0 B16R1.23783 CC(C)(C)c1cc(cc(c1O)C(C)(C)C)O 271570a_203496583355_100009814025 [0,0,0,0,0,0|1,0,0]=1 1 B15R1.5452 CC(C)(C)c1cc(cc(c1)C(C)(C)C)O 271570a_203496583355_100009813640 [1,0,0,0,0,0|1,0,0]=2 2 B15R1.5452 C[Si](C)(C)c1cc(cc(c1)[Si](C)(C)C)O 271570a_203496583355_200010368934 [1,0,0,0,0,0|1,2,0]=4 3 B17R1.20408 C=Cc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C 271570a_100011290941_100009814025 [0,1,0,0,0,0|0,0,1]=2 4 B17R1.20408 CC(C)(C)c1cc(cc(c1O)C(C)(C)C)S[13CH3] 62a_100009814025_200025704644 [0,1,0,0,0,0|0,0,0]=1 5 B17R1.20408 CC(C)(C)c1cc(cc(c1O)C(C)(C)C)S[13CH3] 62a_200025704644_100009814025 [0,1,0,0,0,0|0,0,0]=1 6 B17R1.20408 CSc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C 62a_100009814025_200000210301 [0,1,0,0,0,0|0,0,0]=1 7 B17R1.20408 CSc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C 62a_200000210301_100009814025 [0,1,0,0,0,0|0,0,0]=1 8 B17R1.58997 CC(C)(C)c1cc(cc(c1O[13CH3])C(C)(C)C)Br 34a_100009814025_200025704644 [0,1,0,0,0,0|1,0,0]=2 9 B17R1.58997 CC(C)(C)c1cc(cc(c1O[13CH3])C(C)(C)C)Br 7a_100009814025_200025704644 [0,1,0,0,0,0|1,0,0]=2 10 B17R1.58997 COc1c(cc(cc1C(C)(C)C)Br)C(C)(C)C 34a_100009814025_200000210301 [0,1,0,0,0,0|1,0,0]=2 11 B17R1.58997 COc1c(cc(cc1C(C)(C)C)Br)C(C)(C)C 7a_100009814025_200000210301 [0,1,0,0,0,0|1,0,0]=2 12 B17R1.58997 COc1c(cc(cc1C(C)(C)C)C)C(C)(C)C 34a_100015187909_200000210301 [0,1,0,0,0,0|0,0,0]=1 13 B17R1.58997 COc1c(cc(cc1C(C)(C)C)C)C(C)(C)C 7a_100015187909_200000210301 [0,1,0,0,0,0|0,0,0]=1 14 B17R1.58997 COc1c(cc(cc1C(C)(C)C)O)C(C)(C)C 271570a_203496583355_100016990279 [0,1,0,0,0,0|1,0,0]=2 15 B17R1.58997 Cc1cc(c(c(c1)C(C)(C)C)O[13CH3])C(C)(C)C 34a_100015187909_200025704644 [0,1,0,0,0,0|0,0,0]=1 16 B17R1.58997 Cc1cc(c(c(c1)C(C)(C)C)O[13CH3])C(C)(C)C 7a_100015187909_200025704644 [0,1,0,0,0,0|0,0,0]=1 17 B14R1.3145 CC(C)c1cc(cc(c1N)C(C)C)O 271570a_203496583355_100010205856 [2,0,0,0,0,0|2,0,0]=4 18 B14R1.3145 CC(C)c1cc(cc(c1O)C(C)C)O 271570a_203496583355_200010782092 [2,0,0,0,0,0|1,0,0]=3 19 B14R1.4254 C=C(C)c1cc(cc(c1)C(C)(C)C)C 271570a_100000694244_200009817001 [2,0,0,0,0,0|0,0,2]=4 20 B14R1.4939 C=C(C)c1cccc(c1O)C(C)(C)C 271570a_100000694244_100010083445 [2,0,0,0,0,0|0,0,2]=4 21 B16R1.444 C=Cc1cc(cc(c1)C(C)(C)C)C(C)(C)C 