0 B9R0.56 C=C(Br)CCOC(C)(C)C 34a_100009813270_100000210625 [0,0,0,0,0,0|4,0,0]=4 1 B9R0.56 C=C(C)CCNC(C)(C)C 2230a_100000715429_100000730704 [0,0,0,0,0,0|4,0,0]=4 2 B9R0.56 C=C(C)CCOC(C)(C)C 34a_100000764851_100000210625 [0,0,0,0,0,0|4,0,0]=4 3 B9R0.56 C=C(C)CCOC(C)(C)C 34a_100015890283_100000730704 [0,0,0,0,0,0|4,0,0]=4 4 B9R0.56 C=C(C)CCOC(C)(C)C 7a_100015890283_100000730704 [0,0,0,0,0,0|4,0,0]=4 5 B9R0.56 C=C(C)CCSC(C)(C)C 62a_100000211941_100000730704 [0,0,0,0,0,0|4,0,0]=4 6 B9R0.56 C=C(C)CCSC(C)(C)C 62a_100000730704_100000211941 [0,0,0,0,0,0|4,0,0]=4 7 B9R0.56 C=C(C)CNCC(C)(C)C 2230a_100000743828_100000748629 [0,0,0,0,0,0|4,0,0]=4 8 B9R0.56 C=C(C)COCC(C)(C)C 34a_100000210245_100011219605 [0,0,0,0,0,0|4,0,0]=4 9 B9R0.56 C=C(C)CSCC(C)(C)C 62a_100000748629_100011219605 [0,0,0,0,0,0|4,0,0]=4 10 B9R0.56 C=C(C)CSCC(C)(C)C 62a_100011219605_100000211660 [0,0,0,0,0,0|4,0,0]=4 11 B9R0.56 C=C(C)CSC[N+](C)(C)C 62a_100000748629_200000036245 [0,0,0,0,0,0|3,0,0]=3 12 B9R0.56 C=C(C)CSC[N+](C)(C)C 62a_200000036245_100000211660 [0,0,0,0,0,0|3,0,0]=3 13 B9R0.56 C=C(C)CSC[Si](C)(C)C 62a_100000037933_100000211660 [0,0,0,0,0,0|4,0,0]=4 14 B9R0.56 C=C(C)CSC[Si](C)(C)C 62a_100000748629_100000037933 [0,0,0,0,0,0|4,0,0]=4 15 B9R0.56 C=C(F)CNCC(C)(C)C 2230a_100000743828_100009893438 [0,0,0,0,0,0|4,0,0]=4 16 B9R0.56 C=C(F)COCC(C)(C)C 34a_200010262243_100011219605 [0,0,0,0,0,0|4,0,0]=4 17 B9R0.56 C=C(F)CSCC(C)(C)C 62a_100000042424_100011219605 [0,0,0,0,0,0|4,0,0]=4 18 B9R0.56 C=C(F)CSCC(C)(C)C 62a_100011219605_100000042424 [0,0,0,0,0,0|4,0,0]=4 19 B9R0.56 C=C(F)CSC[N+](C)(C)C 62a_100000042424_200000036245 [0,0,0,0,0,0|3,0,0]=3 20 B9R0.56 C=C(F)CSC[N+](C)(C)C 62a_200000036245_100000042424 [0,0,0,0,0,0|3,0,0]=3 21 B9R0.56 C=C(F)CSC[Si](C)(C)C 62a_100000037933_100000042424 [0,0,0,0,0,0|4,0,0]=4 22 B9R0.56 C=C(F)CSC[Si](C)(C)C 62a_100000042424_100000037933 [0,0,0,0,0,0|4,0,0]=4 23 B9R0.56 CC(=O)CC#C[Si](C)(C)C 1458a_100000070787_100000764098 [0,0,0,0,0,0|2,0,2]=4 24 B9R0.56 CC(=O)CCCS(=O)(=O)C 1458a_100000070787_100000754308 [0,0,0,0,0,0|4,0,0]=4 25 B9R0.56 CC(=O)CCC[N+](C)(C)C 1458a_100000070787_100016990835 [0,0,0,0,0,0|1,0,0]=1 26 B9R0.56 CC(=O)CCC[N+](C)(C)C 1458a_100000085584_200000210301 [0,0,0,0,0,0|1,0,0]=1 27 B9R0.56 CC(=O)CCC[Si](C)(C)C 1458a_100000070787_100011219597 [0,0,0,0,0,0|2,0,0]=2 28 B9R0.56 CC(=O)CCOC(C)(C)C 34a_100000759926_100000210625 [0,0,0,0,0,0|3,0,0]=3 29 B9R0.56 CC(=O)CCOC(C)(C)C 7a_100015890283_100000053229 [0,0,0,0,0,0|3,0,0]=3 30 B9R0.56 CC(=O)CCO[Si](C)(C)C 1458a_100000070787_200000032530 [0,0,0,0,0,0|3,0,0]=3 31 B9R0.56 CC(=O)CCSC(C)(C)C 62a_100000053229_100000211941 [0,0,0,0,0,0|3,0,0]=3 32 B9R0.56 CC(=O)CCSC(C)(C)C 62a_100000211941_100000053229 [0,0,0,0,0,0|3,0,0]=3 33 B9R0.56 CC(=O)COCC(C)(C)C 34a_100000211253_100011219605 [0,0,0,0,0,0|3,0,0]=3 34 B9R0.56 CC(=O)COCC(C)(C)F 34a_100000211253_100011997219 [0,0,0,0,0,0|4,0,0]=4 35 B9R0.56 CC(=O)COCC(C)(C)O 34a_100000211253_100000764493 [0,0,0,0,0,0|4,0,0]=4 36 B9R0.56 CC(=O)NCCC(C)(C)C 11a_100000738805_100015343762 [0,0,0,0,0,0|3,0,0]=3 37 B9R0.56 CC(=O)NCCC(C)(C)C 1626a_100000738805_100015343762 [0,0,0,0,0,0|3,0,0]=3 38 B9R0.56 CC(=O)NCCC(C)(C)C 240690a_100000738805_100015343762 [0,0,0,0,0,0|3,0,0]=3 39 B9R0.56 CC(=O)NCCC(C)(C)C 527a_100000738805_100103153847 [0,0,0,0,0,0|3,0,0]=3 40 B9R0.56 CC(=O)NCCC(C)(C)F 11a_100016253952_100015343762 [0,0,0,0,0,0|4,0,0]=4 41 B9R0.56 CC(=O)NCCC(C)(C)F 1626a_100016253952_100015343762 [0,0,0,0,0,0|4,0,0]=4 42 B9R0.56 CC(=O)NCCC(C)(C)F 240690a_100016253952_100015343762 [0,0,0,0,0,0|4,0,0]=4 43 B9R0.56 CC(=O)NCCC(C)(C)F 527a_100016253952_100103153847 [0,0,0,0,0,0|4,0,0]=4 44 B9R0.56 CC(=O)NCCC(C)(C)O 1626a_100000707701_100015343762 [0,0,0,0,0,0|4,0,0]=4 45 B9R0.56 CC(=O)NCCC(C)(C)O 527a_100000707701_100103153847 [0,0,0,0,0,0|4,0,0]=4 46 B9R0.56 CC(=O)NCC[N+](C)(C)C 1626a_100000106457_100015343762 [0,0,0,0,0,0|2,0,0]=2 47 B9R0.56 CC(=O)NCC[N+](C)(C)C 240690a_100000106457_100015343762 [0,0,0,0,0,0|2,0,0]=2 48 B9R0.56 CC(=O)NCC[N+](C)(C)C 527a_100000106457_100103153847 [0,0,0,0,0,0|2,0,0]=2 49 B9R0.56 CC(=O)OCOC(C)(C)C 34a_100015890283_100009813279 [0,0,0,0,0,0|4,0,0]=4 50 B9R0.56 CC(=O)OCSC(C)(C)C 62a_100000076356_100000211941 [0,0,0,0,0,0|4,0,0]=4 51 B9R0.56 CC(=O)OCSC(C)(C)C 62a_100000211941_100000076356 [0,0,0,0,0,0|4,0,0]=4 52 B9R0.56 CC(C)(C)CNCC(=O)N 2230a_100000743828_100000747473 [0,0,0,0,0,0|3,0,0]=3 53 B9R0.56 CC(C)(C)CNCC(=O)O 269956a_100016091260_100011219605 [0,0,0,0,0,0|2,0,0]=2 54 B9R0.56 CC(C)(C)CSCC(=O)N 62a_100000747473_100011219605 [0,0,0,0,0,0|3,0,0]=3 55 B9R0.56 CC(C)(C)CSCC(=O)N 62a_100011219605_100000747473 [0,0,0,0,0,0|3,0,0]=3 56 B9R0.56 CC(C)(C)CSCC(=O)[O-] 62a_100011219605_100020667443 [0,0,0,0,0,0|2,0,1]=3 57 B9R0.56 CC(C)(C)CSCC(=O)[O-] 62a_100020667443_100011219605 [0,0,0,0,0,0|2,0,1]=3 58 B9R0.56 CC(C)(C)CSC[N+](=O)[O-] 62a_100011219605_100000761209 [0,0,0,0,0,0|3,0,1]=4 59 B9R0.56 CC(C)(C)NCCC(=O)N 2230a_100000715429_100000744528 [0,0,0,0,0,0|3,0,0]=3 60 B9R0.56 CC(C)(C)NOCC(=O)O 269956a_100000106656_100000211941 [0,0,0,0,0,0|3,0,0]=3 61 B9R0.56 CC(C)(C)OCCC(=O)N 34a_100000757172_100000210625 [0,0,0,0,0,0|3,0,0]=3 62 B9R0.56 CC(C)(C)OCCC(=O)N 34a_100015890283_100000731001 [0,0,0,0,0,0|3,0,0]=3 63 B9R0.56 CC(C)(C)OCCC(=O)N 7a_100015890283_100000744528 [0,0,0,0,0,0|3,0,0]=3 64 B9R0.56 CC(C)(C)SCCC(=O)N 62a_100000211941_100000744528 [0,0,0,0,0,0|3,0,0]=3 65 B9R0.56 CC(C)(C)SCCC(=O)N 62a_100000744528_100000211941 [0,0,0,0,0,0|3,0,0]=3 66 B9R0.56 CC(C)(F)CNCC(=O)N 2230a_100020643315_100000747473 [0,0,0,0,0,0|4,0,0]=4 67 B9R0.56 CC(C)(F)CNCC(=O)O 269956a_100016091260_100011997219 [0,0,0,0,0,0|3,0,0]=3 68 B9R0.56 CC(C)(F)COCC(=O)N 34a_100000716592_100000187820 [0,0,0,0,0,0|4,0,0]=4 69 B9R0.56 CC(C)(F)COCC(=O)[O-] 34a_100000716592_100020667443 [0,0,0,0,0,0|3,0,1]=4 70 B9R0.56 CC(C)(F)CSCC(=O)N 62a_100000747473_100011997219 [0,0,0,0,0,0|4,0,0]=4 71 B9R0.56 CC(C)(F)CSCC(=O)N 62a_100011997219_100000747473 [0,0,0,0,0,0|4,0,0]=4 72 B9R0.56 CC(C)(F)CSCC(=O)[O-] 62a_100011997219_100020667443 [0,0,0,0,0,0|3,0,1]=4 73 B9R0.56 CC(C)(F)CSCC(=O)[O-] 62a_100020667443_100011997219 [0,0,0,0,0,0|3,0,1]=4 74 B9R0.56 CC(C)(O)CNCC(=O)N 2230a_100000751335_100000747473 [0,0,0,0,0,0|4,0,0]=4 75 B9R0.56 CC(C)(O)CNCC(=O)O 269956a_100016091260_100000764493 [0,0,0,0,0,0|3,0,0]=3 76 B9R0.56 CC(C)(O)CSCC(=O)N 62a_100000747473_100000764493 [0,0,0,0,0,0|4,0,0]=4 77 B9R0.56 CC(C)(O)CSCC(=O)N 62a_100000764493_100000747473 [0,0,0,0,0,0|4,0,0]=4 78 B9R0.56 CC(C)(O)CSCC(=O)[O-] 62a_100000764493_100020667443 [0,0,0,0,0,0|3,0,1]=4 79 B9R0.56 CC(C)(O)CSCC(=O)[O-] 62a_100020667443_100000764493 [0,0,0,0,0,0|3,0,1]=4 80 B9R0.56 CC(C)CSC[N+](C)(C)C 62a_100000210624_200000036245 [0,0,0,0,0,0|3,0,1]=4 81 B9R0.56 CC(C)CSC[N+](C)(C)C 62a_200000036245_100000210760 [0,0,0,0,0,0|3,0,1]=4 82 B9R0.56 CC(C)NCC[N+](C)(C)C 34a_100138425928_100000085578 [0,0,0,0,0,0|3,0,1]=4 83 B9R0.56 CC(C)OCC[N+](C)(C)C 34a_100000212225_100000085578 [0,0,0,0,0,0|3,0,1]=4 84 B9R0.56 CC(C)OCC[N+](C)(C)C 7a_200020618287_100000210206 [0,0,0,0,0,0|3,0,1]=4 85 B9R0.56 CC(C)SCC[N+](C)(C)C 62a_100000085578_100000210206 [0,0,0,0,0,0|3,0,1]=4 86 B9R0.56 CC(C)SCC[N+](C)(C)C 62a_100000210206_100000085578 [0,0,0,0,0,0|3,0,1]=4 87 B9R0.56 CC(O)CCNC(C)(C)C 2230a_100000715429_100012276601 [0,0,0,0,0,0|3,0,1]=4 88 B9R0.56 CC(O)CCOC(C)(C)C 34a_100015890283_100012276601 [0,0,0,0,0,0|3,0,1]=4 89 B9R0.56 CC(O)CCOC(C)(C)C 7a_100015890283_100012276601 [0,0,0,0,0,0|3,0,1]=4 90 B9R0.56 CC(O)CCSC(C)(C)C 62a_100000211941_100012276601 [0,0,0,0,0,0|3,0,1]=4 91 B9R0.56 CC(O)CCSC(C)(C)C 62a_100012276601_100000211941 [0,0,0,0,0,0|3,0,1]=4 92 B9R0.56 CC(O)CNCC(C)(C)C 2230a_100000743828_100011218427 [0,0,0,0,0,0|3,0,1]=4 93 B9R0.56 CC(O)CNCC(C)(C)C 270004a_100000210904_100011204126 [0,0,0,0,0,0|3,0,1]=4 94 B9R0.56 CC(O)CNCC(C)(C)C 34a_100000210904_100011219605 [0,0,0,0,0,0|3,0,1]=4 95 B9R0.56 CC(O)CNC[Si](C)(C)C 2230a_100000210904_100000037933 [0,0,0,0,0,0|3,0,1]=4 96 B9R0.56 CC(O)CSCC(C)(C)C 62a_100011218427_100011219605 [0,0,0,0,0,0|3,0,1]=4 97 B9R0.56 CC(O)CSCC(C)(C)C 62a_100011219605_100011218427 [0,0,0,0,0,0|3,0,1]=4 98 B9R0.56 CC(O)CSC[N+](C)(C)C 62a_100011218427_200000036245 [0,0,0,0,0,0|2,0,1]=3 99 B9R0.56 CC(O)CSC[N+](C)(C)C 62a_200000036245_100011218427 [0,0,0,0,0,0|2,0,1]=3 100 B9R0.56 CC(O)CSC[Si](C)(C)C 62a_100000037933_100011218427 [0,0,0,0,0,0|3,0,1]=4 101 B9R0.56 CC(O)CSC[Si](C)(C)C 62a_100011218427_100000037933 [0,0,0,0,0,0|3,0,1]=4 102 B9R0.56 CN(C)CCC[N+](C)(C)C 2230a_100102631434_100016990835 [0,0,0,0,0,0|3,0,0]=3 103 B9R0.56 CN(C)CCC[N+](C)(C)C 269982a_100102631434_100016990835 [0,0,0,0,0,0|3,0,0]=3 104 B9R0.56 CN(C)CCC[Si](C)(C)C 2230a_100102631434_100011219597 [0,0,0,0,0,0|4,0,0]=4 105 B9R0.56 CN(C)CCC[Si](C)(C)C 269982a_100102631434_100011219597 [0,0,0,0,0,0|4,0,0]=4 106 B9R0.56 C[C@@H](O)CNCC(C)(C)C 2230a_100000743828_100009817552 [0,0,0,0,0,0|3,0,1]=4 107 B9R0.56 C[C@@H](O)CSCC(C)(C)C 62a_100009817552_100011219605 [0,0,0,0,0,0|3,0,1]=4 108 B9R0.56 C[C@@H](O)CSCC(C)(C)C 62a_100011219605_100009817552 [0,0,0,0,0,0|3,0,1]=4 109 B9R0.56 C[C@@H](O)CSC[N+](C)(C)C 62a_100009817552_200000036245 [0,0,0,0,0,0|2,0,1]=3 110 B9R0.56 C[C@@H](O)CSC[N+](C)(C)C 62a_200000036245_100009817552 [0,0,0,0,0,0|2,0,1]=3 111 B9R0.56 C[C@@H](O)CSC[Si](C)(C)C 62a_100000037933_100009817552 [0,0,0,0,0,0|3,0,1]=4 112 B9R0.56 C[C@@H](O)CSC[Si](C)(C)C 62a_100009817552_100000037933 [0,0,0,0,0,0|3,0,1]=4 113 B9R0.56 C[N+](C)(C)CCCC(=O)[13CH3] 1458a_100000085584_200025704644 [0,0,0,0,0,0|1,0,0]=1 114 B9R0.56 C[N+](C)(C)CNCC(=O)O 269956a_100016091260_200000036245 [0,0,0,0,0,0|1,0,0]=1 115 B9R0.56 C[N+](C)(C)CSCC(=O)N 62a_100000747473_200000036245 [0,0,0,0,0,0|2,0,0]=2 116 B9R0.56 C[N+](C)(C)CSCC(=O)N 62a_200000036245_100000747473 [0,0,0,0,0,0|2,0,0]=2 117 B9R0.56 C[N+](C)(C)CSCC(=O)[O-] 62a_100020667443_200000036245 [0,0,0,0,0,0|1,0,1]=2 118 B9R0.56 C[N+](C)(C)CSCC(=O)[O-] 62a_200000036245_100020667443 [0,0,0,0,0,0|1,0,1]=2 119 B9R0.56 C[N+](C)(C)CSCC(F)F 62a_100011934356_200000036245 [0,0,0,0,0,0|3,0,1]=4 120 B9R0.56 C[N+](C)(C)CSCC(F)F 62a_200000036245_100011934356 [0,0,0,0,0,0|3,0,1]=4 121 B9R0.56 C[N+](C)(C)CSC[N+](=O)[O-] 62a_200000036245_100000761209 [0,0,0,0,0,0|2,0,1]=3 122 B9R0.56 C[Si](C)(C)CNCC(=O)N 2230a_100000711301_100000037933 [0,0,0,0,0,0|3,0,0]=3 123 B9R0.56 C[Si](C)(C)CNCC(=O)O 269956a_100016091260_100000037933 [0,0,0,0,0,0|2,0,0]=2 124 B9R0.56 C[Si](C)(C)CSCC(=O)N 62a_100000037933_100000747473 [0,0,0,0,0,0|3,0,0]=3 125 B9R0.56 C[Si](C)(C)CSCC(=O)N 62a_100000747473_100000037933 [0,0,0,0,0,0|3,0,0]=3 126 B9R0.56 C[Si](C)(C)CSCC(=O)[O-] 62a_100000037933_100020667443 [0,0,0,0,0,0|2,0,1]=3 127 B9R0.56 C[Si](C)(C)CSCC(=O)[O-] 62a_100020667443_100000037933 [0,0,0,0,0,0|2,0,1]=3 128 B9R0.56 C[Si](C)(C)CSC[N+](=O)[O-] 62a_100000037933_100000761209 [0,0,0,0,0,0|3,0,1]=4 129 B8R0.21 C#CCSC[N+](C)(C)C 62a_100000038162_200000036245 [1,0,0,0,0,0|2,0,1]=4 130 B8R0.21 C=CCCNC(C)(C)C 2230a_100000715429_100000754431 [1,0,0,0,0,0|3,0,0]=4 131 B8R0.21 C=CCCOC(C)(C)C 34a_100011205117_100000210625 [1,0,0,0,0,0|3,0,0]=4 132 B8R0.21 C=CCCOC(C)(C)C 34a_100015890283_100000754431 [1,0,0,0,0,0|3,0,0]=4 133 B8R0.21 C=CCCOC(C)(C)C 7a_100015890283_100000754431 [1,0,0,0,0,0|3,0,0]=4 134 B8R0.21 C=CCCSC(C)(C)C 62a_100000211941_100000754431 [1,0,0,0,0,0|3,0,0]=4 135 B8R0.21 C=CCCSC(C)(C)C 62a_100000754431_100000211941 [1,0,0,0,0,0|3,0,0]=4 136 B8R0.21 C=CCNCC(C)(C)C 2230a_100000743828_100000210623 [1,0,0,0,0,0|3,0,0]=4 137 B8R0.21 C=CCNCC(C)(C)C 270004a_100020586998_100011204126 [1,0,0,0,0,0|3,0,0]=4 138 B8R0.21 C=CCNC[Si](C)(C)C 2230a_100020586998_100000037933 [1,0,0,0,0,0|3,0,0]=4 139 B8R0.21 C=CCOCC(C)(C)C 34a_200000210373_100011219605 [1,0,0,0,0,0|3,0,0]=4 140 B8R0.21 C=CCSCC(C)(C)C 62a_100000210623_100011219605 [1,0,0,0,0,0|3,0,0]=4 141 B8R0.21 C=CCSCC(C)(C)C 62a_100011219605_100000210623 [1,0,0,0,0,0|3,0,0]=4 142 B8R0.21 C=CCSC[N+](C)(C)C 62a_100000210623_200000036245 [1,0,0,0,0,0|2,0,0]=3 143 B8R0.21 C=CCSC[N+](C)(C)C 62a_200000036245_100000210623 [1,0,0,0,0,0|2,0,0]=3 144 B8R0.21 C=CCSC[Si](C)(C)C 62a_100000037933_100000210623 [1,0,0,0,0,0|3,0,0]=4 145 B8R0.21 C=CCSC[Si](C)(C)C 62a_100000210623_100000037933 [1,0,0,0,0,0|3,0,0]=4 146 B8R0.21 CC(C)(C)CNCC=O 2230a_100000743828_200015260668 [1,0,0,0,0,0|2,0,0]=3 147 B8R0.21 CC(C)(C)CNCCO 2230a_100000743828_100000211926 [1,0,0,0,0,0|2,0,1]=4 148 B8R0.21 CC(C)(C)CNCCO 270004a_100000210304_100011204126 [1,0,0,0,0,0|2,0,1]=4 149 B8R0.21 CC(C)(C)CNCCO 34a_100016990907_100011219605 [1,0,0,0,0,0|2,0,1]=4 150 B8R0.21 CC(C)(C)CSCC=O 62a_100011219605_200015260668 [1,0,0,0,0,0|2,0,0]=3 151 B8R0.21 CC(C)(C)CSCC=O 62a_200015260668_100011219605 [1,0,0,0,0,0|2,0,0]=3 152 B8R0.21 CC(C)(C)CSCCO 62a_100000211926_100011219605 [1,0,0,0,0,0|2,0,1]=4 153 B8R0.21 CC(C)(C)CSCCO 62a_100011219605_100000211926 [1,0,0,0,0,0|2,0,1]=4 154 B8R0.21 CC(C)(C)NCCCO 2230a_100000715429_100000230001 [1,0,0,0,0,0|2,0,1]=4 155 B8R0.21 CC(C)(C)OCCCO 34a_100015890283_100000230001 [1,0,0,0,0,0|2,0,1]=4 156 B8R0.21 CC(C)(C)OCCCO 7a_100015890283_100011215043 [1,0,0,0,0,0|2,0,1]=4 157 B8R0.21 CC(C)(C)SCCCO 62a_100000211941_100011215043 [1,0,0,0,0,0|2,0,1]=4 158 B8R0.21 CC(C)(C)SCCCO 62a_100011215043_100000211941 [1,0,0,0,0,0|2,0,1]=4 159 B8R0.21 CC(C)(F)CNCC=O 2230a_100020643315_200015260668 [1,0,0,0,0,0|3,0,0]=4 160 B8R0.21 CC(C)(F)COCC=O 34a_100000716592_200009817547 [1,0,0,0,0,0|3,0,0]=4 161 B8R0.21 CC(C)(F)CSCC=O 62a_100011997219_200015260668 [1,0,0,0,0,0|3,0,0]=4 162 B8R0.21 CC(C)(F)CSCC=O 62a_200015260668_100011997219 [1,0,0,0,0,0|3,0,0]=4 163 B8R0.21 CC(C)(O)CNCC=O 2230a_100000751335_200015260668 [1,0,0,0,0,0|3,0,0]=4 164 B8R0.21 CC(C)(O)CSCC=O 62a_100000764493_200015260668 [1,0,0,0,0,0|3,0,0]=4 165 B8R0.21 CC(C)(O)CSCC=O 62a_200015260668_100000764493 [1,0,0,0,0,0|3,0,0]=4 166 B8R0.21 CCCSC[N+](C)(C)C 62a_100000210303_200000036245 [1,0,0,0,0,0|2,0,1]=4 