0 B16R0.33065 CCCC[Sn](CCCC)(CCCC)COCC 34a_100121572206_100121571168 [0,0,0,0,0,0|2,0,0]=2 1 B15R0.8187 CCCC[Sn](CCCC)(CCCC)COC 34a_100138415774_100121571168 [1,0,0,0,0,0|2,0,0]=3 2 B15R0.8187 CCCC[Sn](CCCC)(CCCC)CSC 62a_100121571168_200000210301 [1,0,0,0,0,0|2,0,0]=3 3 B15R0.8187 CCCC[Sn](CCCC)(CCCC)CSC 62a_200000210301_100121571168 [1,0,0,0,0,0|2,0,0]=3 4 B15R0.8187 CCCC[Sn](CCCC)(CCCC)CS[13CH3] 62a_100121571168_200025704644 [1,0,0,0,0,0|2,0,0]=3 5 B15R0.8187 CCCC[Sn](CCCC)(CCCC)CS[13CH3] 62a_200025704644_100121571168 [1,0,0,0,0,0|2,0,0]=3 6 B17R0.60397 C#CCOC[Sn](CCCC)(CCCC)CCCC 34a_100000210247_100121571168 [0,1,0,0,0,0|1,0,2]=4 7 B17R0.60397 C#CCSC[Sn](CCCC)(CCCC)CCCC 62a_100000038162_100121571168 [0,1,0,0,0,0|1,0,2]=4 8 B17R0.60397 C=CCNC[Sn](CCCC)(CCCC)CCCC 2230a_100020586998_100121571168 [0,1,0,0,0,0|1,0,2]=4 9 B17R0.60397 C=CCOC[Sn](CCCC)(CCCC)CCCC 34a_200000210373_100121571168 [0,1,0,0,0,0|1,0,2]=4 10 B17R0.60397 CCCC[Sn](CCCC)(CCCC)COCCBr 34a_100000211926_100121571168 [0,1,0,0,0,0|2,0,0]=3 11 B17R0.60397 CCCC[Sn](CCCC)(CCCC)COCCC 34a_100000210258_100121571168 [0,1,0,0,0,0|1,0,0]=2 12 B17R0.60397 CCCC[Sn](CCCC)(CCCC)CSCC#N 62a_100011215382_100121571168 [0,1,0,0,0,0|2,0,1]=4 13 B17R0.60397 CCCC[Sn](CCCC)(CCCC)CSCC#N 62a_100121571168_100011215382 [0,1,0,0,0,0|2,0,1]=4 14 B17R0.60397 CCCC[Sn](CCCC)(CCCC)CSCC=O 62a_100121571168_200015260668 [0,1,0,0,0,0|2,0,1]=4 15 B17R0.60397 CCCC[Sn](CCCC)(CCCC)CSCC=O 62a_200015260668_100121571168 [0,1,0,0,0,0|2,0,1]=4 16 B17R0.60397 CCCC[Sn](CCCC)(CCCC)CSCCO 62a_100000211926_100121571168 [0,1,0,0,0,0|2,0,0]=3 17 B17R0.60397 CCCC[Sn](CCCC)(CCCC)CSCCO 62a_100121571168_100000211926 [0,1,0,0,0,0|2,0,0]=3 18 B17R0.60397 CCCC[Sn](CCCC)(CCCC)CSCOC 62a_100000766300_100121571168 [0,1,0,0,0,0|2,0,0]=3 19 B17R0.60397 CCCC[Sn](CCCC)(CCCC)CSCOC 62a_100121571168_100000766300 [0,1,0,0,0,0|2,0,0]=3 20 B17R0.73334 CCCC[Sn](CCCC)(CCCC)CC(=O)CC 1458a_100000210414_100121571168 [0,1,0,0,0,0|1,0,1]=3 21 B17R0.73334 CCCC[Sn](CCCC)(CCCC)CN(C)CC 2230a_100000225621_100121571168 [0,1,0,0,0,0|2,0,0]=3 22 B17R0.73334 CCCC[Sn](CCCC)(CCCC)CN(C)CC 269982a_100000225621_100121571168 [0,1,0,0,0,0|2,0,0]=3 23 B17R0.73336 CCCC[Sn](CCCC)(CCCC)CNC(C)C 2230a_100138425928_100121571168 [0,1,0,0,0,0|2,0,0]=3 24 B17R0.73336 CCCC[Sn](CCCC)(CCCC)CNC(C)C 34a_100138425928_100121571168 [0,1,0,0,0,0|2,0,0]=3 25 B17R0.73336 CCCC[Sn](CCCC)(CCCC)COC(C)C 34a_100000212225_100121571168 [0,1,0,0,0,0|2,0,0]=3 26 B16R0.22592 CCCC[Sn](CCCC)(CCCC)CC(=O)C 