271570a_100011290941_100009813640 [1,1,0,0,0,0|0,0,1]=3 22 B16R1.444 CC(C)(C)c1cc(cc(c1)C(C)(C)C)N[13CH3] 2230a_102516457208_200025704644 [1,1,0,0,0,0|0,0,0]=2 23 B16R1.444 CC(C)(C)c1cc(cc(c1)C(C)(C)C)N[13CH3] 34a_102516457208_200025704644 [1,1,0,0,0,0|0,0,0]=2 24 B16R1.444 CC(C)(C)c1cc(cc(c1)C(C)(C)C)N[13CH3] 7a_102516457208_200025704644 [1,1,0,0,0,0|0,0,0]=2 25 B16R1.444 CC(C)(C)c1cc(cc(c1)C(C)(C)C)O[13CH3] 34a_100000211555_200025704644 [1,1,0,0,0,0|0,0,0]=2 26 B16R1.444 CC(C)(C)c1cc(cc(c1)C(C)(C)C)O[13CH3] 7a_100000211555_200025704644 [1,1,0,0,0,0|0,0,0]=2 27 B16R1.444 CC(C)(C)c1cc(cc(c1)C(C)(C)C)S[13CH3] 62a_100009813640_200025704644 [1,1,0,0,0,0|0,0,0]=2 28 B16R1.444 CC(C)(C)c1cc(cc(c1)C(C)(C)C)S[13CH3] 62a_200025704644_100009813640 [1,1,0,0,0,0|0,0,0]=2 29 B16R1.444 CNc1cc(cc(c1)C(C)(C)C)C(C)(C)C 2230a_102516457208_200000210301 [1,1,0,0,0,0|0,0,0]=2 30 B16R1.444 CNc1cc(cc(c1)C(C)(C)C)C(C)(C)C 34a_102516457208_200000210301 [1,1,0,0,0,0|0,0,0]=2 31 B16R1.444 CNc1cc(cc(c1)C(C)(C)C)C(C)(C)C 7a_102516457208_200000210301 [1,1,0,0,0,0|0,0,0]=2 32 B16R1.444 COc1cc(cc(c1)C(C)(C)C)C(C)(C)C 34a_100000211555_200000210301 [1,1,0,0,0,0|0,0,0]=2 33 B16R1.444 COc1cc(cc(c1)C(C)(C)C)C(C)(C)C 7a_100000211555_200000210301 [1,1,0,0,0,0|0,0,0]=2 34 B16R1.444 CSc1cc(cc(c1)C(C)(C)C)C(C)(C)C 62a_100009813640_200000210301 [1,1,0,0,0,0|0,0,0]=2 35 B16R1.444 CSc1cc(cc(c1)C(C)(C)C)C(C)(C)C 62a_200000210301_100009813640 [1,1,0,0,0,0|0,0,0]=2 36 B16R1.444 CSc1cc(cc(c1)[Si](C)(C)C)[Si](C)(C)C 62a_200000210301_200010368934 [1,1,0,0,0,0|0,2,0]=4 37 B16R1.444 CSc1cc(cc(c1)[Si](C)(C)C)[Si](C)(C)C 62a_200010368934_200000210301 [1,1,0,0,0,0|0,2,0]=4 38 B16R1.444 C[Si](C)(C)c1cc(cc(c1)[Si](C)(C)C)S[13CH3] 62a_200010368934_200025704644 [1,1,0,0,0,0|0,2,0]=4 39 B16R1.444 C[Si](C)(C)c1cc(cc(c1)[Si](C)(C)C)S[13CH3] 62a_200025704644_200010368934 [1,1,0,0,0,0|0,2,0]=4 40 B16R1.52976 CC(C)(C)c1cc(c(c(c1)C(C)(C)C)O)O 271570a_203496583355_100000297635 [1,1,0,0,0,0|1,0,0]=3 41 B16R1.5943 CC(C)(C)c1cccc(c1O[13CH3])C(C)(C)C 34a_100000210501_200025704644 [1,1,0,0,0,0|0,0,0]=2 42 B16R1.5943 CC(C)(C)c1cccc(c1O[13CH3])C(C)(C)C 7a_100000210501_200025704644 [1,1,0,0,0,0|0,0,0]=2 43 B16R1.5943 COc1c(cccc1C(C)(C)C)C(C)(C)C 34a_100000210501_200000210301 [1,1,0,0,0,0|0,0,0]=2 44 B16R1.5943 COc1c(cccc1C(C)(C)C)C(C)(C)C 7a_100000210501_200000210301 [1,1,0,0,0,0|0,0,0]=2 45 B18R1.27314 C=Cc1cc(c(c(c1)C(C)(C)C)OC)C(C)(C)C 271570a_100011290941_100016990279 [0,2,0,0,0,0|0,0,1]=3 46 B18R1.27314 C=Cc1cc(c(c(c1)C(C)(C)C)OC)C(C)(C)C 34a_100020644603_200000210301 [0,2,0,0,0,0|0,0,1]=3 47 B18R1.27314 C=Cc1cc(c(c(c1)C(C)(C)C)OC)C(C)(C)C 7a_100020644603_200000210301 [0,2,0,0,0,0|0,0,1]=3 48 B18R1.27314 C=Cc1cc(c(c(c1)C(C)(C)C)O[13CH3])C(C)(C)C 34a_100020644603_200025704644 [0,2,0,0,0,0|0,0,1]=3 49 B18R1.27314 C=Cc1cc(c(c(c1)C(C)(C)C)O[13CH3])C(C)(C)C 7a_100020644603_200025704644 [0,2,0,0,0,0|0,0,1]=3 50 B18R1.27314 CC(C)(C)c1cc(cc(c1O[13CH3])C(C)(C)C)C#N 34a_100000643530_200025704644 [0,2,0,0,0,0|0,0,1]=3 51 B18R1.27314 CC(C)(C)c1cc(cc(c1O[13CH3])C(C)(C)C)C#N 7a_100000643530_200025704644 [0,2,0,0,0,0|0,0,1]=3 52 B18R1.27314 CC(C)(C)c1cc(cc(c1O[13CH3])C(C)(C)C)CBr 34a_100102609838_200025704644 [0,2,0,0,0,0|0,0,0]=2 53 B18R1.27314 CC(C)(C)c1cc(cc(c1O[13CH3])C(C)(C)C)CBr 7a_100102609838_200025704644 [0,2,0,0,0,0|0,0,0]=2 54 B18R1.27314 CC(C)(C)c1cc(cc(c1O[13CH3])C(C)(C)C)CO 34a_100000511239_200025704644 [0,2,0,0,0,0|0,0,0]=2 55 B18R1.27314 CC(C)(C)c1cc(cc(c1O[13CH3])C(C)(C)C)CO 7a_100000511239_200025704644 [0,2,0,0,0,0|0,0,0]=2 56 B18R1.27314 CC(C)(C)c1cc(cc(c1O[13CH3])C(C)(C)C)N=O 34a_200000013307_200025704644 [0,2,0,0,0,0|1,0,0]=3 57 B18R1.27314 CC(C)(C)c1cc(cc(c1O[13CH3])C(C)(C)C)N=O 7a_200000013307_200025704644 [0,2,0,0,0,0|1,0,0]=3 58 B18R1.27314 CCc1cc(c(c(c1)C(C)(C)C)OC)C(C)(C)C 34a_100000068050_200000210301 [0,2,0,0,0,0|0,0,0]=2 59 B18R1.27314 CCc1cc(c(c(c1)C(C)(C)C)OC)C(C)(C)C 7a_100000068050_200000210301 [0,2,0,0,0,0|0,0,0]=2 60 B18R1.27314 CCc1cc(c(c(c1)C(C)(C)C)O[13CH3])C(C)(C)C 34a_100000068050_200025704644 [0,2,0,0,0,0|0,0,0]=2 61 B18R1.27314 CCc1cc(c(c(c1)C(C)(C)C)O[13CH3])C(C)(C)C 7a_100000068050_200025704644 [0,2,0,0,0,0|0,0,0]=2 62 B18R1.27314 COc1c(cc(cc1C(C)(C)C)C#N)C(C)(C)C 34a_100000643530_200000210301 [0,2,0,0,0,0|0,0,1]=3 63 B18R1.27314 COc1c(cc(cc1C(C)(C)C)C#N)C(C)(C)C 7a_100000643530_200000210301 [0,2,0,0,0,0|0,0,1]=3 64 B18R1.27314 COc1c(cc(cc1C(C)(C)C)CBr)C(C)(C)C 34a_100102609838_200000210301 [0,2,0,0,0,0|0,0,0]=2 65 B18R1.27314 