=3 357 B8R0.12 CCNC(C)(C)C(=O)N 2230a_100015525214_100000702505 [0,2,0,0,0,0|1,0,0]=3 358 B8R0.12 CCNC(C)(C)C(=O)N 34a_100000743658_100000210202 [0,2,0,0,0,0|1,0,0]=3 359 B8R0.12 CCOC(C)(C)C(=O)C 1458a_100011458965_200000210301 [0,2,0,0,0,0|2,0,0]=4 360 B8R0.12 CCOC(C)(C)C(=O)C 34a_100000747739_100000210202 [0,2,0,0,0,0|2,0,0]=4 361 B8R0.12 CCOC(C)(C)C(=O)C 7a_100000747739_100000210202 [0,2,0,0,0,0|2,0,0]=4 362 B8R0.12 CCOC(C)(C)C(=O)N 34a_100011626353_100000210202 [0,2,0,0,0,0|2,0,0]=4 363 B8R0.12 CCOC(C)(C)C(=O)N 34a_100121572206_100000702505 [0,2,0,0,0,0|2,0,0]=4 364 B8R0.12 CCOC(C)(C)C(=O)N 7a_100011626353_100000210202 [0,2,0,0,0,0|2,0,0]=4 365 B8R0.12 CCOC(C)(C)C(=O)[13CH3] 1458a_100011458965_200025704644 [0,2,0,0,0,0|2,0,0]=4 366 B8R0.12 CCSC(C)(C)C(=O)C 62a_100000075568_100000210202 [0,2,0,0,0,0|2,0,0]=4 367 B8R0.12 CCSC(C)(C)C(=O)C 62a_100000210202_100000075568 [0,2,0,0,0,0|2,0,0]=4 368 B8R0.12 CCSC(C)(C)C(=O)N 62a_100000210202_100000702505 [0,2,0,0,0,0|2,0,0]=4 369 B8R0.12 CCSC(C)(C)C(=O)N 62a_100000702505_100000210202 [0,2,0,0,0,0|2,0,0]=4 370 B8R0.12 CNCC(C)(C)C(=O)N 2230a_100000740840_200000210301 [0,2,0,0,0,0|1,0,0]=3 371 B8R0.12 CNCC(C)(C)C(=O)N 34a_100000740840_200000210301 [0,2,0,0,0,0|1,0,0]=3 372 B8R0.12 CNCC(C)(C)C(=O)N 34a_100102657272_200009895572 [0,2,0,0,0,0|1,0,0]=3 373 B8R0.12 CNCC(C)(C)C(=O)O 269956a_100000693527_200000210301 [0,2,0,0,0,0|0,0,0]=2 374 B8R0.12 CNCC(F)(F)C(=O)O 269956a_100000734215_200000210301 [0,2,0,0,0,0|2,0,0]=4 375 B8R0.12 CNOC(C)(C)C(=O)O 269956a_100016989451_200000210301 [0,2,0,0,0,0|0,0,0]=2 376 B8R0.12 COCC(C)(C)C(=O)N 34a_100138415774_200009895572 [0,2,0,0,0,0|2,0,0]=4 377 B8R0.12 CSCC(C)(C)C(=O)N 62a_200000210301_200009895572 [0,2,0,0,0,0|2,0,0]=4 378 B8R0.12 CSCC(C)(C)C(=O)N 62a_200009895572_200000210301 [0,2,0,0,0,0|2,0,0]=4 379 B8R0.12 [13CH3]NCC(F)(F)C(=O)O 269956a_100000734215_200025704644 [0,2,0,0,0,0|2,0,0]=4 380 B8R0.13 C#CC(=O)C(C)(C)C#C 1458a_100000211873_100000038118 [0,2,0,0,0,0|2,0,0]=4 381 B8R0.13 C#CC(C)(C)C(=O)C=C 1458a_100000185746_100000038118 [0,2,0,0,0,0|2,0,0]=4 382 B8R0.13 C#CC(C)(C)C(=O)CC 1458a_100000079900_100000210202 [0,2,0,0,0,0|2,0,0]=4 383 B8R0.13 C#CC(C)(C)C(=O)CC 1458a_100000210414_100000038118 [0,2,0,0,0,0|2,0,0]=4 384 B8R0.13 C#CC(C)(C)C(=O)CF 1458a_100000079900_100015361967 [0,2,0,0,0,0|2,0,0]=4 385 B8R0.13 C#CC(C)(C)C(=O)CO 1458a_100000210174_100000038118 [0,2,0,0,0,0|1,0,0]=3 386 B8R0.13 C#CC(C)(C)C(=O)NC 11a_106832991635_100000079900 [0,2,0,0,0,0|2,0,0]=4 387 B8R0.13 C#CC(C)(C)C(=O)NC 1626a_100102657272_100000079900 [0,2,0,0,0,0|2,0,0]=4 388 B8R0.13 C#CC(C)(C)C(=O)NC 240690a_100102657272_100000079900 [0,2,0,0,0,0|2,0,0]=4 389 B8R0.13 C#CC(C)(C)C(=O)NC 527a_100102657272_100000079900 [0,2,0,0,0,0|2,0,0]=4 390 B8R0.13 C=CC(C)(C)C(=O)CC 1458a_100012027013_100000210202 [0,2,0,0,0,0|2,0,0]=4 391 B8R0.13 C=CC(C)(C)C(=O)CF 1458a_100012027013_100015361967 [0,2,0,0,0,0|2,0,0]=4 392 B8R0.13 C=CC(C)(C)C(=O)NC 11a_106832991635_100012027013 [0,2,0,0,0,0|2,0,0]=4 393 B8R0.13 C=CC(C)(C)C(=O)NC 1626a_100102657272_100012027013 [0,2,0,0,0,0|2,0,0]=4 394 B8R0.13 C=CC(C)(C)C(=O)NC 240690a_100102657272_100012027013 [0,2,0,0,0,0|2,0,0]=4 395 B8R0.13 C=CC(C)(C)C(=O)NC 527a_100102657272_100012027013 [0,2,0,0,0,0|2,0,0]=4 396 B8R0.13 CC(C)(C#N)C(=O)CF 1458a_100000740761_100015361967 [0,2,0,0,0,0|1,0,1]=4 397 B8R0.13 CC(C)(CF)C(=O)CF 1458a_100000138116_100015361967 [0,2,0,0,0,0|2,0,0]=4 398 B8R0.13 CC(C)(CO)C(=O)CF 1458a_100000749806_100015361967 [0,2,0,0,0,0|2,0,0]=4 399 B8R0.13 CC(C)(O[13CH3])C(=O)NN 34a_100000061348_200025704644 [0,2,0,0,0,0|2,0,0]=4 400 B8R0.13 CCC(=O)C(C)(C)C#N 1458a_100000740761_100000210202 [0,2,0,0,0,0|1,0,1]=4 401 B8R0.13 CCC(=O)C(C)(C)CC 1458a_100000749717_100000210202 [0,2,0,0,0,0|2,0,0]=4 402 B8R0.13 CCC(=O)C(C)(C)CF 1458a_100000138116_100000210202 [0,2,0,0,0,0|2,0,0]=4 403 B8R0.13 CCC(=O)C(C)(C)CO 1458a_100000749806_100000210202 [0,2,0,0,0,0|2,0,0]=4 404 B8R0.13 CCC(=O)C(C)(C)OC 1458a_100000753492_100000210202 [0,2,0,0,0,0|2,0,0]=4 405 B8R0.13 CCC(=O)C(C)(O)CC 1458a_100011219770_100000210202 [0,2,0,0,0,0|2,0,0]=4 406 B8R0.13 CCC(C)(C)C(=O)CF 1458a_100000749717_100015361967 [0,2,0,0,0,0|2,0,0]=4 407 B8R0.13 CCC(C)(C)C(=O)NC 11a_106832991635_100000749717 [0,2,0,0,0,0|2,0,0]=4 408 B8R0.13 CCC(C)(C)C(=O)NC 1626a_100102657272_100000749717 [0,2,0,0,0,0|2,0,0]=4 409 B8R0.13 CCC(C)(C)C(=O)NC 240690a_100102657272_100000749717 [0,2,0,0,0,0|2,0,0]=4 410 B8R0.13 CCC(C)(C)C(=O)NC 527a_100102657272_100000749717 [0,2,0,0,0,0|2,0,0]=4 411 B8R0.13 CCC(C)(O)C(=O)CF 1458a_100011219770_100015361967 [0,2,0,0,0,0|2,0,0]=4 412 B8R0.13 CCC(C)(O)C(=O)NC 240690a_100102657272_100011219770 [0,2,0,0,0,0|2,0,0]=4 413 B8R0.13 CNC(=O)C(C)(C)C#N 11a_106832991635_100000740761 [0,2,0,0,0,0|1,0,1]=4 414 B8R0.13 CNC(=O)C(C)(C)C#N 1626a_100102657272_100000740761 [0,2,0,0,0,0|1,0,1]=4 415 B8R0.13 CNC(=O)C(C)(C)C#N 240690a_100102657272_100000740761 [0,2,0,0,0,0|1,0,1]=4 416 B8R0.13 CNC(=O)C(C)(C)C#N 527a_100102657272_100000740761 [0,2,0,0,0,0|1,0,1]=4 417 B8R0.13 CNC(=O)C(C)(C)CF 11a_106832991635_100000138116 [0,2,0,0,0,0|2,0,0]=4 418 B8R0.13 CNC(=O)C(C)(C)CF 1626a_100102657272_100000138116 [0,2,0,0,0,0|2,0,0]=4 419 B8R0.13 CNC(=O)C(C)(C)CF 240690a_100102657272_100000138116 [0,2,0,0,0,0|2,0,0]=4 420 B8R0.13 CNC(=O)C(C)(C)CF 527a_100102657272_100000138116 [0,2,0,0,0,0|2,0,0]=4 421 B8R0.13 CNC(=O)C(C)(C)CO 1626a_100102657272_100000749806 [0,2,0,0,0,0|2,0,0]=4 422 B8R0.13 CNC(=O)C(C)(C)CO 240690a_100102657272_100000749806 [0,2,0,0,0,0|2,0,0]=4 423 B8R0.13 CNC(=O)C(C)(C)CO 527a_100102657272_100000749806 [0,2,0,0,0,0|2,0,0]=4 424 B8R0.13 CNC(=O)C(C)(C)NC 