1458a_100000070787_100121571168 [1,1,0,0,0,0|1,0,1]=4 27 B18R0.137578 C#CCCOC[Sn](CCCC)(CCCC)CCCC 34a_100011215631_100121571168 [0,2,0,0,0,0|1,0,1]=4 28 B18R0.137578 C/C=C/COC[Sn](CCCC)(CCCC)CCCC 34a_100016270725_100121571168 [0,2,0,0,0,0|1,0,1]=4 29 B18R0.137578 C=CCCNC[Sn](CCCC)(CCCC)CCCC 2230a_100015191253_100121571168 [0,2,0,0,0,0|1,0,1]=4 30 B18R0.137578 C=CCCOC[Sn](CCCC)(CCCC)CCCC 34a_100011205117_100121571168 [0,2,0,0,0,0|1,0,1]=4 31 B18R0.137578 CC#CCOC[Sn](CCCC)(CCCC)CCCC 34a_100000761923_100121571168 [0,2,0,0,0,0|1,0,1]=4 32 B18R0.137578 CCCCNC[Sn](CCCC)(CCCC)CCCC 2230a_100000102301_100121571168 [0,2,0,0,0,0|1,0,0]=3 33 B18R0.137578 CCCCNC[Sn](CCCC)(CCCC)CCCC 7a_106832991798_100121571168 [0,2,0,0,0,0|1,0,0]=3 34 B18R0.137578 CCCC[Sn](CCCC)(CCCC)CNCCCF 2230a_100015189416_100121571168 [0,2,0,0,0,0|1,0,0]=3 35 B18R0.137578 CCCC[Sn](CCCC)(CCCC)CNCCCF 34a_100015189416_100121571168 [0,2,0,0,0,0|1,0,0]=3 36 B18R0.137578 CCCC[Sn](CCCC)(CCCC)CNCCSC 2230a_100020590264_100121571168 [0,2,0,0,0,0|1,0,0]=3 37 B18R0.137578 CCCC[Sn](CCCC)(CCCC)COCCCF 34a_100000759539_100121571168 [0,2,0,0,0,0|1,0,0]=3 38 B18R0.137578 CCCC[Sn](CCCC)(CCCC)COCCOC 34a_100000210237_100121571168 [0,2,0,0,0,0|1,0,0]=3 39 B18R0.137578 CCCC[Sn](CCCC)(CCCC)COCCSC 34a_100000230434_100121571168 [0,2,0,0,0,0|1,0,0]=3 40 B18R0.137578 CCCC[Sn](CCCC)(CCCC)COCCSC 7a_100000230434_100121571168 [0,2,0,0,0,0|1,0,0]=3 41 B18R0.137578 CCCC[Sn](CCCC)(CCCC)CSCCCO 62a_100011215043_100121571168 [0,2,0,0,0,0|1,0,0]=3 42 B18R0.137578 CCCC[Sn](CCCC)(CCCC)CSCCCO 62a_100121571168_100011215043 [0,2,0,0,0,0|1,0,0]=3 43 B18R0.137578 CCCC[Sn](CCCC)(CCCC)CSCCOC 62a_100000233755_100121571168 [0,2,0,0,0,0|1,0,0]=3 44 B18R0.137578 CCCC[Sn](CCCC)(CCCC)CSCCOC 62a_100121571168_100000233755 [0,2,0,0,0,0|1,0,0]=3 45 B18R0.162021 CCCC[Sn](CCCC)(CCCC)CC(=O)COC 1458a_100000210968_100121571168 [0,2,0,0,0,0|1,0,1]=4 46 B18R0.162021 CCCC[Sn](CCCC)(CCCC)CC(=O)CSC 1458a_100000184570_100121571168 [0,2,0,0,0,0|1,0,1]=4 47 B18R0.162021 CCCC[Sn](CCCC)(CCCC)CN(C)CCC 2230a_100000747261_100121571168 [0,2,0,0,0,0|1,0,0]=3 48 B18R0.162021 CCCC[Sn](CCCC)(CCCC)CN(C)CCC 269982a_100000747261_100121571168 [0,2,0,0,0,0|1,0,0]=3 49 B18R0.221932 C=C(C)COC[Sn](CCCC)(CCCC)CCCC 34a_100000210245_100121571168 [0,2,0,0,0,0|1,0,1]=4 50 B18R0.221932 CCCC[Sn](CCCC)(CCCC)CNCC(C)C 2230a_100000210953_100121571168 [0,2,0,0,0,0|1,0,0]=3 51 B18R0.221932 CCCC[Sn](CCCC)(CCCC)CNCC(C)C 34a_100000210953_100121571168 [0,2,0,0,0,0|1,0,0]=3 52 