COc1c(cc(cc1C(C)(C)C)CBr)C(C)(C)C 7a_100102609838_200000210301 [0,2,0,0,0,0|0,0,0]=2 66 B18R1.27314 COc1c(cc(cc1C(C)(C)C)CO)C(C)(C)C 34a_100000511239_200000210301 [0,2,0,0,0,0|0,0,0]=2 67 B18R1.27314 COc1c(cc(cc1C(C)(C)C)CO)C(C)(C)C 7a_100000511239_200000210301 [0,2,0,0,0,0|0,0,0]=2 68 B18R1.27314 COc1c(cc(cc1C(C)(C)C)N=O)C(C)(C)C 34a_200000013307_200000210301 [0,2,0,0,0,0|1,0,0]=3 69 B18R1.27314 COc1c(cc(cc1C(C)(C)C)N=O)C(C)(C)C 7a_200000013307_200000210301 [0,2,0,0,0,0|1,0,0]=3 70 B18R1.27314 COc1c(cc(cc1C(C)(C)C)SC)C(C)(C)C 62a_100016990279_200000210301 [0,2,0,0,0,0|0,0,0]=2 71 B18R1.27314 COc1c(cc(cc1C(C)(C)C)SC)C(C)(C)C 62a_200000210301_100016990279 [0,2,0,0,0,0|0,0,0]=2 72 B18R1.27314 COc1c(cc(cc1C(C)(C)C)S[13CH3])C(C)(C)C 62a_100016990279_200025704644 [0,2,0,0,0,0|0,0,0]=2 73 B18R1.27314 COc1c(cc(cc1C(C)(C)C)S[13CH3])C(C)(C)C 62a_200025704644_100016990279 [0,2,0,0,0,0|0,0,0]=2 74 B18R1.27314 COc1cc(c(c(c1)C(C)(C)C)OC)C(C)(C)C 34a_100000719896_200000210301 [0,2,0,0,0,0|0,0,0]=2 75 B18R1.27314 COc1cc(c(c(c1)C(C)(C)C)OC)C(C)(C)C 7a_100000719896_200000210301 [0,2,0,0,0,0|0,0,0]=2 76 B18R1.27314 COc1cc(c(c(c1)C(C)(C)C)O[13CH3])C(C)(C)C 34a_100000719896_200025704644 [0,2,0,0,0,0|0,0,0]=2 77 B18R1.27314 COc1cc(c(c(c1)C(C)(C)C)O[13CH3])C(C)(C)C 7a_100000719896_200025704644 [0,2,0,0,0,0|0,0,0]=2 78 B18R1.53578 C=C=Cc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C 271570a_100015277604_100009814025 [0,2,0,0,0,0|0,0,1]=3 79 B18R1.53578 CC(C)(C)c1cc(cc(c1O)C(C)(C)C)CS[13CH3] 62a_100102609838_200025704644 [0,2,0,0,0,0|0,0,0]=2 80 B18R1.53578 CC(C)(C)c1cc(cc(c1O)C(C)(C)C)CS[13CH3] 62a_200025704644_100102609838 [0,2,0,0,0,0|0,0,0]=2 81 B18R1.53578 CC(C)(C)c1cc(cc(c1O)C(C)(C)C)SCF 62a_100009814025_100015361967 [0,2,0,0,0,0|0,0,0]=2 82 B18R1.53578 CC(C)(C)c1cc(cc(c1O)C(C)(C)C)SCF 62a_100015361967_100009814025 [0,2,0,0,0,0|0,0,0]=2 83 B18R1.53578 CC=Cc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C 271570a_100016259895_100009814025 [0,2,0,0,0,0|0,0,0]=2 84 B18R1.53578 CCSc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C 62a_100000210202_100009814025 [0,2,0,0,0,0|0,0,0]=2 85 B18R1.53578 CCSc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C 62a_100009814025_100000210202 [0,2,0,0,0,0|0,0,0]=2 