2230a_106832991635_100000732697 [0,2,0,0,0,0|1,0,0]=3 425 B8R0.13 CNC(=O)C(C)(C)NC 34a_100102657272_100000732697 [0,2,0,0,0,0|1,0,0]=3 426 B8R0.13 CNC(=O)C(C)(C)OC 11a_106832991635_100000753492 [0,2,0,0,0,0|2,0,0]=4 427 B8R0.13 CNC(=O)C(C)(C)OC 1626a_100102657272_100000753492 [0,2,0,0,0,0|2,0,0]=4 428 B8R0.13 CNC(=O)C(C)(C)OC 240690a_100102657272_100000753492 [0,2,0,0,0,0|2,0,0]=4 429 B8R0.13 CNC(=O)C(C)(C)OC 34a_100138415774_100000732697 [0,2,0,0,0,0|2,0,0]=4 430 B8R0.13 CNC(=O)C(C)(C)OC 527a_100102657272_100000753492 [0,2,0,0,0,0|2,0,0]=4 431 B8R0.13 CNC(=O)C(C)(C)SC 62a_100000732697_200000210301 [0,2,0,0,0,0|2,0,0]=4 432 B8R0.13 CNC(=O)C(C)(C)SC 62a_200000210301_100000732697 [0,2,0,0,0,0|2,0,0]=4 433 B8R0.13 CNC(=O)C(C)(C)S[13CH3] 62a_100000732697_200025704644 [0,2,0,0,0,0|2,0,0]=4 434 B8R0.13 CNC(=O)C(C)(C)S[13CH3] 62a_200025704644_100000732697 [0,2,0,0,0,0|2,0,0]=4 435 B8R0.13 CNC(C)(C)C(=O)OC 2230a_106832991635_100000689032 [0,2,0,0,0,0|0,0,0]=2 436 B8R0.13 CNC(C)(F)C(=O)OC 2230a_106832991635_200009867631 [0,2,0,0,0,0|1,0,0]=3 437 B8R0.13 CNC(C)(F)C(=O)OC 34a_100102657272_200009867631 [0,2,0,0,0,0|1,0,0]=3 438 B8R0.13 CNC(F)(F)C(=O)OC 34a_100102657272_100000211177 [0,2,0,0,0,0|2,0,0]=4 439 B8R0.13 CNC(F)(F)C(=O)OC 7a_106832991635_100000211177 [0,2,0,0,0,0|2,0,0]=4 440 B8R0.13 COC(=O)C(C)(C)OC 34a_100011217581_200000210301 [0,2,0,0,0,0|1,0,0]=3 441 B8R0.13 COC(=O)C(C)(C)OC 7a_100011217581_200000210301 [0,2,0,0,0,0|1,0,0]=3 442 B8R0.13 COC(=O)C(C)(C)O[13CH3] 34a_100011217581_200025704644 [0,2,0,0,0,0|1,0,0]=3 443 B8R0.13 COC(=O)C(C)(C)O[13CH3] 7a_100011217581_200025704644 [0,2,0,0,0,0|1,0,0]=3 444 B8R0.13 COC(=O)C(C)(C)SC 62a_100000689032_200000210301 [0,2,0,0,0,0|1,0,0]=3 445 B8R0.13 COC(=O)C(C)(C)SC 62a_200000210301_100000689032 [0,2,0,0,0,0|1,0,0]=3 446 B8R0.13 COC(=O)C(C)(C)S[13CH3] 62a_100000689032_200025704644 [0,2,0,0,0,0|1,0,0]=3 447 B8R0.13 COC(=O)C(C)(C)S[13CH3] 62a_200025704644_100000689032 [0,2,0,0,0,0|1,0,0]=3 448 B8R0.13 COC(=O)C(C)(F)OC 34a_100138415774_200009867631 [0,2,0,0,0,0|1,0,0]=3 449 B8R0.13 COC(=O)C(C)(F)SC 62a_200000210301_200009867631 [0,2,0,0,0,0|1,0,0]=3 450 B8R0.13 COC(=O)C(C)(F)SC 62a_200009867631_200000210301 [0,2,0,0,0,0|1,0,0]=3 451 B8R0.13 COC(=O)C(C)(F)S[13CH3] 62a_200009867631_200025704644 [0,2,0,0,0,0|1,0,0]=3 452 B8R0.13 COC(=O)C(C)(F)S[13CH3] 62a_200025704644_200009867631 [0,2,0,0,0,0|1,0,0]=3 453 B8R0.13 COC(=O)C(F)(F)OC 34a_100138415774_100000211177 [0,2,0,0,0,0|2,0,0]=4 454 B8R0.13 COC(=O)C(F)(F)SC 62a_100000211177_200000210301 [0,2,0,0,0,0|2,0,0]=4 455 B8R0.13 COC(=O)C(F)(F)SC 62a_200000210301_100000211177 [0,2,0,0,0,0|2,0,0]=4 456 B8R0.13 COC(=O)C(F)(F)S[13CH3] 62a_100000211177_200025704644 [0,2,0,0,0,0|2,0,0]=4 457 B8R0.13 COC(=O)C(F)(F)S[13CH3] 62a_200025704644_100000211177 [0,2,0,0,0,0|2,0,0]=4 