167 B8R0.21 CCCSC[N+](C)(C)C 62a_200000036245_100000210303 [1,0,0,0,0,0|2,0,1]=4 168 B8R0.21 CCOCC[N+](C)(C)C 34a_100121572206_100000085578 [1,0,0,0,0,0|2,0,1]=4 169 B8R0.21 CCOCC[N+](C)(C)C 7a_200020618287_100000210202 [1,0,0,0,0,0|2,0,1]=4 170 B8R0.21 CCSCC[N+](C)(C)C 62a_100000085578_100000210202 [1,0,0,0,0,0|2,0,1]=4 171 B8R0.21 CCSCC[N+](C)(C)C 62a_100000210202_100000085578 [1,0,0,0,0,0|2,0,1]=4 172 B8R0.21 CNCCC[N+](C)(C)C 2230a_106832991635_100016990835 [1,0,0,0,0,0|2,0,0]=3 173 B8R0.21 CNCCC[N+](C)(C)C 34a_100102657272_100016990835 [1,0,0,0,0,0|2,0,0]=3 174 B8R0.21 CNCCC[N+](C)(C)C 7a_106832991635_100016990835 [1,0,0,0,0,0|2,0,0]=3 175 B8R0.21 CNCCC[Si](C)(C)C 2230a_106832991635_100011219597 [1,0,0,0,0,0|3,0,0]=4 176 B8R0.21 CNCCC[Si](C)(C)C 34a_100102657272_100011219597 [1,0,0,0,0,0|3,0,0]=4 177 B8R0.21 CNCCC[Si](C)(C)C 7a_106832991635_100011219597 [1,0,0,0,0,0|3,0,0]=4 178 B8R0.21 COCCC[N+](C)(C)C 34a_100138415774_100016990835 [1,0,0,0,0,0|2,0,0]=3 179 B8R0.21 COCCC[Si](C)(C)C 34a_100138415774_100011219597 [1,0,0,0,0,0|3,0,0]=4 180 B8R0.21 COCCC[Si](C)(C)C 7a_200011215415_200000210301 [1,0,0,0,0,0|3,0,0]=4 181 B8R0.21 COCSC[N+](C)(C)C 62a_100000766300_200000036245 [1,0,0,0,0,0|3,0,0]=4 182 B8R0.21 COCSC[N+](C)(C)C 62a_200000036245_100000766300 [1,0,0,0,0,0|3,0,0]=4 183 B8R0.21 CSCCC[N+](C)(C)C 62a_100016990835_200000210301 [1,0,0,0,0,0|2,0,0]=3 184 B8R0.21 CSCCC[N+](C)(C)C 62a_200000210301_100016990835 [1,0,0,0,0,0|2,0,0]=3 185 B8R0.21 CSCCC[Si](C)(C)C 62a_100011219597_200000210301 [1,0,0,0,0,0|3,0,0]=4 186 B8R0.21 CSCCC[Si](C)(C)C 62a_200000210301_100011219597 [1,0,0,0,0,0|3,0,0]=4 187 B8R0.21 CSCSC[N+](C)(C)C 62a_100011218213_200000036245 [1,0,0,0,0,0|3,0,0]=4 188 B8R0.21 CSCSC[N+](C)(C)C 62a_200000036245_100011218213 [1,0,0,0,0,0|3,0,0]=4 189 B8R0.21 C[N+](C)(C)CCCS[13CH3] 62a_100016990835_200025704644 [1,0,0,0,0,0|2,0,0]=3 190 B8R0.21 C[N+](C)(C)CCCS[13CH3] 62a_200025704644_100016990835 [1,0,0,0,0,0|2,0,0]=3 191 B8R0.21 C[N+](C)(C)CCOCF 7a_200020618287_100015361967 [1,0,0,0,0,0|2,0,1]=4 192 B8R0.21 C[N+](C)(C)CCSCF 62a_100000085578_100015361967 [1,0,0,0,0,0|2,0,1]=4 193 B8R0.21 C[N+](C)(C)CCSCF 62a_100015361967_100000085578 [1,0,0,0,0,0|2,0,1]=4 194 B8R0.21 C[N+](C)(C)CSCC#N 62a_100011215382_200000036245 [1,0,0,0,0,0|2,0,1]=4 195 B8R0.21 C[N+](C)(C)CSCC#N 62a_200000036245_100011215382 [1,0,0,0,0,0|2,0,1]=4 196 B8R0.21 C[N+](C)(C)CSCC=O 62a_200000036245_200015260668 [1,0,0,0,0,0|1,0,0]=2 197 B8R0.21 C[N+](C)(C)CSCC=O 62a_200015260668_200000036245 [1,0,0,0,0,0|1,0,0]=2 198 B8R0.21 C[N+](C)(C)CSCCF 62a_100011217306_200000036245 [1,0,0,0,0,0|2,0,1]=4 199 B8R0.21 C[N+](C)(C)CSCCF 62a_200000036245_100011217306 [1,0,0,0,0,0|2,0,1]=4 200 B8R0.21 C[N+](C)(C)CSCCO 62a_100000211926_200000036245 [1,0,0,0,0,0|1,0,1]=3 201 B8R0.21 C[N+](C)(C)CSCCO 62a_200000036245_100000211926 [1,0,0,0,0,0|1,0,1]=3 202 B8R0.21 C[Si](C)(C)CCCO[13CH3] 7a_200011215415_200025704644 [1,0,0,0,0,0|3,0,0]=4 203 B8R0.21 C[Si](C)(C)CCCS[13CH3] 62a_100011219597_200025704644 [1,0,0,0,0,0|3,0,0]=4 204 B8R0.21 C[Si](C)(C)CCCS[13CH3] 62a_200025704644_100011219597 [1,0,0,0,0,0|3,0,0]=4 205 B8R0.21 C[Si](C)(C)CNCCO 2230a_100016997473_100000037933 [1,0,0,0,0,0|2,0,1]=4 206 B8R0.21 C[Si](C)(C)CSCC=O 62a_100000037933_200015260668 [1,0,0,0,0,0|2,0,0]=3 207 B8R0.21 C[Si](C)(C)CSCC=O 62a_200015260668_100000037933 [1,0,0,0,0,0|2,0,0]=3 208 B8R0.21 C[Si](C)(C)CSCCO 62a_100000037933_100000211926 [1,0,0,0,0,0|2,0,1]=4 209 B8R0.21 C[Si](C)(C)CSCCO 62a_100000211926_100000037933 [1,0,0,0,0,0|2,0,1]=4 210 B8R0.28 C=C(C)CNCC(=O)O 269956a_100016091260_100000748629 [1,0,0,0,0,0|2,0,1]=4 211 B8R0.28 CC(=O)CCC=C(C)C 1458a_100000070787_100011217483 [1,0,0,0,0,0|2,0,1]=4 212 B8R0.28 CC(=O)CCCC(=O)C 1458a_100000070787_100011215641 [1,0,0,0,0,0|3,0,0]=4 213 B8R0.28 CC(=O)CCCC(=O)N 1458a_100000070787_100102525003 [1,0,0,0,0,0|3,0,0]=4 214 B8R0.28 CC(=O)CCCC(C)C 1458a_100000070787_100011214892 [1,0,0,0,0,0|2,0,0]=3 215 B8R0.28 CC(=O)CCCC(C)C 1458a_100011216857_200000210301 [1,0,0,0,0,0|2,0,0]=3 216 B8R0.28 CC(=O)CCCC(C)O 1458a_100000070787_200000718107 [1,0,0,0,0,0|3,0,0]=4 217 B8R0.28 CC(=O)CCCN(C)C 1458a_100000070787_100000695564 [1,0,0,0,0,0|1,0,1]=3 218 B8R0.28 CC(=O)CCCN(C)C 269982a_100102631434_100011215641 [1,0,0,0,0,0|1,0,1]=3 219 B8R0.28 CC(=O)CCOC(C)C 1458a_100000070787_100000211751 [1,0,0,0,0,0|3,0,0]=4 220 B8R0.28 CC(=O)CCOC(C)C 34a_100000759926_100000210206 [1,0,0,0,0,0|3,0,0]=4 221 B8R0.28 CC(=O)CCOC(C)C 7a_100000759926_100000210206 [1,0,0,0,0,0|3,0,0]=4 222 B8R0.28 CC(=O)CCSC(C)C 1458a_100000070787_100000730970 [1,0,0,0,0,0|3,0,0]=4 223 B8R0.28 CC(=O)CCSC(C)C 62a_100000053229_100000210206 [1,0,0,0,0,0|3,0,0]=4 224 B8R0.28 CC(=O)CCSC(C)C 62a_100000210206_100000053229 [1,0,0,0,0,0|3,0,0]=4 225 B8R0.28 CC(=O)COCC(C)C 1458a_100011223364_200000210301 [1,0,0,0,0,0|3,0,0]=4 226 B8R0.28 CC(=O)COCC(C)C 34a_100000211253_100000210624 [1,0,0,0,0,0|3,0,0]=4 227 B8R0.28 CC(=O)NCCC(C)C 11a_100000210545_100015343762 [1,0,0,0,0,0|3,0,0]=4 228 B8R0.28 CC(=O)NCCC(C)C 1626a_100000210545_100015343762 [1,0,0,0,0,0|3,0,0]=4 229 B8R0.28 CC(=O)NCCC(C)C 240690a_100000210545_100015343762 [1,0,0,0,0,0|3,0,0]=4 230 B8R0.28 CC(=O)NCCC(C)C 527a_100000210545_100103153847 [1,0,0,0,0,0|3,0,0]=4 231 B8R0.28 CC(=O)NCCN(C)C 2230a_100102631434_100000189650 [1,0,0,0,0,0|2,0,1]=4 232 B8R0.28 CC(=O)NCCN(C)C 240690a_100000210585_100015343762 [1,0,0,0,0,0|2,0,1]=4 233 B8R0.28 CC(=O)NCCN(C)C 269982a_100102631434_100000189650 [1,0,0,0,0,0|2,0,1]=4 234 B8R0.28 CC(=O)NCCN(C)C 527a_100000210585_100103153847 [1,0,0,0,0,0|2,0,1]=4 235 B8R0.28 CC(=O)OCCN(C)C 269982a_100102631434_100009814007 [1,0,0,0,0,0|2,0,1]=4 236 B8R0.28 CC(C)CCCC(=O)[13CH3] 1458a_100011216857_200025704644 [1,0,0,0,0,0|2,0,0]=3 237 B8R0.28 CC(C)CNCC(=O)N 2230a_100000210953_100000747473 [1,0,0,0,0,0|3,0,0]=4 238 B8R0.28 CC(C)CNCC(=O)N 2230a_100000711301_100000210760 [1,0,0,0,0,0|3,0,0]=4 239 B8R0.28 CC(C)CNCC(=O)N 34a_100000210953_100000187820 [1,0,0,0,0,0|3,0,0]=4 240 B8R0.28 CC(C)CNCC(=O)O 269956a_100016091260_100000210760 [1,0,0,0,0,0|2,0,0]=3 241 B8R0.28 CC(C)CNCC(=O)[O-] 34a_100000210953_100020667443 [1,0,0,0,0,0|2,0,1]=4 242 B8R0.28 CC(C)COCC(=O)N 34a_100000210257_100000187820 [1,0,0,0,0,0|3,0,0]=4 243 B8R0.28 CC(C)COCC(=O)[13CH3] 1458a_100011223364_200025704644 [1,0,0,0,0,0|3,0,0]=4 244 B8R0.28 CC(C)COCC(=O)[O-] 34a_100000210257_100020667443 [1,0,0,0,0,0|2,0,1]=4 245 B8R0.28 CC(C)CSCC(=O)N 62a_100000210624_100000747473 [1,0,0,0,0,0|3,0,0]=4 246 B8R0.28 CC(C)CSCC(=O)N 62a_100000747473_100000210760 [1,0,0,0,0,0|3,0,0]=4 247 B8R0.28 CC(C)CSCC(=O)[O-] 62a_100000210624_100020667443 [1,0,0,0,0,0|2,0,1]=4 248 B8R0.28 CC(C)CSCC(=O)[O-] 62a_100020667443_100000210760 [1,0,0,0,0,0|2,0,1]=4 249 B8R0.28 CC(C)NCCC(=O)N 2230a_100138425928_100000744528 [1,0,0,0,0,0|3,0,0]=4 250 B8R0.28 CC(C)NCCC(=O)N 34a_100138425928_100000731001 [1,0,0,0,0,0|3,0,0]=4 251 B8R0.28 CC(C)NOCC(=O)O 269956a_100000106656_100000210206 [1,0,0,0,0,0|3,0,0]=4 252 B8R0.28 CC(C)OCCC(=O)N 34a_100000212225_100000731001 [1,0,0,0,0,0|3,0,0]=4 253 B8R0.28 CC(C)OCCC(=O)N 34a_100000757172_100000210206 [1,0,0,0,0,0|3,0,0]=4 254 B8R0.28 CC(C)OCCC(=O)N 7a_100000757172_100000210206 [1,0,0,0,0,0|3,0,0]=4 255 B8R0.28 CC(C)SCCC(=O)N 62a_100000210206_100000744528 [1,0,0,0,0,0|3,0,0]=4 256 B8R0.28 CC(C)SCCC(=O)N 62a_100000744528_100000210206 [1,0,0,0,0,0|3,0,0]=4 257 B8R0.28 CC(O)CCCN(C)C 2230a_100102631434_200000718107 [1,0,0,0,0,0|1,0,2]=4 258 B8R0.28 CC(O)CCCN(C)C 269982a_100102631434_200000718107 [1,0,0,0,0,0|1,0,2]=4 259 B8R0.28 CC(O)CNCC(=O)O 269956a_100016091260_100011218427 [1,0,0,0,0,0|3,0,0]=4 260 B8R0.28 CN(C)CCCC(=O)N 269982a_100102631434_100102525003 [1,0,0,0,0,0|1,0,1]=3 261 B8R0.28 CN(C)CCCC(=O)O 269956a_100000719178_200000210301 [1,0,0,0,0,0|0,0,1]=2 262 B8R0.28 CN(C)CCNC(=O)N 2230a_100102631434_200000034859 [1,0,0,0,0,0|2,0,1]=4 263 B8R0.28 CN(C)CCNC(=O)N 269982a_100102631434_200000034859 [1,0,0,0,0,0|2,0,1]=4 264 B8R0.28 CN(C)CCOC(=O)N 269982a_100102631434_200011214921 [1,0,0,0,0,0|2,0,1]=4 265 B8R0.28 CN([13CH3])CCCC(=O)O 269956a_100000719178_200025704644 [1,0,0,0,0,0|0,0,1]=2 266 B8R0.28 C[C@@H](O)CNCC(=O)O 269956a_100016091260_100009817552 [1,0,0,0,0,0|3,0,0]=4 267 B10R0.12 CC(=O)CCN(C)C(C)(C)C 269982a_100011215553_100000053229 [0,1,0,0,0,0|3,0,0]=4 268 B10R0.12 CN(CCC(=O)N)C(C)(C)C 269982a_100011215553_100000744528 [0,1,0,0,0,0|3,0,0]=4 269 B10R0.12 C[C@@H](NCC(=O)N)C(C)(C)C 2230a_100025703359_100000747473 [0,1,0,0,0,0|3,0,0]=4 270 B10R0.31 C=C(C)CC(=O)C[N+](C)(C)C 1458a_100000033712_100000748629 [0,1,0,0,0,0|2,0,1]=4 271 B10R0.31 C=C(C)CN(C)C[N+](C)(C)C 269982a_100000225649_200000036245 [0,1,0,0,0,0|3,0,0]=4 272 B10R0.31 C=C(F)CC(=O)C[N+](C)(C)C 1458a_100000033712_100009893438 [0,1,0,0,0,0|2,0,1]=4 273 B10R0.31 CC(=O)CC(C)CC(C)(C)C 1458a_100000239893_200000210301 [0,1,0,0,0,0|2,0,0]=3 274 B10R0.31 CC(=O)CC(O)C[N+](C)(C)C 1458a_100000070787_100000032816 [0,1,0,0,0,0|1,0,0]=2 275 B10R0.31 CC(=O)C[C@@H](O)C[N+](C)(C)C 1458a_100000004043_200000210301 [0,1,0,0,0,0|1,0,0]=2 276 B10R0.31 CC(=O)N[C@@H](C)CC(C)(C)C 11a_106358413534_100015343762 [0,1,0,0,0,0|3,0,0]=4 277 B10R0.31 CC(=O)N[C@@H](C)CC(C)(C)C 1626a_106358413534_100015343762 [0,1,0,0,0,0|3,0,0]=4 278 B10R0.31 CC(=O)N[C@@H](C)CC(C)(C)C 240690a_106358413534_100015343762 [0,1,0,0,0,0|3,0,0]=4 279 B10R0.31 CC(=O)N[C@@H](C)CC(C)(C)C 527a_106358413534_100103153847 [0,1,0,0,0,0|3,0,0]=4 280 B10R0.31 CC(C)(C)CC(=O)CC(=O)N 1458a_100000211214_100000187820 [0,1,0,0,0,0|2,0,1]=4 281 B10R0.31 CC(C)(C)CC(=O)CC(=O)[O-] 1458a_100000211214_100020667443 [0,1,0,0,0,0|1,0,2]=4 282 B10R0.31 CC(CC(=O)[13CH3])CC(C)(C)C 1458a_100000239893_200025704644 [0,1,0,0,0,0|2,0,0]=3 283 B10R0.31 CC(O)CC(=O)C[N+](C)(C)C 1458a_100000033712_100011218427 [0,1,0,0,0,0|1,0,2]=4 284 B10R0.31 CC(O)CN(C)C[N+](C)(C)C 269982a_100000227577_200000036245 [0,1,0,0,0,0|2,0,1]=4 285 B10R0.31 CN(C)CC(O)C[N+](C)(C)C 2230a_100102631434_100000032816 [0,1,0,0,0,0|3,0,0]=4 286 B10R0.31 CN(C)CC(O)C[N+](C)(C)C 269982a_100102631434_100000032816 [0,1,0,0,0,0|3,0,0]=4 287 B10R0.31 CN(CC(=O)N)CC(C)(C)C 2230a_100000742839_100000747473 [0,1,0,0,0,0|3,0,0]=4 288 B10R0.31 CN(CC(=O)N)CC(C)(C)C 269982a_100000742839_100000187820 [0,1,0,0,0,0|3,0,0]=4 289 B10R0.31 CN(CC(=O)N)CC(C)(C)C 270004a_100000739694_100011204126 [0,1,0,0,0,0|3,0,0]=4 290 B10R0.31 CN(CC(=O)N)C[Si](C)(C)C 2230a_100000739694_100000037933 [0,1,0,0,0,0|3,0,0]=4 291 B10R0.31 CN(CC(=O)N)C[Si](C)(C)C 269982a_200020589227_100000187820 [0,1,0,0,0,0|3,0,0]=4 292 B10R0.31 CN(CC(=O)O)CC(C)(C)C 269956a_100000746989_100011219605 [0,1,0,0,0,0|2,0,0]=3 293 B10R0.31 CN(CC(=O)O)CC(C)(C)F 269956a_100000746989_100011997219 [0,1,0,0,0,0|3,0,0]=4 294 B10R0.31 CN(CC(=O)O)CC(C)(C)O 269956a_100000746989_100000764493 [0,1,0,0,0,0|3,0,0]=4 295 B10R0.31 CN(CC(=O)O)C[N+](C)(C)C 269956a_100000746989_200000036245 [0,1,0,0,0,0|1,0,0]=2 296 B10R0.31 CN(CC(=O)O)C[Si](C)(C)C 269956a_100000746989_100000037933 [0,1,0,0,0,0|2,0,0]=3 297 B10R0.31 CN(CC(=O)[O-])CC(C)(C)C 269982a_100000742839_100020667443 [0,1,0,0,0,0|2,0,1]=4 298 B10R0.31 CN(CC(=O)[O-])C[Si](C)(C)C 269982a_200020589227_100020667443 [0,1,0,0,0,0|2,0,1]=4 299 B10R0.31 C[N+](C)(C)CC(=O)CC(=O)N 1458a_100000033712_100000187820 [0,1,0,0,0,0|1,0,1]=3 300 B10R0.31 C[N+](C)(C)CC(=O)CC(=O)[O-] 1458a_100000033712_100020667443 [0,1,0,0,0,0|0,0,2]=3 301 B10R0.31 C[N+](C)(C)CC(=O)C[N+](=O)[O-] 1458a_100000033712_100000761209 [0,1,0,0,0,0|1,0,2]=4 302 B10R0.31 C[N+](C)(C)C[C@H](O)CC(=O)[13CH3] 1458a_100000004043_200025704644 [0,1,0,0,0,0|1,0,0]=2 303 B10R0.31 C[Si](C)(C)CC(=O)CC(=O)N 1458a_100011218504_100000187820 [0,1,0,0,0,0|2,0,1]=4 304 B10R0.31 C[Si](C)(C)CC(=O)CC(=O)N 1458a_100134613110_100000233785 [0,1,0,0,0,0|2,0,1]=4 305 B10R0.31 C[Si](C)(C)CC(=O)CC(=O)[O-] 1458a_100011218504_100020667443 [0,1,0,0,0,0|1,0,2]=4 306 B10R0.60 C#CC(=O)CCC[N+](C)(C)C 1458a_100000211873_100016990835 [0,1,0,0,0,0|1,0,0]=2 307 B10R0.60 C#CC(=O)CCC[Si](C)(C)C 1458a_100000211873_100011219597 [0,1,0,0,0,0|2,0,0]=3 308 B10R0.60 C#CC(=O)CCO[Si](C)(C)C 1458a_100000211873_200000032530 [0,1,0,0,0,0|3,0,0]=4 309 B10R0.60 C=C(C#N)CSC[N+](C)(C)C 62a_200000036245_100000694840 [0,1,0,0,0,0|3,0,0]=4 310 B10R0.60 C=CC(=O)CCC[N+](C)(C)C 1458a_100000185746_100016990835 [0,1,0,0,0,0|1,0,0]=2 311 B10R0.60 C=CC(=O)CCC[Si](C)(C)C 1458a_100000185746_100011219597 [0,1,0,0,0,0|2,0,0]=3 312 B10R0.60 C=CC(=O)CCO[Si](C)(C)C 1458a_100000185746_200000032530 [0,1,0,0,0,0|3,0,0]=4 313 B10R0.60 C=CC(=O)NCCC(C)(C)C 1626a_100000738805_100000185746 [0,1,0,0,0,0|3,0,0]=4 314 B10R0.60 C=CC(=O)NCCC(C)(C)C 240690a_100000738805_200121576911 [0,1,0,0,0,0|3,0,0]=4 315 B10R0.60 C=CC(=O)NCC[N+](C)(C)C 1626a_100000106457_100000185746 [0,1,0,0,0,0|2,0,0]=3 316 B10R0.60 C=CC(=O)NCC[N+](C)(C)C 240690a_100000106457_200121576911 [0,1,0,0,0,0|2,0,0]=3 317 B10R0.60 C=CC(O)CSC[N+](C)(C)C 62a_100000730141_200000036245 [0,1,0,0,0,0|2,0,1]=4 318 B10R0.60 C=CC(O)CSC[N+](C)(C)C 62a_200000036245_100000730141 [0,1,0,0,0,0|2,0,1]=4 319 B10R0.60 CC(C)(C)CCNC(=O)CO 240690a_100000738805_100000210174 [0,1,0,0,0,0|2,0,0]=3 320 B10R0.60 CC(C)(C)CCNC(=O)CO 527a_100000738805_100000210174 [0,1,0,0,0,0|2,0,0]=3 321 B10R0.60 CC(C)(C)OCCC(=NO)N 34a_100000749954_100000210625 [0,1,0,0,0,0|3,0,0]=4 322 B10R0.60 CC(C)(F)CCNC(=O)CO 240690a_100016253952_100000210174 [0,1,0,0,0,0|3,0,0]=4 323 B10R0.60 CC(C)(F)CCNC(=O)CO 527a_100016253952_100000210174 [0,1,0,0,0,0|3,0,0]=4 324 B10R0.60 CC(C)(O)CCNC(=O)CO 527a_100000707701_100000210174 [0,1,0,0,0,0|3,0,0]=4 325 B10R0.60 CC(CO)OCC[N+](C)(C)C 7a_200020618287_100012180447 [0,1,0,0,0,0|2,0,1]=4 326 B10R0.60 CC(CO)SCC[N+](C)(C)C 62a_100012180447_100000085578 [0,1,0,0,0,0|2,0,1]=4 327 B10R0.60 CCC(=O)CCC[N+](C)(C)C 1458a_100000085584_100000210202 [0,1,0,0,0,0|1,0,0]=2 328 B10R0.60 CCC(=O)CCC[N+](C)(C)C 1458a_100000210414_100016990835 [0,1,0,0,0,0|1,0,0]=2 329 B10R0.60 CCC(=O)CCC[Si](C)(C)C 