86 B18R1.53578 CNCc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C 207a_100102657272_100000389536 [0,2,0,0,0,0|0,0,0]=2 87 B18R1.53578 CNCc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C 2230a_106832991635_100102609838 [0,2,0,0,0,0|0,0,0]=2 88 B18R1.53578 CNCc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C 34a_100102657272_100102609838 [0,2,0,0,0,0|0,0,0]=2 89 B18R1.53578 CNCc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C 7a_106832991635_100102609838 [0,2,0,0,0,0|0,0,0]=2 90 B18R1.53578 COCc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C 34a_100138415774_100102609838 [0,2,0,0,0,0|0,0,0]=2 91 B18R1.53578 CSCc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C 62a_100102609838_200000210301 [0,2,0,0,0,0|0,0,0]=2 92 B18R1.53578 CSCc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C 62a_200000210301_100102609838 [0,2,0,0,0,0|0,0,0]=2 93 B18R1.126381 C=C(C)c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C 271570a_100000694244_100009814025 [0,2,0,0,0,0|0,0,0]=2 94 B18R1.126381 CC(=O)c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C 1458a_100000489409_200000210301 [0,2,0,0,0,0|0,0,0]=2 95 B18R1.126381 CC(C)(C)c1cc(cc(c1O)C(C)(C)C)C(=O)[13CH3] 1458a_100000489409_200025704644 [0,2,0,0,0,0|0,0,0]=2 96 B18R1.133122 CC(C)(C)c1cc(cc(c1OCF)C(C)(C)C)Br 34a_100009814025_100015361967 [0,2,0,0,0,0|1,0,0]=3 97 B18R1.133122 CC(C)(C)c1cc(cc(c1OCF)C(C)(C)C)Br 7a_100009814025_100015361967 [0,2,0,0,0,0|1,0,0]=3 98 B18R1.133122 CCOc1c(cc(cc1C(C)(C)C)Br)C(C)(C)C 34a_100009814025_100000210202 [0,2,0,0,0,0|1,0,0]=3 99 B18R1.133122 CCOc1c(cc(cc1C(C)(C)C)Br)C(C)(C)C 7a_100009814025_100000210202 [0,2,0,0,0,0|1,0,0]=3 100 B18R1.133122 CCOc1c(cc(cc1C(C)(C)C)C)C(C)(C)C 34a_100015187909_100000210202 [0,2,0,0,0,0|0,0,0]=2 101 B18R1.133122 CCOc1c(cc(cc1C(C)(C)C)C)C(C)(C)C 7a_100015187909_100000210202 [0,2,0,0,0,0|0,0,0]=2 102 B18R1.133122 CNCc1c(cc(cc1C(C)(C)C)Br)C(C)(C)C 26a_100102657272_100009814025 [0,2,0,0,0,0|2,0,0]=4 103 B18R1.133122 CNCc1c(cc(cc1C(C)(C)C)C)C(C)(C)C 26a_100102657272_100015187909 [0,2,0,0,0,0|1,0,0]=3 104 B18R1.133122 CNCc1c(cc(cc1C(C)(C)C)O)C(C)(C)C 207a_100102657272_100102525530 [0,2,0,0,0,0|2,0,0]=4 105 B18R1.133122 CNCc1c(cc(cc1C(C)(C)C)O)C(C)(C)C 