458 B8R0.13 COC(C)(C)C(=O)CF 1458a_100000753492_100015361967 [0,2,0,0,0,0|2,0,0]=4 459 B8R0.13 COC(C)(C)C(=O)NN 34a_100000061348_200000210301 [0,2,0,0,0,0|2,0,0]=4 460 B8R0.36 CC(=O)C(C)(CO)CO 1458a_100000693232_200000210301 [0,2,0,0,0,0|2,0,0]=4 461 B8R0.36 CC(CO)(CO)C(=O)[13CH3] 1458a_100000693232_200025704644 [0,2,0,0,0,0|2,0,0]=4 462 B8R0.36 CCC(C)(CC)C(=O)C 1458a_100000070787_100009817345 [0,2,0,0,0,0|2,0,0]=4 463 B8R0.36 CCC(C)(CC)C(=O)C 1458a_100000760562_200000210301 [0,2,0,0,0,0|2,0,0]=4 464 B8R0.36 CCC(C)(CC)C(=O)[13CH3] 1458a_100000760562_200025704644 [0,2,0,0,0,0|2,0,0]=4 465 B8R0.36 CCC(C)(NC)C(=O)O 269956a_100025756313_200000210301 [0,2,0,0,0,0|0,0,0]=2 466 B8R0.36 CCC(C)(N[13CH3])C(=O)O 269956a_100025756313_200025704644 [0,2,0,0,0,0|0,0,0]=2 467 B8R0.37 C=C(Cl)C(C)(C)C(=O)C 1458a_100000049003_200000210301 [0,2,0,0,0,0|2,0,0]=4 468 B8R0.37 C=C(Cl)C(C)(C)C(=O)[13CH3] 1458a_100000049003_200025704644 [0,2,0,0,0,0|2,0,0]=4 469 B8R0.37 CC(=O)C(C)(C)N(C)C 1458a_100000688961_200000210301 [0,2,0,0,0,0|1,0,0]=3 470 B8R0.37 CC(=O)C(C)(C)N(C)C 269982a_100102631434_100000075568 [0,2,0,0,0,0|1,0,0]=3 471 B8R0.37 CN(C)C(C)(C)C(=O)N 2230a_100102631434_100000702505 [0,2,0,0,0,0|1,0,0]=3 472 B8R0.37 CN(C)C(C)(C)C(=O)N 269982a_100102631434_100000702505 [0,2,0,0,0,0|1,0,0]=3 473 B8R0.37 CN(C)C(C)(C)C(=O)[13CH3] 1458a_100000688961_200025704644 [0,2,0,0,0,0|1,0,0]=3 474 B8R0.37 CN(C)C(C)(C)[N+](=O)[O-] 269982a_100102631434_200009813997 [0,2,0,0,0,0|1,0,1]=4 475 B8R0.14 C#CCC(=O)C(C)(C)C 1458a_106744555173_100000184674 [0,2,0,0,0,0|2,0,0]=4 476 B8R0.14 C#CCC(=O)C(C)(C)F 1458a_100000765255_100000184674 [0,2,0,0,0,0|2,0,0]=4 477 B8R0.14 C#CCC(=O)C(C)(C)O 1458a_100000242741_100000184674 [0,2,0,0,0,0|2,0,0]=4 478 B8R0.14 C=CCC(=O)C(C)(C)C 1458a_106744555173_100000210623 [0,2,0,0,0,0|2,0,0]=4 479 B8R0.14 C=CCC(=O)C(C)(C)F 1458a_100000765255_100000210623 [0,2,0,0,0,0|2,0,0]=4 480 B8R0.14 C=CCC(=O)C(C)(C)O 1458a_100000242741_100000210623 [0,2,0,0,0,0|2,0,0]=4 481 B8R0.14 CC(C)(C)C(=O)CC#N 1458a_106744555173_100011214920 [0,2,0,0,0,0|2,0,0]=4 482 B8R0.14 CC(C)(C)C(=O)CCF 1458a_106744555173_100011217306 [0,2,0,0,0,0|2,0,0]=4 483 B8R0.14 CC(C)(C)C(=O)CCO 1458a_106744555173_100000211926 [0,2,0,0,0,0|1,0,0]=3 484 B8R0.14 CC(C)(C)C(=O)CO[13CH3] 34a_200011592769_200025704644 [0,2,0,0,0,0|1,0,0]=3 485 B8R0.14 CC(C)(C)C(=O)CO[13CH3] 7a_200011592769_200025704644 [0,2,0,0,0,0|1,0,0]=3 486 B8R0.14 CC(C)(C)C(=O)CS[13CH3] 62a_100000210923_200025704644 [0,2,0,0,0,0|1,1,0]=4 487 B8R0.14 CC(C)(C)C(=O)CS[13CH3] 62a_200025704644_100000210923 [0,2,0,0,0,0|1,1,0]=4 488 B8R0.14 CC(C)(F)C(=O)CC#N 1458a_100000765255_100011214920 [0,2,0,0,0,0|2,0,0]=4 489 B8R0.14 CC(C)(F)C(=O)CCF 1458a_100000765255_100011217306 [0,2,0,0,0,0|2,0,0]=4 490 B8R0.14 CC(C)(F)C(=O)CCO 1458a_100000765255_100000211926 [0,2,0,0,0,0|1,0,0]=3 491 B8R0.14 CC(C)(O)C(=O)CC#N 1458a_100000242741_100011214920 [0,2,0,0,0,0|2,0,0]=4 492 B8R0.14 CC(C)(O)C(=O)CCF 1458a_100000242741_100011217306 [0,2,0,0,0,0|2,0,0]=4 493 B8R0.14 CC(C)(O)C(=O)CCO 1458a_100000242741_100000211926 [0,2,0,0,0,0|1,0,0]=3 494 B8R0.14 CCCC(=O)C(C)(C)C 1458a_106744555173_100000210303 [0,2,0,0,0,0|2,0,0]=4 495 B8R0.14 CCCC(=O)C(C)(C)F 1458a_100000765255_100000210303 [0,2,0,0,0,0|2,0,0]=4 496 B8R0.14 CCCC(=O)C(C)(C)O 1458a_100000242741_100000210303 [0,2,0,0,0,0|2,0,0]=4 497 B8R0.14 CCNC(=O)C(C)(C)C 11a_100015525214_106744555173 [0,2,0,0,0,0|2,0,0]=4 498 B8R0.14 CCNC(=O)C(C)(C)C 240690a_100015525214_106744555173 [0,2,0,0,0,0|2,0,0]=4 499 B8R0.14 CCNC(=O)C(C)(C)C 527a_100015525214_106744555173 [0,2,0,0,0,0|2,0,0]=4 500 B8R0.14 CCNC(=O)C(C)(C)F 11a_100015525214_100000765255 [0,2,0,0,0,0|2,0,0]=4 501 B8R0.14 CCNC(=O)C(C)(C)F 240690a_100015525214_100000765255 [0,2,0,0,0,0|2,0,0]=4 502 B8R0.14 CCNC(=O)C(C)(C)F 527a_100015525214_100000765255 [0,2,0,0,0,0|2,0,0]=4 503 B8R0.14 CCNC(=O)C(C)(C)O 240690a_100015525214_100000242741 [0,2,0,0,0,0|2,0,0]=4 504 B8R0.14 CNCC(=O)C(C)(C)C 34a_100102657272_100000229897 [0,2,0,0,0,0|2,0,0]=4 505 B8R0.14 CNCC(=O)C(C)(C)C 7a_106832991635_100000210923 [0,2,0,0,0,0|2,0,0]=4 506 B8R0.14 CNNC(=O)C(C)(C)C 22a_100016993582_106744555173 [0,2,0,0,0,0|2,0,0]=4 507 B8R0.14 CNNC(=O)C(C)(C)F 22a_100016993582_100000765255 [0,2,0,0,0,0|2,0,0]=4 508 B8R0.14 CNNC(=O)C(C)(C)O 22a_100016993582_100000242741 [0,2,0,0,0,0|2,0,0]=4 509 B8R0.14 COCC(=O)C(C)(C)C 34a_100138415774_100000229897 [0,2,0,0,0,0|1,0,0]=3 510 B8R0.14 COCC(=O)C(C)(C)C 34a_200011592769_200000210301 [0,2,0,0,0,0|1,0,0]=3 511 B8R0.14 COCC(=O)C(C)(C)C 7a_200011592769_200000210301 [0,2,0,0,0,0|1,0,0]=3 512 B8R0.14 CSCC(=O)C(C)(C)C 62a_100000210923_200000210301 [0,2,0,0,0,0|1,1,0]=4 513 B8R0.14 CSCC(=O)C(C)(C)C 62a_200000210301_100000210923 [0,2,0,0,0,0|1,1,0]=4 514 B6R1.11 CC(=O)C1CC1 1458a_100000210395_200000210301 [1,0,0,1,0,0|1,0,0]=3 515 B6R1.11 CC(=O)C1CO1 1458a_100000701028_200000210301 [1,0,0,1,0,0|2,0,0]=4 516 B6R1.11 [13CH3]C(=O)C1CC1 1458a_100000210395_200025704644 [1,0,0,1,0,0|1,0,0]=3 517 B6R1.11 [13CH3]C(=O)C1CO1 1458a_100000701028_200025704644 [1,0,0,1,0,0|2,0,0]=4 518 B8R1.42 CC(=O)CC1(CC1)C 1458a_100000112800_200000210301 [0,0,0,1,0,1|2,0,0]=4 519 B8R1.42 CC(=O)CC1(CO1)C 1458a_100000070787_100000760498 [0,0,0,1,0,1|2,0,0]=4 520 B8R1.42 CC(=O)NC1(CC1)C 11a_100000757604_100015343762 [0,0,0,1,0,1|2,0,0]=4 521 B8R1.42 CC(=O)NC1(CC1)C 1626a_100000757604_100015343762 [0,0,0,1,0,1|2,0,0]=4 522 B8R1.42 CC(=O)NC1(CC1)C 240690a_100000757604_100015343762 [0,0,0,1,0,1|2,0,0]=4 523 B8R1.42 CC(=O)NC1(CC1)C 527a_100000757604_100103153847 [0,0,0,1,0,1|2,0,0]=4 524 B8R1.42 CC1(CC1)CC(=O)[13CH3] 1458a_100000112800_200025704644 [0,0,0,1,0,1|2,0,0]=4 525 B8R1.77 CC(=O)[C@H]1CC1(C)C 1458a_100000692687_200000210301 [0,0,0,1,0,1|2,0,0]=4 526 B8R1.77 CC1(C[C@@H]1C(=O)[13CH3])C 1458a_100000692687_200025704644 [0,0,0,1,0,1|2,0,0]=4 527 B8R1.63 C#CC1(CC1)C(=O)C 1458a_100000139144_200000210301 [0,1,0,1,0,0|2,0,0]=4 528 B8R1.63 C#CC1(CC1)C(=O)[13CH3] 1458a_100000139144_200025704644 [0,1,0,1,0,0|2,0,0]=4 529 B8R1.63 CC(=O)C1(CC1)C#N 1458a_100000070787_100009889376 [0,1,0,1,0,0|1,0,1]=4 530 B8R1.63 CC(=O)C1(CC1)C#N 1458a_100000691320_200000210301 [0,1,0,1,0,0|1,0,1]=4 531 B8R1.63 CC(=O)C1(CC1)CO 1458a_100012027107_200000210301 [0,1,0,1,0,0|2,0,0]=4 532 B8R1.63 CC(=O)C1(CC1)S[13CH3] 62a_100000086384_200025704644 [0,1,0,1,0,0|2,0,0]=4 533 B8R1.63 CC(=O)C1(CC1)S[13CH3] 62a_200025704644_100000086384 [0,1,0,1,0,0|2,0,0]=4 534 B8R1.63 CNC1(CC1)C(=O)N 2230a_100000687655_200000210301 [0,1,0,1,0,0|1,0,0]=3 535 B8R1.63 CNC1(CC1)C(=O)N 34a_100102657272_100010760883 [0,1,0,1,0,0|1,0,0]=3 536 B8R1.63 CNC1(CC1)C(=O)N 7a_106832991635_100010760883 [0,1,0,1,0,0|1,0,0]=3 537 B8R1.63 CNC1(CC1)C(=O)O 269956a_100000746478_200000210301 [0,1,0,1,0,0|0,0,0]=2 538 B8R1.63 COC1(CC1)C(=O)C 1458a_100000137688_200000210301 [0,1,0,1,0,0|2,0,0]=4 539 B8R1.63 COC1(CC1)C(=O)N 34a_100138415774_100010760883 [0,1,0,1,0,0|2,0,0]=4 540 B8R1.63 COC1(CC1)C(=O)[13CH3] 1458a_100000137688_200025704644 [0,1,0,1,0,0|2,0,0]=4 541 B8R1.63 CSC1(CC1)C(=O)C 62a_100000086384_200000210301 [0,1,0,1,0,0|2,0,0]=4 542 B8R1.63 CSC1(CC1)C(=O)C 62a_200000210301_100000086384 [0,1,0,1,0,0|2,0,0]=4 543 B8R1.63 CSC1(CC1)C(=O)N 62a_100010760883_200000210301 [0,1,0,1,0,0|2,0,0]=4 544 B8R1.63 CSC1(CC1)C(=O)N 62a_200000210301_100010760883 [0,1,0,1,0,0|2,0,0]=4 545 B8R1.63 [13CH3]C(=O)C1(CC1)C#N 1458a_100000691320_200025704644 [0,1,0,1,0,0|1,0,1]=4 546 B8R1.63 [13CH3]C(=O)C1(CC1)CO 1458a_100012027107_200025704644 [0,1,0,1,0,0|2,0,0]=4 547 B8R1.63 [13CH3]NC1(CC1)C(=O)N 2230a_100000687655_200025704644 [0,1,0,1,0,0|1,0,0]=3 548 B8R1.63 [13CH3]NC1(CC1)C(=O)O 269956a_100000746478_200025704644 [0,1,0,1,0,0|0,0,0]=2 549 B8R1.63 [13CH3]SC1(CC1)C(=O)N 62a_100010760883_200025704644 [0,1,0,1,0,0|2,0,0]=4 550 B8R1.63 [13CH3]SC1(CC1)C(=O)N 62a_200025704644_100010760883 [0,1,0,1,0,0|2,0,0]=4 551 B8R1.78 CC(=O)C1(CCC1)C 1458a_100000684636_200000210301 [0,1,0,1,0,0|2,0,0]=4 552 B8R1.78 CC(=O)C1(CCC1)O 1458a_100000242746_200000210301 [0,1,0,1,0,0|2,0,0]=4 553 B8R1.78 CC(=O)C1(COC1)C 1458a_100000094709_200000210301 [0,1,0,1,0,0|2,0,0]=4 554 B8R1.78 CC(=O)C1(COC1)O 1458a_100010273515_200000210301 [0,1,0,1,0,0|2,0,0]=4 555 B8R1.78 CC1(CCC1)C(=O)[13CH3] 1458a_100000684636_200025704644 [0,1,0,1,0,0|2,0,0]=4 556 B8R1.78 CC1(COC1)C(=O)[13CH3] 1458a_100000094709_200025704644 [0,1,0,1,0,0|2,0,0]=4 557 B8R1.78 [13CH3]C(=O)C1(CCC1)O 1458a_100000242746_200025704644 [0,1,0,1,0,0|2,0,0]=4 