1458a_100000210414_100011219597 [0,1,0,0,0,0|2,0,0]=3 330 B10R0.60 CCC(=O)CCO[Si](C)(C)C 1458a_100000210414_200000032530 [0,1,0,0,0,0|3,0,0]=4 331 B10R0.60 CCC(=O)COCC(C)(C)C 34a_100000725409_100011219605 [0,1,0,0,0,0|3,0,0]=4 332 B10R0.60 CCC(=O)CSCC(C)(C)C 62a_100000747405_100011219605 [0,1,0,0,0,0|3,0,0]=4 333 B10R0.60 CCC(=O)CSCC(C)(C)C 62a_100011219605_100000747405 [0,1,0,0,0,0|3,0,0]=4 334 B10R0.60 CCC(=O)CSC[N+](C)(C)C 62a_100000747405_200000036245 [0,1,0,0,0,0|2,0,0]=3 335 B10R0.60 CCC(=O)CSC[N+](C)(C)C 62a_200000036245_100000747405 [0,1,0,0,0,0|2,0,0]=3 336 B10R0.60 CCC(=O)CSC[Si](C)(C)C 62a_100000037933_100000747405 [0,1,0,0,0,0|3,0,0]=4 337 B10R0.60 CCC(=O)CSC[Si](C)(C)C 62a_100000747405_100000037933 [0,1,0,0,0,0|3,0,0]=4 338 B10R0.60 CCC(=O)NCCC(C)(C)C 11a_100000738805_100000210414 [0,1,0,0,0,0|3,0,0]=4 339 B10R0.60 CCC(=O)NCCC(C)(C)C 1626a_100000738805_100000210414 [0,1,0,0,0,0|3,0,0]=4 340 B10R0.60 CCC(=O)NCCC(C)(C)C 240690a_100000738805_100000210414 [0,1,0,0,0,0|3,0,0]=4 341 B10R0.60 CCC(=O)NCCC(C)(C)C 527a_100000738805_100000210414 [0,1,0,0,0,0|3,0,0]=4 342 B10R0.60 CCC(=O)NCC[N+](C)(C)C 1626a_100000106457_100000210414 [0,1,0,0,0,0|2,0,0]=3 343 B10R0.60 CCC(=O)NCC[N+](C)(C)C 240690a_100000106457_100000210414 [0,1,0,0,0,0|2,0,0]=3 344 B10R0.60 CCC(=O)NCC[N+](C)(C)C 527a_100000106457_100000210414 [0,1,0,0,0,0|2,0,0]=3 345 B10R0.60 CCC(O)CSC[N+](C)(C)C 62a_100011218378_200000036245 [0,1,0,0,0,0|2,0,1]=4 346 B10R0.60 CCC(O)CSC[N+](C)(C)C 62a_200000036245_100011218378 [0,1,0,0,0,0|2,0,1]=4 347 B10R0.60 CCN(C)CCC[N+](C)(C)C 2230a_100000225621_100016990835 [0,1,0,0,0,0|3,0,0]=4 348 B10R0.60 CCN(C)CCC[N+](C)(C)C 269982a_100000225621_100016990835 [0,1,0,0,0,0|3,0,0]=4 349 B10R0.60 CNC(=O)CCC[N+](C)(C)C 11a_106832991635_100000085584 [0,1,0,0,0,0|1,0,0]=2 350 B10R0.60 CNC(=O)CCC[N+](C)(C)C 1626a_100102657272_100000085584 [0,1,0,0,0,0|1,0,0]=2 351 B10R0.60 CNC(=O)CCC[N+](C)(C)C 240690a_100102657272_100000085584 [0,1,0,0,0,0|1,0,0]=2 352 B10R0.60 CNC(=O)CCC[N+](C)(C)C 527a_100102657272_100000085584 [0,1,0,0,0,0|1,0,0]=2 353 B10R0.60 CNC(=O)CCNC(C)(C)C 2230a_100000715429_100000737683 [0,1,0,0,0,0|3,0,0]=4 354 B10R0.60 CNC(=O)CCNC(C)(C)C 34a_100000738227_100000210625 [0,1,0,0,0,0|3,0,0]=4 355 B10R0.60 CNC(=O)CCOC(C)(C)C 34a_100000754576_100000210625 [0,1,0,0,0,0|3,0,0]=4 356 B10R0.60 CNC(=O)CCOC(C)(C)C 34a_100015890283_100012179268 [0,1,0,0,0,0|3,0,0]=4 357 B10R0.60 CNC(=O)CCOC(C)(C)C 7a_100015890283_100000737683 [0,1,0,0,0,0|3,0,0]=4 358 B10R0.60 CNC(=O)CCSC(C)(C)C 62a_100000211941_100000737683 [0,1,0,0,0,0|3,0,0]=4 359 B10R0.60 CNC(=O)CCSC(C)(C)C 62a_100000737683_100000211941 [0,1,0,0,0,0|3,0,0]=4 360 B10R0.60 CNC(=O)CNCC(C)(C)C 2230a_100000743828_100000183359 [0,1,0,0,0,0|3,0,0]=4 361 B10R0.60 CNC(=O)CNCC(C)(C)C 270004a_100000693194_100011204126 [0,1,0,0,0,0|3,0,0]=4 362 B10R0.60 CNC(=O)CNC[Si](C)(C)C 2230a_100000693194_100000037933 [0,1,0,0,0,0|3,0,0]=4 363 B10R0.60 CNC(=O)COCC(C)(C)C 34a_100000750040_100011219605 [0,1,0,0,0,0|3,0,0]=4 364 B10R0.60 CNC(=O)CSCC(C)(C)C 62a_100000183359_100011219605 [0,1,0,0,0,0|3,0,0]=4 365 B10R0.60 CNC(=O)CSCC(C)(C)C 62a_100011219605_100000183359 [0,1,0,0,0,0|3,0,0]=4 366 B10R0.60 CNC(=O)CSC[N+](C)(C)C 62a_100000183359_200000036245 [0,1,0,0,0,0|2,0,0]=3 367 B10R0.60 CNC(=O)CSC[N+](C)(C)C 62a_200000036245_100000183359 [0,1,0,0,0,0|2,0,0]=3 368 B10R0.60 CNC(=O)CSC[Si](C)(C)C 62a_100000037933_100000183359 [0,1,0,0,0,0|3,0,0]=4 369 B10R0.60 CNC(=O)CSC[Si](C)(C)C 62a_100000183359_100000037933 [0,1,0,0,0,0|3,0,0]=4 370 B10R0.60 CNC(=O)NCCC(C)(C)C 2708a_100000738805_106832991635 [0,1,0,0,0,0|3,0,0]=4 371 B10R0.60 CNC(=O)NCCC(C)(C)C 2708a_100102657272_100000738805 [0,1,0,0,0,0|3,0,0]=4 372 B10R0.60 CNC(=O)NCCC(C)(C)C 273464a_100000738805_100102657272 [0,1,0,0,0,0|3,0,0]=4 373 B10R0.60 CNC(=O)NCCC(C)(C)C 273464a_100102657272_100000738805 [0,1,0,0,0,0|3,0,0]=4 374 B10R0.60 CNC(=O)NCCC(C)(C)C 512a_100000738805_100102657272 [0,1,0,0,0,0|3,0,0]=4 375 B10R0.60 CNC(=O)NCCC(C)(C)C 512a_106832991638_100000738805 [0,1,0,0,0,0|3,0,0]=4 376 B10R0.60 CNC(=O)NCC[N+](C)(C)C 2708a_100102657272_100000106457 [0,1,0,0,0,0|2,0,0]=3 377 B10R0.60 CNC(=O)NCC[N+](C)(C)C 273464a_100000106457_100102657272 [0,1,0,0,0,0|2,0,0]=3 378 B10R0.60 CNC(=O)NCC[N+](C)(C)C 273464a_100102657272_100000106457 [0,1,0,0,0,0|2,0,0]=3 379 B10R0.60 CNC(=O)NCC[N+](C)(C)C 512a_100000106457_100102657272 [0,1,0,0,0,0|2,0,0]=3 380 B10R0.60 CNC(=O)NCC[N+](C)(C)C 512a_106832991638_100000106457 [0,1,0,0,0,0|2,0,0]=3 381 B10R0.60 COC(=O)CCNC(C)(C)C 2230a_100000715429_100000204255 [0,1,0,0,0,0|2,0,0]=3 382 B10R0.60 COC(=O)CCOC(C)(C)C 34a_100015890283_100000742370 [0,1,0,0,0,0|2,0,0]=3 383 B10R0.60 COC(=O)CCOC(C)(C)C 7a_100015890283_100000204255 [0,1,0,0,0,0|2,0,0]=3 384 B10R0.60 COC(=O)CCSC(C)(C)C 62a_100000204255_100000211941 [0,1,0,0,0,0|2,0,0]=3 385 B10R0.60 COC(=O)CCSC(C)(C)C 62a_100000211941_100000204255 [0,1,0,0,0,0|2,0,0]=3 386 B10R0.60 COC(=O)CNCC(C)(C)C 2230a_100000743828_100000747449 [0,1,0,0,0,0|2,0,0]=3 387 B10R0.60 COC(=O)CNCC(C)(C)F 2230a_100020643315_100000747449 [0,1,0,0,0,0|3,0,0]=4 388 B10R0.60 COC(=O)CNCC(C)(C)O 2230a_100000751335_100000747449 [0,1,0,0,0,0|3,0,0]=4 389 B10R0.60 COC(=O)COCC(C)(C)F 34a_100000716592_100000747449 [0,1,0,0,0,0|3,0,0]=4 390 B10R0.60 COC(=O)CSCC(C)(C)C 62a_100000747449_100011219605 [0,1,0,0,0,0|2,0,0]=3 391 B10R0.60 COC(=O)CSCC(C)(C)C 62a_100011219605_100000747449 [0,1,0,0,0,0|2,0,0]=3 392 B10R0.60 COC(=O)CSCC(C)(C)F 62a_100000747449_100011997219 [0,1,0,0,0,0|3,0,0]=4 393 B10R0.60 COC(=O)CSCC(C)(C)F 62a_100011997219_100000747449 [0,1,0,0,0,0|3,0,0]=4 394 B10R0.60 COC(=O)CSCC(C)(C)O 62a_100000747449_100000764493 [0,1,0,0,0,0|3,0,0]=4 395 B10R0.60 COC(=O)CSCC(C)(C)O 62a_100000764493_100000747449 [0,1,0,0,0,0|3,0,0]=4 396 B10R0.60 COC(=O)CSC[N+](C)(C)C 62a_100000747449_200000036245 [0,1,0,0,0,0|1,0,0]=2 397 B10R0.60 COC(=O)CSC[N+](C)(C)C 62a_200000036245_100000747449 [0,1,0,0,0,0|1,0,0]=2 398 B10R0.60 COC(=O)CSC[Si](C)(C)C 62a_100000037933_100000747449 [0,1,0,0,0,0|2,0,0]=3 399 B10R0.60 COC(=O)CSC[Si](C)(C)C 62a_100000747449_100000037933 [0,1,0,0,0,0|2,0,0]=3 400 B10R0.60 COC(=O)OCSC(C)(C)C 62a_100000211941_100000139417 [0,1,0,0,0,0|3,0,0]=4 401 B10R0.60 COC(C)SCC[N+](C)(C)C 62a_100000085578_100009879195 [0,1,0,0,0,0|2,0,1]=4 402 B10R0.60 COC(C)SCC[N+](C)(C)C 62a_100009879195_100000085578 [0,1,0,0,0,0|2,0,1]=4 403 B10R0.60 CS(=O)(=O)CCCC(=O)CO 1458a_100000210174_100000754308 [0,1,0,0,0,0|3,0,0]=4 404 B10R0.60 C[C@@H](CO)CSC[N+](C)(C)C 62a_100000059175_200000036245 [0,1,0,0,0,0|2,0,1]=4 405 B10R0.60 C[C@@H](CO)CSC[N+](C)(C)C 62a_200000036245_100000059175 [0,1,0,0,0,0|2,0,1]=4 406 B10R0.60 C[C@H](CO)SCC[N+](C)(C)C 62a_100000085578_100016084084 [0,1,0,0,0,0|2,0,1]=4 407 B10R0.60 C[C@H](CO)SCC[N+](C)(C)C 62a_100016084084_100000085578 [0,1,0,0,0,0|2,0,1]=4 408 B10R0.60 C[N+](C)(C)CCCC(=O)CF 1458a_100000085584_100015361967 [0,1,0,0,0,0|1,0,0]=2 409 B10R0.60 