B18R0.221932 CCCC[Sn](CCCC)(CCCC)CNCC(F)F 34a_100000765723_100121571168 [0,2,0,0,0,0|2,0,0]=4 53 B18R0.221932 CCCC[Sn](CCCC)(CCCC)COCC(C)F 34a_100015925927_100121571168 [0,2,0,0,0,0|1,0,0]=3 54 B18R0.221932 CCCC[Sn](CCCC)(CCCC)COCC(F)F 34a_100000743014_100121571168 [0,2,0,0,0,0|2,0,0]=4 55 B18R0.221932 CCCC[Sn](CCCC)(CCCC)CSCC(C)O 62a_100011218427_100121571168 [0,2,0,0,0,0|1,0,0]=3 56 B18R0.221932 CCCC[Sn](CCCC)(CCCC)CSCC(C)O 62a_100121571168_100011218427 [0,2,0,0,0,0|1,0,0]=3 57 B18R0.221932 CCCC[Sn](CCCC)(CCCC)CSC[C@@H](C)O 62a_100009817552_100121571168 [0,2,0,0,0,0|1,0,0]=3 58 B18R0.221932 CCCC[Sn](CCCC)(CCCC)CSC[C@@H](C)O 62a_100121571168_100009817552 [0,2,0,0,0,0|1,0,0]=3 59 B18R0.221933 C#C[C@@H](C)OC[Sn](CCCC)(CCCC)CCCC 34a_100009815206_100121571168 [0,2,0,0,0,0|2,0,0]=4 60 B18R0.221933 C#C[C@@H](C)OC[Sn](CCCC)(CCCC)CCCC 7a_100009815206_100121571168 [0,2,0,0,0,0|2,0,0]=4 61 B18R0.221933 C=CC(C)OC[Sn](CCCC)(CCCC)CCCC 34a_100000695699_100121571168 [0,2,0,0,0,0|2,0,0]=4 62 B18R0.221933 CCCC[Sn](CCCC)(CCCC)CNC(C)CC 2230a_100000209981_100121571168 [0,2,0,0,0,0|1,0,0]=3 63 B18R0.221933 CCCC[Sn](CCCC)(CCCC)COC(C)C#N 34a_100011218135_100121571168 [0,2,0,0,0,0|2,0,0]=4 64 B18R0.221933 CCCC[Sn](CCCC)(CCCC)COC(C)CF 34a_100016041109_100121571168 [0,2,0,0,0,0|2,0,0]=4 65 B18R0.221933 CCCC[Sn](CCCC)(CCCC)COC(C)CF 7a_100016041109_100121571168 [0,2,0,0,0,0|2,0,0]=4 66 B18R0.221933 CCCC[Sn](CCCC)(CCCC)CSC(C)CO 62a_100012180447_100121571168 [0,2,0,0,0,0|2,0,0]=4 67 B18R0.221933 CCCC[Sn](CCCC)(CCCC)CS[C@H](C)CO 62a_100016084084_100121571168 [0,2,0,0,0,0|2,0,0]=4 68 B18R0.221933 CCCC[Sn](CCCC)(CCCC)CS[C@H](C)CO 62a_100121571168_100016084084 [0,2,0,0,0,0|2,0,0]=4 69 B18R0.162023 CCCC[Sn](CCCC)(CCCC)CN(CC)CC 2230a_100000724800_100121571168 [0,2,0,0,0,0|2,0,0]=4 70 B18R0.162023 CCCC[Sn](CCCC)(CCCC)CN(CC)CC 269956a_100000042499_100121571168 [0,2,0,0,0,0|2,0,0]=4 71 B18R0.162023 CCCC[Sn](CCCC)(CCCC)CN(CC)CC 269982a_100000724800_100121571168 [0,2,0,0,0,0|2,0,0]=4 72 B18R0.162025 CCCC[Sn](CCCC)(CCCC)CC(=O)C(C)F 1458a_100000062450_100121571168 [0,2,0,0,0,0|1,0,1]=4 73 B18R0.162025 CCCC[Sn](CCCC)(CCCC)CN(C)C(C)C 269982a_200000211004_100121571168 [0,2,0,0,0,0|2,0,0]=4 74 B18R0.162022 CCCC[Sn](CCCC)(CCCC)CNC(C)(C)C 2230a_100000715429_100121571168 [0,2,0,0,0,0|2,0,0]=4 75 B18R1.1279215 CCCC[Sn](CCCC)(CCCC)CN1CCC1 269982a_100000754969_100121571168 [0,1,0,1,0,0|1,0,0]=3 76 B18R1.1279216 CCCC[Sn](CCCC)(CCCC)CNC1CC1 34a_100000212008_100121571168 [0,1,0,1,0,0|1,0,0]=3