558 B8R1.78 [13CH3]C(=O)C1(COC1)O 1458a_100010273515_200025704644 [0,1,0,1,0,0|2,0,0]=4 559 B8R1.39 CC1(CC1)C(=O)CF 1458a_100000756474_100015361967 [0,1,0,1,0,0|2,0,0]=4 560 B8R1.39 CCC(=O)C1(CC1)C 1458a_100000756474_100000210202 [0,1,0,1,0,0|2,0,0]=4 561 B8R1.39 CCC(=O)C1(CC1)F 1458a_100000055089_100000210202 [0,1,0,1,0,0|2,0,0]=4 562 B8R1.39 CCC(=O)C1(CC1)O 1458a_100000241761_100000210202 [0,1,0,1,0,0|2,0,0]=4 563 B8R1.39 CNC(=O)C1(CC1)C 11a_106832991635_100000756474 [0,1,0,1,0,0|2,0,0]=4 564 B8R1.39 CNC(=O)C1(CC1)C 1626a_100102657272_100000756474 [0,1,0,1,0,0|2,0,0]=4 565 B8R1.39 CNC(=O)C1(CC1)C 240690a_100102657272_100000756474 [0,1,0,1,0,0|2,0,0]=4 566 B8R1.39 CNC(=O)C1(CC1)C 527a_100102657272_100000756474 [0,1,0,1,0,0|2,0,0]=4 567 B8R1.39 CNC(=O)C1(CC1)F 11a_106832991635_100000055089 [0,1,0,1,0,0|2,0,0]=4 568 B8R1.39 CNC(=O)C1(CC1)F 1626a_100102657272_100000055089 [0,1,0,1,0,0|2,0,0]=4 569 B8R1.39 CNC(=O)C1(CC1)F 240690a_100102657272_100000055089 [0,1,0,1,0,0|2,0,0]=4 570 B8R1.39 CNC(=O)C1(CC1)F 527a_100102657272_100000055089 [0,1,0,1,0,0|2,0,0]=4 571 B8R1.39 CNC(=O)C1(CC1)O 240690a_100102657272_100000241761 [0,1,0,1,0,0|2,0,0]=4 572 B8R1.39 O=C(CF)C1(CC1)F 1458a_100000055089_100015361967 [0,1,0,1,0,0|2,0,0]=4 573 B8R1.39 O=C(CF)C1(CC1)O 1458a_100000241761_100015361967 [0,1,0,1,0,0|2,0,0]=4 574 B6R0.2 CC(=CC(=O)[13CH3])C 1458a_100000211388_200025704644 [1,0,0,0,0,1|1,0,1]=4 575 B6R0.2 CC(=O)C=C(C)C 1458a_100000211388_200000210301 [1,0,0,0,0,1|1,0,1]=4 576 B6R0.2 CC(=O)CC(C)C 1458a_100000070787_100000210624 [1,0,0,0,0,1|1,0,0]=3 577 B6R0.2 CC(=O)CC(C)C 1458a_100000210554_200000210301 [1,0,0,0,0,1|1,0,0]=3 578 B6R0.2 CC(=O)CC(C)O 1458a_100000070787_100011218427 [1,0,0,0,0,1|2,0,0]=4 579 B6R0.2 CC(=O)CN(C)C 1458a_100000750896_200000210301 [1,0,0,0,0,1|2,0,0]=4 580 B6R0.2 CC(=O)C[C@@H](C)O 1458a_100011933948_200000210301 [1,0,0,0,0,1|2,0,0]=4 581 B6R0.2 CC(=O)C[S+](C)C 1458a_200159257847_200000210301 [1,0,0,0,0,1|2,0,0]=4 582 B6R0.2 CC(=O)NC(C)C 11a_100138425928_100015343762 [1,0,0,0,0,1|1,0,0]=3 583 B6R0.2 CC(=O)NC(C)C 1626a_100138425928_100015343762 [1,0,0,0,0,1|1,0,0]=3 584 B6R0.2 CC(=O)NC(C)C 240690a_100138425928_100015343762 [1,0,0,0,0,1|1,0,0]=3 585 B6R0.2 CC(=O)NC(C)C 527a_100138425928_100103153847 [1,0,0,0,0,1|1,0,0]=3 586 B6R0.2 CC(C)CC(=O)[13CH3] 1458a_100000210554_200025704644 [1,0,0,0,0,1|1,0,0]=3 587 B6R0.2 CN(C)CC(=O)N 2230a_100000739694_200000210301 [1,0,0,0,0,1|2,0,0]=4 588 B6R0.2 CN(C)CC(=O)N 2230a_100102631434_100000747473 [1,0,0,0,0,1|2,0,0]=4 589 B6R0.2 CN(C)CC(=O)N 269982a_100102631434_100000187820 [1,0,0,0,0,1|2,0,0]=4 590 B6R0.2 CN(C)CC(=O)O 269956a_100000746989_200000210301 [1,0,0,0,0,1|1,0,0]=3 591 B6R0.2 CN(C)CC(=O)[13CH3] 1458a_100000750896_200025704644 [1,0,0,0,0,1|2,0,0]=4 592 B6R0.2 CN(C)CC(=O)[O-] 269982a_100102631434_100020667443 [1,0,0,0,0,1|1,0,1]=4 593 B6R0.2 CN([13CH3])CC(=O)N 2230a_100000739694_200025704644 [1,0,0,0,0,1|2,0,0]=4 594 B6R0.2 CN([13CH3])CC(=O)O 269956a_100000746989_200025704644 [1,0,0,0,0,1|1,0,0]=3 595 B6R0.2 C[C@@H](O)CC(=O)[13CH3] 1458a_100011933948_200025704644 [1,0,0,0,0,1|2,0,0]=4 596 B6R0.2 C[S+](C)CC(=O)[13CH3] 1458a_200159257847_200025704644 [1,0,0,0,0,1|2,0,0]=4 597 B8R0.29 CC(=O)C#CC(C)(C)C 1458a_100011966651_200000210301 [0,0,0,0,0,2|2,0,0]=4 598 B8R0.29 CC(=O)CCC(C)(C)C 1458a_100000070787_100000755188 [0,0,0,0,0,2|2,0,0]=4 599 B8R0.29 CC(=O)CCC(C)(C)C 1458a_100000757465_200000210301 [0,0,0,0,0,2|2,0,0]=4 600 B8R0.29 CC(=O)COC(C)(C)C 1458a_100000686494_200000210301 [0,0,0,0,0,2|2,0,0]=4 601 B8R0.29 CC(=O)COC(C)(C)C 34a_100000211253_100000210625 [0,0,0,0,0,2|2,0,0]=4 602 B8R0.29 CC(=O)NCC(C)(C)C 11a_100000743828_100015343762 [0,0,0,0,0,2|2,0,0]=4 603 B8R0.29 CC(=O)NCC(C)(C)C 1626a_100000743828_100015343762 [0,0,0,0,0,2|2,0,0]=4 604 B8R0.29 CC(=O)NCC(C)(C)C 240690a_100000743828_100015343762 [0,0,0,0,0,2|2,0,0]=4 605 B8R0.29 CC(=O)NCC(C)(C)C 527a_100000743828_100103153847 [0,0,0,0,0,2|2,0,0]=4 606 B8R0.29 CC(=O)NCC(C)(C)F 11a_100020643315_100015343762 [0,0,0,0,0,2|2,0,0]=4 607 B8R0.29 CC(=O)NCC(C)(C)F 1626a_100020643315_100015343762 [0,0,0,0,0,2|2,0,0]=4 608 B8R0.29 CC(=O)NCC(C)(C)F 240690a_100020643315_100015343762 [0,0,0,0,0,2|2,0,0]=4 609 B8R0.29 CC(=O)NCC(C)(C)F 527a_100020643315_100103153847 [0,0,0,0,0,2|2,0,0]=4 610 B8R0.29 CC(=O)NCC(C)(C)O 1626a_100000751335_100015343762 [0,0,0,0,0,2|2,0,0]=4 611 B8R0.29 CC(=O)NCC(C)(C)O 240690a_100000751335_100015343762 [0,0,0,0,0,2|2,0,0]=4 612 B8R0.29 CC(=O)NCC(C)(C)O 527a_100000751335_100103153847 [0,0,0,0,0,2|2,0,0]=4 613 B8R0.29 CC(=O)NNC(C)(C)C 22a_100000725372_100000070787 [0,0,0,0,0,2|2,0,0]=4 614 B8R0.29 CC(C)(C)C#CC(=O)[13CH3] 1458a_100011966651_200025704644 [0,0,0,0,0,2|2,0,0]=4 615 B8R0.29 CC(C)(C)CCC(=O)[13CH3] 1458a_100000757465_200025704644 [0,0,0,0,0,2|2,0,0]=4 616 B8R0.29 CC(C)(C)NCC(=O)N 2230a_100000715429_100000747473 [0,0,0,0,0,2|2,0,0]=4 617 B8R0.29 CC(C)(C)NCC(=O)O 269956a_100016091260_100000211941 [0,0,0,0,0,2|1,0,0]=3 618 B8R0.29 CC(C)(C)OCC(=O)N 34a_100015890283_100000187820 [0,0,0,0,0,2|2,0,0]=4 619 B8R0.29 CC(C)(C)OCC(=O)N 7a_100015890283_100000187820 [0,0,0,0,0,2|2,0,0]=4 620 B8R0.29 CC(C)(C)OCC(=O)[13CH3] 1458a_100000686494_200025704644 [0,0,0,0,0,2|2,0,0]=4 621 B8R0.29 CC(C)(C)OCC(=O)[O-] 34a_100015890283_100020667443 [0,0,0,0,0,2|1,0,1]=4 622 B8R0.29 CC(C)(C)SCC(=O)N 62a_100000211941_100000747473 [0,0,0,0,0,2|2,0,0]=4 623 B8R0.29 CC(C)(C)SCC(=O)N 62a_100000747473_100000211941 [0,0,0,0,0,2|2,0,0]=4 624 B8R0.29 CC(C)(C)SCC(=O)[O-] 62a_100000211941_100020667443 [0,0,0,0,0,2|1,0,1]=4 625 B8R0.29 CC(C)(C)SCC(=O)[O-] 62a_100020667443_100000211941 [0,0,0,0,0,2|1,0,1]=4