C[N+](C)(C)CCCC(=O)CO 1458a_100000210174_100016990835 [0,1,0,0,0,0|0,0,0]=1 410 B10R0.60 C[N+](C)(C)CCNC(=O)CO 240690a_100000106457_100000210174 [0,1,0,0,0,0|1,0,0]=2 411 B10R0.60 C[N+](C)(C)CCNC(=O)CO 527a_100000106457_100000210174 [0,1,0,0,0,0|1,0,0]=2 412 B10R0.60 C[N+](C)(C)CSCC(O)CO 62a_100011219619_200000036245 [0,1,0,0,0,0|1,0,2]=4 413 B10R0.60 C[N+](C)(C)CSCC(O)CO 62a_200000036245_100011219619 [0,1,0,0,0,0|1,0,2]=4 414 B10R0.60 C[N+](C)(C)CSC[C@@H](O)CF 62a_100015614560_200000036245 [0,1,0,0,0,0|2,0,1]=4 415 B10R0.60 C[N+](C)(C)CSC[C@@H](O)CF 62a_200000036245_100015614560 [0,1,0,0,0,0|2,0,1]=4 416 B10R0.60 C[N+](C)(C)CSC[C@@H](O)CO 62a_100009815848_200000036245 [0,1,0,0,0,0|1,0,2]=4 417 B10R0.60 C[N+](C)(C)CSC[C@@H](O)CO 62a_200000036245_100009815848 [0,1,0,0,0,0|1,0,2]=4 418 B10R0.60 C[Si](C)(C)C#CCC(=O)CO 1458a_100000210174_100000764098 [0,1,0,0,0,0|1,0,2]=4 419 B10R0.60 C[Si](C)(C)CCCC(=O)CO 1458a_100000210174_100011219597 [0,1,0,0,0,0|1,0,0]=2 420 B10R0.60 C[Si](C)(C)OCCC(=O)CO 1458a_100000210174_200000032530 [0,1,0,0,0,0|2,0,0]=3 421 B10R0.65 C=C[Si](C)(C)CNCC(=O)O 269956a_100016091260_100000038793 [0,1,0,0,0,0|2,0,1]=4 422 B10R0.65 CC(=O)CCCC(C)(C)C#N 1458a_100000070787_100000759902 [0,1,0,0,0,0|2,0,1]=4 423 B10R0.65 CC(=O)CCOC(C)(C)CCl 7a_100000764493_100000053229 [0,1,0,0,0,0|3,0,0]=4 424 B10R0.65 CC(=O)COCC(C)(C)CO 34a_100000211253_100009813988 [0,1,0,0,0,0|3,0,0]=4 425 B10R0.65 CC(C)(CCl)COCC(=O)N 7a_100011217199_100000187820 [0,1,0,0,0,0|3,0,0]=4 426 B10R0.65 CC(C)(CCl)OCCC(=O)N 7a_100000764493_100000744528 [0,1,0,0,0,0|3,0,0]=4 427 B10R0.65 CC(C)(CO)CNCC(=O)N 2230a_100020635058_100000747473 [0,1,0,0,0,0|3,0,0]=4 428 B10R0.65 CC(C)(CO)CNCC(=O)O 269956a_100016091260_100009813988 [0,1,0,0,0,0|2,0,0]=3 429 B10R0.65 CC(C)(CO)CSCC(=O)N 62a_100000747473_100009813988 [0,1,0,0,0,0|3,0,0]=4 430 B10R0.65 CC(C)(CO)CSCC(=O)N 62a_100009813988_100000747473 [0,1,0,0,0,0|3,0,0]=4 431 B10R0.65 CC(C)(CO)CSCC(=O)[O-] 62a_100009813988_100020667443 [0,1,0,0,0,0|2,0,1]=4 432 B10R0.65 CC(C)(CO)CSCC(=O)[O-] 62a_100020667443_100009813988 [0,1,0,0,0,0|2,0,1]=4 433 B10R0.65 CC(C)(CO)NCCC(=O)N 2230a_100000210608_100000744528 [0,1,0,0,0,0|3,0,0]=4 434 B10R0.65 CCC(C)(C)COCC(=O)N 7a_100000765029_100000187820 [0,1,0,0,0,0|3,0,0]=4 435 B10R0.65 CCC(C)(C)NCCC(=O)N 2230a_100000211385_100000744528 [0,1,0,0,0,0|3,0,0]=4 436 B10R0.65 CCC(C)(C)NOCC(=O)O 269956a_100000106656_100000032637 [0,1,0,0,0,0|3,0,0]=4 437 B10R0.65 CCC(C)(C)OCCC(=O)C 7a_100000210230_100000053229 [0,1,0,0,0,0|3,0,0]=4 438 B10R0.65 CCC(C)(C)OCCC(=O)C 7a_100000759926_100000210677 [0,1,0,0,0,0|3,0,0]=4 439 B10R0.65 CCC(C)(C)OCCC(=O)N 7a_100000210230_100000744528 [0,1,0,0,0,0|3,0,0]=4 440 B10R0.65 CCC(C)(C)OCCC(=O)N 7a_100000757172_100000210677 [0,1,0,0,0,0|3,0,0]=4 441 B10R0.65 CCC(C)(C)SCCC(=O)C 62a_100000032637_100000053229 [0,1,0,0,0,0|3,0,0]=4 442 B10R0.65 CCC(C)(C)SCCC(=O)C 62a_100000053229_100000032637 [0,1,0,0,0,0|3,0,0]=4 443 B10R0.65 CCC(C)(C)SCCC(=O)N 62a_100000032637_100000744528 [0,1,0,0,0,0|3,0,0]=4 444 B10R0.65 CCC(C)(C)SCCC(=O)N 62a_100000744528_100000032637 [0,1,0,0,0,0|3,0,0]=4 445 B10R0.65 COC(C)(C)CNCC(=O)N 2230a_100000763424_100000747473 [0,1,0,0,0,0|3,0,0]=4 446 B10R0.65 COC(C)(C)CNCC(=O)O 269956a_100016091260_100000701081 [0,1,0,0,0,0|2,0,0]=3 447 B10R0.65 COC(C)(C)COCC(=O)C 34a_100000211253_100000701081 [0,1,0,0,0,0|3,0,0]=4 448 B10R0.65 COC(C)(C)CSCC(=O)N 62a_100000701081_100000747473 [0,1,0,0,0,0|3,0,0]=4 449 B10R0.65 COC(C)(C)CSCC(=O)N 62a_100000747473_100000701081 [0,1,0,0,0,0|3,0,0]=4 450 B10R0.65 COC(C)(C)CSCC(=O)[O-] 62a_100000701081_100020667443 [0,1,0,0,0,0|2,0,1]=4 451 B10R0.65 COC(C)(C)CSCC(=O)[O-] 62a_100020667443_100000701081 [0,1,0,0,0,0|2,0,1]=4 452 B10R0.92 C=C(C)C(=O)CC[N+](C)(C)C 1458a_100000185857_100000085578 [0,1,0,0,0,0|2,0,1]=4 453 B10R0.92 CC(=O)C(C)COC(C)(C)C 34a_100000032740_100000210625 [0,1,0,0,0,0|3,0,0]=4 454 B10R0.92 CC(=O)C(C)NCC(C)(C)C 2230a_100000743828_100009814033 [0,1,0,0,0,0|3,0,0]=4 455 B10R0.92 CC(=O)C(C)OCC(C)(C)C 34a_100000212229_100011219605 [0,1,0,0,0,0|3,0,0]=4 456 B10R0.92 CC(=O)C(C)SCC(C)(C)C 62a_100009814033_100011219605 [0,1,0,0,0,0|3,0,0]=4 457 B10R0.92 CC(=O)C(C)SCC(C)(C)C 62a_100011219605_100009814033 [0,1,0,0,0,0|3,0,0]=4 458 B10R0.92 CC(=O)C(C)SC[N+](C)(C)C 62a_100009814033_200000036245 [0,1,0,0,0,0|2,0,0]=3 459 B10R0.92 CC(=O)C(C)SC[N+](C)(C)C 62a_200000036245_100009814033 [0,1,0,0,0,0|2,0,0]=3 460 B10R0.92 CC(=O)C(C)SC[Si](C)(C)C 62a_100000037933_100009814033 [0,1,0,0,0,0|3,0,0]=4 461 B10R0.92 CC(=O)C(C)SC[Si](C)(C)C 62a_100009814033_100000037933 [0,1,0,0,0,0|3,0,0]=4 462 B10R0.92 CC(C)(C)CNC(F)C(=O)N 2230a_100000743828_100009813875 [0,1,0,0,0,0|3,0,0]=4 463 B10R0.92 CC(C)(C)CSC(F)C(=O)N 62a_100009813875_100011219605 [0,1,0,0,0,0|3,0,0]=4 464 B10R0.92 CC(C)(C)CSC(F)C(=O)N 62a_100011219605_100009813875 [0,1,0,0,0,0|3,0,0]=4 465 B10R0.92 CC(C)(C)CSC(F)C(=O)[O-] 62a_100011219605_100020610796 [0,1,0,0,0,0|2,0,1]=4 466 B10R0.92 CC(C)(C)CSC(F)C(=O)[O-] 62a_100020610796_100011219605 [0,1,0,0,0,0|2,0,1]=4 467 B10R0.92 CC(C)(C)NCC(F)C(=O)O 269956a_100000084737_100000211941 [0,1,0,0,0,0|2,0,0]=3 468 B10R0.92 CC(C)(C)OC[C@H](N)C(=O)N 34a_100000729942_100000210625 [0,1,0,0,0,0|3,0,0]=4 469 B10R0.92 CC(CNC(C)(C)C)C(=O)O 269956a_100000749485_100000211941 [0,1,0,0,0,0|2,0,0]=3 470 B10R0.92 CC(NCC(C)(C)C)C(=O)N 2230a_100000743828_100000702099 [0,1,0,0,0,0|3,0,0]=4 471 B10R0.92 CC(SCC(C)(C)C)C(=O)N 62a_100000702099_100011219605 [0,1,0,0,0,0|3,0,0]=4 472 B10R0.92 CC(SCC(C)(C)C)C(=O)N 62a_100011219605_100000702099 [0,1,0,0,0,0|3,0,0]=4 473 B10R0.92 CC(SC[N+](C)(C)C)C(=O)N 62a_100000702099_200000036245 [0,1,0,0,0,0|2,0,0]=3 474 B10R0.92 CC(SC[N+](C)(C)C)C(=O)N 62a_200000036245_100000702099 [0,1,0,0,0,0|2,0,0]=3 475 B10R0.92 CC(SC[Si](C)(C)C)C(=O)N 62a_100000037933_100000702099 [0,1,0,0,0,0|3,0,0]=4 476 B10R0.92 CC(SC[Si](C)(C)C)C(=O)N 62a_100000702099_100000037933 [0,1,0,0,0,0|3,0,0]=4 477 B10R0.92 C[C@@H](NCC(C)(C)C)C(=O)N 270004a_100000119354_100011204126 [0,1,0,0,0,0|3,0,0]=4 478 B10R0.92 C[C@@H](NCC(C)(C)C)C(=O)N 34a_100000119354_100011219605 [0,1,0,0,0,0|3,0,0]=4 479 B10R0.92 C[C@@H](NC[Si](C)(C)C)C(=O)N 2230a_100000119354_100000037933 [0,1,0,0,0,0|3,0,0]=4 480 B10R0.92 C[C@@H](O)C(=O)CC[N+](C)(C)C 1458a_100000717761_100000085578 [0,1,0,0,0,0|1,0,2]=4 481 B10R0.92 C[C@@H](OCC(C)(C)C)C(=O)N 34a_100000731257_100011219605 [0,1,0,0,0,0|3,0,0]=4 482 B10R0.92 C[C@@H](OC[Si](C)(C)C)C(=O)N 7a_100000731257_100000233785 [0,1,0,0,0,0|3,0,0]=4 483 B10R0.92 C[C@H](NCC(C)(C)C)C(=O)O 269956a_100000743915_100011219605 [0,1,0,0,0,0|2,0,0]=3 484 B10R0.92 C[C@H](NCC(C)(C)F)C(=O)O 269956a_100000743915_100011997219 [0,1,0,0,0,0|3,0,0]=4 485 B10R0.92 C[C@H](NCC(C)(C)O)C(=O)O 269956a_100000743915_100000764493 [0,1,0,0,0,0|3,0,0]=4 486 B10R0.92 C[C@H](NC[N+](C)(C)C)C(=O)O 269956a_100000743915_200000036245 [0,1,0,0,0,0|1,0,0]=2 487 B10R0.92 C[C@H](NC[Si](C)(C)C)C(=O)O 269956a_100000743915_100000037933 [0,1,0,0,0,0|2,0,0]=3 488 B10R0.92 C[C@H](O)C(=O)CC[N+](C)(C)C 1458a_217856618621_100000085578 [0,1,0,0,0,0|1,0,2]=4 489 B10R0.92 C[C@H](OC[Si](C)(C)C)C(=O)[O-] 7a_217856618621_100000233785 [0,1,0,0,0,0|2,0,1]=4 490 B10R0.92 C[N+](C)(C)CCC(=O)C(O)O 1458a_100000233687_100000085578 [0,1,0,0,0,0|0,0,3]=4 491 B10R0.92 C[N+](C)(C)CSC(F)C(=O)N 62a_100009813875_200000036245 [0,1,0,0,0,0|2,0,0]=3 492 B10R0.92 C[N+](C)(C)CSC(F)C(=O)N 62a_200000036245_100009813875 [0,1,0,0,0,0|2,0,0]=3 493 B10R0.92 C[N+](C)(C)CSC(F)C(=O)[O-] 62a_100020610796_200000036245 [0,1,0,0,0,0|1,0,1]=3 494 B10R0.92 C[N+](C)(C)CSC(F)C(=O)[O-] 62a_200000036245_100020610796 [0,1,0,0,0,0|1,0,1]=3 495 B10R0.92 C[Si](C)(C)CSC(F)C(=O)N 62a_100000037933_100009813875 [0,1,0,0,0,0|3,0,0]=4 496 B10R0.92 C[Si](C)(C)CSC(F)C(=O)N 62a_100009813875_100000037933 [0,1,0,0,0,0|3,0,0]=4 497 B10R0.92 C[Si](C)(C)CSC(F)C(=O)[O-] 62a_100000037933_100020610796 [0,1,0,0,0,0|2,0,1]=4 498 B10R0.92 C[Si](C)(C)CSC(F)C(=O)[O-] 62a_100020610796_100000037933 [0,1,0,0,0,0|2,0,1]=4 499 B10R0.113 CC(C)(O)CSC[N+](C)(C)C 62a_100000764493_200000036245 [0,1,0,0,0,0|2,0,1]=4 500 B10R0.113 CC(C)(O)CSC[N+](C)(C)C 62a_200000036245_100000764493 [0,1,0,0,0,0|2,0,1]=4 501 B10R0.113 C[N+](C)(C)CCNS(=O)(=O)C 40a_100000106457_100000738038 [0,1,0,0,0,0|2,0,1]=4 502 B10R0.113 C[N+](C)(C)CSCS(=O)(=O)N 62a_100000741382_200000036245 [0,1,0,0,0,0|2,0,1]=4 503 B10R0.113 C[N+](C)(C)CSCS(=O)(=O)N 62a_200000036245_100000741382 [0,1,0,0,0,0|2,0,1]=4 504 B10R0.113 C[N+](C)(C)CSCS(=O)(=O)[O-] 62a_100009817235_200000036245 [0,1,0,0,0,0|2,0,1]=4 505 B10R0.113 C[N+](C)(C)CSCS(=O)(=O)[O-] 62a_200000036245_100009817235 [0,1,0,0,0,0|2,0,1]=4 506 B10R1.112 CC(C)(C)SC1CC(=O)C1 62a_100009894365_100000211941 [0,0,0,1,0,0|3,0,0]=4 507 B10R1.112 C[N+](C)(C)CN1CC(C1)O 269982a_100000749847_200000036245 [0,0,0,1,0,0|2,0,1]=4 508 B10R1.210 C[N+](C)(C)CSCC1CO1 62a_102125554688_200000036245 [0,0,0,1,0,0|2,0,1]=4 509 B10R1.210 C[N+](C)(C)CSCC1CO1 62a_200000036245_102125554688 [0,0,0,1,0,0|2,0,1]=4 510 B10R1.210 C[N+](C)(C)CSC[C@@H]1CO1 62a_100000745022_200000036245 [0,0,0,1,0,0|2,0,1]=4 511 B10R1.210 C[N+](C)(C)CSC[C@@H]1CO1 62a_200000036245_100000745022 [0,0,0,1,0,0|2,0,1]=4 512 B10R1.350 CC(=O)CCOC1(CC1)C 7a_100011725673_100000053229 [0,0,0,1,0,0|3,0,0]=4 513 B10R1.350 CC1(CC1)CNCC(=O)N 2230a_100000766693_100000747473 [0,0,0,1,0,0|3,0,0]=4 514 B10R1.350 CC1(CC1)COCC(=O)N 7a_100000698024_100000187820 [0,0,0,1,0,0|3,0,0]=4 515 B10R1.350 CC1(CC1)NCCC(=O)N 2230a_100000757604_100000744528 [0,0,0,1,0,0|3,0,0]=4 516 B10R1.350 CC1(CC1)OCCC(=O)N 7a_100011725673_100000744528 [0,0,0,1,0,0|3,0,0]=4 517 B10R1.350 CC1(CO1)CNCC(=O)O 269956a_100016091260_100000760498 [0,0,0,1,0,0|3,0,0]=4 518 B10R1.359 CC(=O)N1CCC(C1)(C)C 11a_100000764714_100015343762 [0,0,0,1,0,0|3,0,0]=4 519 B10R1.359 CC(=O)N1CCC(C1)(C)C 1626a_100000764714_100015343762 [0,0,0,1,0,0|3,0,0]=4 520 B10R1.359 CC(=O)N1CCC(C1)(C)C 240690a_100000764714_100015343762 [0,0,0,1,0,0|3,0,0]=4 521 B10R1.359 CC(=O)N1CCC(C1)(C)C 527a_100000764714_100103153847 [0,0,0,1,0,0|3,0,0]=4 522 B10R1.371 CC1(CN(C1)CC(=O)N)C 2230a_100000753659_100000747473 [0,0,0,1,0,0|3,0,0]=4 523 B10R1.371 CC1(CN(C1)CC(=O)N)C 269982a_100000753659_100000187820 [0,0,0,1,0,0|3,0,0]=4 524 B10R1.371 CC1(CN(C1)CC(=O)[O-])C 269982a_100000753659_100020667443 [0,0,0,1,0,0|2,0,1]=4 525 B8R0.29 CC(=O)CCC(C)(C)C 1458a_100000070787_100000755188 [0,0,0,0,1,0|2,0,0]=3 526 B8R0.29 CC(=O)CCC(C)(C)C 1458a_100000757465_200000210301 [0,0,0,0,1,0|2,0,0]=3 527 B8R0.29 CC(=O)CC[N+](C)(C)C 1458a_100000070787_100000085578 [0,0,0,0,1,0|1,0,0]=2 528 B8R0.29 CC(=O)CC[Si](C)(C)C 1458a_100000070787_200000733723 [0,0,0,0,1,0|2,0,0]=3 529 B8R0.29 CC(=O)CC[Si](C)(C)C 1458a_100011215282_200000210301 [0,0,0,0,1,0|2,0,0]=3 530 B8R0.29 CC(=O)COC(C)(C)C 1458a_100000686494_200000210301 [0,0,0,0,1,0|3,0,0]=4 531 B8R0.29 CC(=O)COC(C)(C)C 34a_100000211253_100000210625 [0,0,0,0,1,0|3,0,0]=4 532 B8R0.29 CC(=O)NCC(C)(C)C 11a_100000743828_100015343762 [0,0,0,0,1,0|3,0,0]=4 533 B8R0.29 CC(=O)NCC(C)(C)C 1626a_100000743828_100015343762 [0,0,0,0,1,0|3,0,0]=4 534 B8R0.29 CC(=O)NCC(C)(C)C 240690a_100000743828_100015343762 [0,0,0,0,1,0|3,0,0]=4 535 B8R0.29 CC(=O)NCC(C)(C)C 527a_100000743828_100103153847 [0,0,0,0,1,0|3,0,0]=4 536 B8R0.29 CC(=O)NC[Si](C)(C)C 11a_102516607284_100015343762 [0,0,0,0,1,0|3,0,0]=4 537 B8R0.29 CC(=O)NC[Si](C)(C)C 1626a_102516607284_100015343762 [0,0,0,0,1,0|3,0,0]=4 538 B8R0.29 CC(=O)NC[Si](C)(C)C 240690a_102516607284_100015343762 [0,0,0,0,1,0|3,0,0]=4 539 B8R0.29 CC(=O)NC[Si](C)(C)C 527a_102516607284_100103153847 [0,0,0,0,1,0|3,0,0]=4 540 B8R0.29 CC(C)(C)CCC(=O)[13CH3] 1458a_100000757465_200025704644 [0,0,0,0,1,0|2,0,0]=3 541 B8R0.29 CC(C)(C)NCC(=O)N 2230a_100000715429_100000747473 [0,0,0,0,1,0|3,0,0]=4 542 B8R0.29 CC(C)(C)NCC(=O)O 269956a_100016091260_100000211941 [0,0,0,0,1,0|2,0,0]=3 543 B8R0.29 CC(C)(C)OCC(=O)N 34a_100015890283_100000187820 [0,0,0,0,1,0|3,0,0]=4 544 B8R0.29 CC(C)(C)OCC(=O)N 7a_100015890283_100000187820 [0,0,0,0,1,0|3,0,0]=4 545 B8R0.29 CC(C)(C)OCC(=O)[13CH3] 1458a_100000686494_200025704644 [0,0,0,0,1,0|3,0,0]=4 546 B8R0.29 CC(C)(C)OCC(=O)[O-] 34a_100015890283_100020667443 [0,0,0,0,1,0|2,0,1]=4 547 B8R0.29 CC(C)(C)SCC(=O)N 62a_100000211941_100000747473 [0,0,0,0,1,0|3,0,0]=4 548 B8R0.29 CC(C)(C)SCC(=O)N 62a_100000747473_100000211941 [0,0,0,0,1,0|3,0,0]=4 549 B8R0.29 CC(C)(C)SCC(=O)[O-] 62a_100000211941_100020667443 [0,0,0,0,1,0|2,0,1]=4 550 B8R0.29 CC(C)(C)SCC(=O)[O-] 62a_100020667443_100000211941 [0,0,0,0,1,0|2,0,1]=4 551 B8R0.29 CN(C)CC[N+](C)(C)C 269982a_100102631434_100000085578 [0,0,0,0,1,0|3,0,0]=4 552 B8R0.29 C[Si](C)(C)CCC(=O)[13CH3] 1458a_100011215282_200025704644 [0,0,0,0,1,0|2,0,0]=3 553 B10R0.15 C=C(Br)CCOCC(C)(C)C 34a_100009813270_100011219605 [0,0,0,0,0,1|3,0,0]=4 554 B10R0.15 C=C(C)CCNCC(C)(C)C 2230a_100000743828_100000730704 [0,0,0,0,0,1|3,0,0]=4 555 B10R0.15 C=C(C)CCOCC(C)(C)C 34a_100000764851_100011219605 [0,0,0,0,0,1|3,0,0]=4 556 B10R0.15 C=C(C)CCSCC(C)(C)C 62a_100000730704_100011219605 [0,0,0,0,0,1|3,0,0]=4 557 B10R0.15 C=C(C)CCSCC(C)(C)C 62a_100011219605_100000730704 [0,0,0,0,0,1|3,0,0]=4 558 B10R0.15 C=C(C)CCSC[N+](C)(C)C 62a_100000730704_200000036245 [0,0,0,0,0,1|2,0,0]=3 559 B10R0.15 C=C(C)CCSC[N+](C)(C)C 62a_200000036245_100000730704 [0,0,0,0,0,1|2,0,0]=3 560 B10R0.15 C=C(C)CCSC[Si](C)(C)C 62a_100000037933_100000730704 [0,0,0,0,0,1|3,0,0]=4 561 B10R0.15 C=C(C)CCSC[Si](C)(C)C 62a_100000730704_100000037933 [0,0,0,0,0,1|3,0,0]=4 562 B10R0.15 C=C(C)CNCCC(C)(C)C 2230a_100000738805_100000748629 [0,0,0,0,0,1|3,0,0]=4 563 B10R0.15 C=C(C)COCCC(C)(C)C 34a_100000210245_100000755188 [0,0,0,0,0,1|3,0,0]=4 564 B10R0.15 C=C(C)COCCC(C)(C)C 7a_100000765024_100000748629 [0,0,0,0,0,1|3,0,0]=4 565 B10R0.15 C=C(C)COCC[N+](C)(C)C 34a_100000210245_100000085578 [0,0,0,0,0,1|2,0,0]=3 566 B10R0.15 C=C(C)COCC[N+](C)(C)C 7a_200020618287_100000748629 [0,0,0,0,0,1|2,0,0]=3 567 B10R0.15 