270004a_106832991635_100102525530 [0,2,0,0,0,0|2,0,0]=4 106 B18R1.133122 Cc1cc(c(c(c1)C(C)(C)C)OCF)C(C)(C)C 34a_100015187909_100015361967 [0,2,0,0,0,0|0,0,0]=2 107 B18R1.133122 Cc1cc(c(c(c1)C(C)(C)C)OCF)C(C)(C)C 7a_100015187909_100015361967 [0,2,0,0,0,0|0,0,0]=2 108 B16R1.25857 CC(C)(C)C=Cc1cc(ccn1)C(C)(C)C 271570a_100102527731_100009878675 [0,0,1,1,0,0|2,0,0]=4 109 B16R1.25857 CC(C)(C)C=Cc1cccc(c1)C(C)(C)C 271570a_100102527731_100009816526 [0,0,1,1,0,0|1,0,1]=4 110 B16R1.25857 CC(C)(C)C=Cc1cncc(c1)C(C)(C)C 271570a_100102527731_100010191215 [0,0,1,1,0,0|1,0,1]=4 111 B16R1.7481 Cc1ccc(c(c1)C(C)(C)C)OC(C)(C)C 34a_100000211090_100000210625 [0,0,1,1,0,0|2,0,0]=4 112 B16R1.3923 CN(C)Cc1cc(cc(c1O)C(C)(C)C)Br 270004a_100102631434_100009996380 [1,0,0,0,0,1|2,0,0]=4 113 B16R1.23824 CC(=O)c1cc(cc(c1O)SC(C)(C)C)C 62a_100000211941_100011659362 [1,0,0,0,0,1|1,0,1]=4 114 B16R1.23824 CC(C)c1cc(cc(c1N)SC(C)(C)C)F 62a_100000211941_202125602415 [1,0,0,0,0,1|2,0,0]=4 115 B16R1.23824 CC(C)c1cc(cc(c1N)SC(C)(C)C)F 62a_202125602415_100000211941 [1,0,0,0,0,1|2,0,0]=4 116 B16R1.23824 Cc1cc(c(c(n1)SC(C)(C)C)C)C(C)C 62a_100000211941_202495333933 [1,0,0,0,0,1|2,0,0]=4 117 B16R1.23824 Cc1cc(c(c(n1)SC(C)(C)C)C)C(C)C 62a_202495333933_100000211941 [1,0,0,0,0,1|2,0,0]=4 118 B16R1.6854 CC(C)(C)Sc1cc(cc(c1)C(C)(C)C)Br 62a_100000211941_100010131424 [1,0,0,0,0,1|1,0,0]=3 119 B16R1.6854 CC(C)(C)Sc1cc(cc(c1)C(C)(C)C)Br 62a_100010131424_100000211941 [1,0,0,0,0,1|1,0,0]=3 120 B16R1.6854 CC(C)(C)Sc1cc(cc(c1)C(C)(C)C)F 62a_100000211941_100010174802 [1,0,0,0,0,1|1,0,0]=3 121 B16R1.6854 CC(C)(C)Sc1cc(cc(c1)C(C)(C)C)F 62a_100010174802_100000211941 [1,0,0,0,0,1|1,0,0]=3 122 B16R1.6854 Cc1cc(cc(c1)C(C)(C)C)SC(C)(C)C 62a_100000211941_200009817001 [1,0,0,0,0,1|0,0,0]=2 123 B16R1.6854 Cc1cc(cc(c1)C(C)(C)C)SC(C)(C)C 62a_200009817001_100000211941 [1,0,0,0,0,1|0,0,0]=2 124 B16R1.6854 Cc1cc(nc(n1)C(C)(C)C)SC(C)(C)C 62a_100000211941_100000754433 [1,0,0,0,0,1|2,0,0]=4 125 B16R1.6854 Cc1cc(nc(n1)C(C)(C)C)SC(C)(C)C 62a_100000754433_100000211941 [1,0,0,0,0,1|2,0,0]=4 126 B16R1.44082 CC(C)(C)Sc1cccc(c1O)C(C)(C)C 62a_100000211941_100010083445 [1,0,0,0,0,1|0,0,0]=2 127 B16R1.44082 CC(C)(C)Sc1cccc(c1O)C(C)(C)C 62a_100010083445_100000211941 [1,0,0,0,0,1|0,0,0]=2