C=C(C)COCC[Si](C)(C)C 34a_100000210245_200000733723 [0,0,0,0,0,1|3,0,0]=4 568 B10R0.15 C=C(C)COCC[Si](C)(C)C 7a_100000039746_100000748629 [0,0,0,0,0,1|3,0,0]=4 569 B10R0.15 C=C(C)CSCCC(C)(C)C 62a_100000748629_100000755188 [0,0,0,0,0,1|3,0,0]=4 570 B10R0.15 C=C(C)CSCCC(C)(C)C 62a_100000755188_100000211660 [0,0,0,0,0,1|3,0,0]=4 571 B10R0.15 C=C(C)CSCC[N+](C)(C)C 62a_100000085578_100000211660 [0,0,0,0,0,1|2,0,0]=3 572 B10R0.15 C=C(C)CSCC[N+](C)(C)C 62a_100000748629_100000085578 [0,0,0,0,0,1|2,0,0]=3 573 B10R0.15 C=C(C)CSCC[Si](C)(C)C 62a_100000748629_200000733723 [0,0,0,0,0,1|3,0,0]=4 574 B10R0.15 C=C(C)CSCC[Si](C)(C)C 62a_200000733723_100000211660 [0,0,0,0,0,1|3,0,0]=4 575 B10R0.15 C=C(F)CNCCC(C)(C)C 2230a_100000738805_100009893438 [0,0,0,0,0,1|3,0,0]=4 576 B10R0.15 C=C(F)COCCC(C)(C)C 34a_200010262243_100000755188 [0,0,0,0,0,1|3,0,0]=4 577 B10R0.15 C=C(F)COCCC(C)(C)C 7a_100000765024_100000042424 [0,0,0,0,0,1|3,0,0]=4 578 B10R0.15 C=C(F)COCC[N+](C)(C)C 34a_200010262243_100000085578 [0,0,0,0,0,1|2,0,0]=3 579 B10R0.15 C=C(F)COCC[N+](C)(C)C 7a_200020618287_100000042424 [0,0,0,0,0,1|2,0,0]=3 580 B10R0.15 C=C(F)COCC[Si](C)(C)C 34a_200010262243_200000733723 [0,0,0,0,0,1|3,0,0]=4 581 B10R0.15 C=C(F)COCC[Si](C)(C)C 7a_100000039746_100000042424 [0,0,0,0,0,1|3,0,0]=4 582 B10R0.15 C=C(F)CSCCC(C)(C)C 62a_100000042424_100000755188 [0,0,0,0,0,1|3,0,0]=4 583 B10R0.15 C=C(F)CSCCC(C)(C)C 62a_100000755188_100000042424 [0,0,0,0,0,1|3,0,0]=4 584 B10R0.15 C=C(F)CSCC[N+](C)(C)C 62a_100000042424_100000085578 [0,0,0,0,0,1|2,0,0]=3 585 B10R0.15 C=C(F)CSCC[N+](C)(C)C 62a_100000085578_100000042424 [0,0,0,0,0,1|2,0,0]=3 586 B10R0.15 C=C(F)CSCC[Si](C)(C)C 62a_100000042424_200000733723 [0,0,0,0,0,1|3,0,0]=4 587 B10R0.15 C=C(F)CSCC[Si](C)(C)C 62a_200000733723_100000042424 [0,0,0,0,0,1|3,0,0]=4 588 B10R0.15 CC(=CCSC[N+](C)(C)C)C 62a_100000761012_200000036245 [0,0,0,0,0,1|2,0,1]=4 589 B10R0.15 CC(=CCSC[N+](C)(C)C)C 62a_200000036245_100000761012 [0,0,0,0,0,1|2,0,1]=4 590 B10R0.15 CC(=O)CCC#C[Si](C)(C)C 1458a_100000070787_100010401983 [0,0,0,0,0,1|2,0,1]=4 591 B10R0.15 CC(=O)CCCOC(C)(C)C 34a_100000759063_100000210625 [0,0,0,0,0,1|2,0,0]=3 592 B10R0.15 CC(=O)CCCOC(C)(C)C 34a_100015890283_100000685027 [0,0,0,0,0,1|2,0,0]=3 593 B10R0.15 CC(=O)CCCOC(C)(C)C 7a_100015890283_100011215641 [0,0,0,0,0,1|2,0,0]=3 594 B10R0.15 CC(=O)CCCSC(C)(C)C 62a_100000211941_100011215641 [0,0,0,0,0,1|2,0,0]=3 595 B10R0.15 CC(=O)CCCSC(C)(C)C 62a_100011215641_100000211941 [0,0,0,0,0,1|2,0,0]=3 596 B10R0.15 CC(=O)CCOCC(C)(C)C 34a_100000759926_100011219605 [0,0,0,0,0,1|2,0,0]=3 597 B10R0.15 CC(=O)CCOCC(C)(C)F 34a_100000759926_100011997219 [0,0,0,0,0,1|3,0,0]=4 598 B10R0.15 CC(=O)CCOCC(C)(C)O 34a_100000759926_100000764493 [0,0,0,0,0,1|3,0,0]=4 599 B10R0.15 CC(=O)CCOCC(C)(C)O 7a_100000759926_100000764493 [0,0,0,0,0,1|3,0,0]=4 600 B10R0.15 CC(=O)CCOC[Si](C)(C)C 7a_100000759926_100000233785 [0,0,0,0,0,1|2,0,0]=3 601 B10R0.15 CC(=O)CCSCC(C)(C)C 62a_100000053229_100011219605 [0,0,0,0,0,1|2,0,0]=3 602 B10R0.15 CC(=O)CCSCC(C)(C)C 62a_100011219605_100000053229 [0,0,0,0,0,1|2,0,0]=3 603 B10R0.15 CC(=O)CCSCC(C)(C)F 62a_100000053229_100011997219 [0,0,0,0,0,1|3,0,0]=4 604 B10R0.15 CC(=O)CCSCC(C)(C)F 62a_100011997219_100000053229 [0,0,0,0,0,1|3,0,0]=4 605 B10R0.15 CC(=O)CCSCC(C)(C)O 62a_100000053229_100000764493 [0,0,0,0,0,1|3,0,0]=4 606 B10R0.15 CC(=O)CCSCC(C)(C)O 62a_100000764493_100000053229 [0,0,0,0,0,1|3,0,0]=4 607 B10R0.15 CC(=O)CCSC[N+](C)(C)C 62a_100000053229_200000036245 [0,0,0,0,0,1|1,0,0]=2 608 B10R0.15 CC(=O)CCSC[N+](C)(C)C 62a_200000036245_100000053229 [0,0,0,0,0,1|1,0,0]=2 609 B10R0.15 CC(=O)CCSC[Si](C)(C)C 62a_100000037933_100000053229 [0,0,0,0,0,1|2,0,0]=3 610 B10R0.15 CC(=O)CCSC[Si](C)(C)C 62a_100000053229_100000037933 [0,0,0,0,0,1|2,0,0]=3 611 B10R0.15 CC(=O)COCCC(C)(C)C 34a_100000211253_100000755188 [0,0,0,0,0,1|2,0,0]=3 612 B10R0.15 CC(=O)COCCC(C)(C)O 34a_100000211253_100000702414 [0,0,0,0,0,1|3,0,0]=4 613 B10R0.15 CC(=O)COCC[N+](C)(C)C 34a_100000211253_100000085578 [0,0,0,0,0,1|1,0,0]=2 614 B10R0.15 CC(=O)COCC[Si](C)(C)C 1458a_100000070787_100000032501 [0,0,0,0,0,1|2,0,0]=3 615 B10R0.15 CC(=O)COCC[Si](C)(C)C 34a_100000211253_200000733723 [0,0,0,0,0,1|2,0,0]=3 616 B10R0.15 CC(=O)NCCC[Si](C)(C)C 1626a_100000725946_100015343762 [0,0,0,0,0,1|2,0,0]=3 617 B10R0.15 CC(=O)NCCC[Si](C)(C)C 240690a_100000725946_100015343762 [0,0,0,0,0,1|2,0,0]=3 618 B10R0.15 CC(=O)NCCC[Si](C)(C)C 527a_100000725946_100103153847 [0,0,0,0,0,1|2,0,0]=3 619 B10R0.15 CC(=O)NCCNC(C)(C)C 2230a_100000715429_100000189650 [0,0,0,0,0,1|3,0,0]=4 620 B10R0.15 CC(=O)NCCOC(C)(C)C 11a_100000747557_100015343762 [0,0,0,0,0,1|3,0,0]=4 621 B10R0.15 CC(=O)NCCOC(C)(C)C 1626a_100000747557_100015343762 [0,0,0,0,0,1|3,0,0]=4 622 B10R0.15 CC(=O)NCCOC(C)(C)C 240690a_100000747557_100015343762 [0,0,0,0,0,1|3,0,0]=4 623 B10R0.15 CC(=O)NCCOC(C)(C)C 34a_100000158858_100000210625 [0,0,0,0,0,1|3,0,0]=4 624 B10R0.15 CC(=O)NCCOC(C)(C)C 527a_100000747557_100103153847 [0,0,0,0,0,1|3,0,0]=4 625 B10R0.15 CC(=O)NCCOC(C)(C)C 7a_100015890283_100000189650 [0,0,0,0,0,1|3,0,0]=4 626 B10R0.15 CC(=O)NCCSC(C)(C)C 11a_100000689375_100015343762 [0,0,0,0,0,1|3,0,0]=4 627 B10R0.15 CC(=O)NCCSC(C)(C)C 1626a_100000689375_100015343762 [0,0,0,0,0,1|3,0,0]=4 628 B10R0.15 CC(=O)NCCSC(C)(C)C 240690a_100000689375_100015343762 [0,0,0,0,0,1|3,0,0]=4 629 B10R0.15 CC(=O)NCCSC(C)(C)C 527a_100000689375_100103153847 [0,0,0,0,0,1|3,0,0]=4 630 B10R0.15 CC(=O)NCCSC(C)(C)C 62a_100000189650_100000211941 [0,0,0,0,0,1|3,0,0]=4 631 B10R0.15 CC(=O)NCCSC(C)(C)C 62a_100000211941_100000189650 [0,0,0,0,0,1|3,0,0]=4 632 B10R0.15 CC(=O)OCCOC(C)(C)C 34a_100015890283_100009814007 [0,0,0,0,0,1|3,0,0]=4 633 B10R0.15 CC(=O)OCCOC(C)(C)C 7a_100015890283_100009814007 [0,0,0,0,0,1|3,0,0]=4 634 B10R0.15 CC(=O)OCCSC(C)(C)C 62a_100000211941_100009814007 [0,0,0,0,0,1|3,0,0]=4 635 B10R0.15 CC(=O)OCCSC(C)(C)C 62a_100009814007_100000211941 [0,0,0,0,0,1|3,0,0]=4 636 B10R0.15 CC(=O)OCSCC(C)(C)C 62a_100000076356_100011219605 [0,0,0,0,0,1|3,0,0]=4 637 B10R0.15 CC(=O)OCSCC(C)(C)C 62a_100011219605_100000076356 [0,0,0,0,0,1|3,0,0]=4 638 B10R0.15 CC(=O)OCSC[N+](C)(C)C 62a_100000076356_200000036245 [0,0,0,0,0,1|2,0,0]=3 639 B10R0.15 CC(=O)OCSC[N+](C)(C)C 62a_200000036245_100000076356 [0,0,0,0,0,1|2,0,0]=3 640 B10R0.15 CC(=O)OCSC[Si](C)(C)C 62a_100000037933_100000076356 [0,0,0,0,0,1|3,0,0]=4 641 B10R0.15 CC(=O)OCSC[Si](C)(C)C 62a_100000076356_100000037933 [0,0,0,0,0,1|3,0,0]=4 642 B10R0.15 CC(Br)COCC[N+](C)(C)C 34a_100012180447_100000085578 [0,0,0,0,0,1|2,0,1]=4 643 B10R0.15 CC(C)(C)CCNCC(=O)N 2230a_100000711301_100000755188 [0,0,0,0,0,1|2,0,0]=3 644 B10R0.15 CC(C)(C)CCNCC(=O)N 2230a_100000738805_100000747473 [0,0,0,0,0,1|2,0,0]=3 645 B10R0.15 CC(C)(C)CCNCC(=O)O 269956a_100016091260_100000755188 [0,0,0,0,0,1|1,0,0]=2 646 B10R0.15 CC(C)(C)CCOCC(=O)N 7a_100000765024_100000187820 [0,0,0,0,0,1|2,0,0]=3 647 B10R0.15 CC(C)(C)CCSCC(=O)N 62a_100000747473_100000755188 [0,0,0,0,0,1|2,0,0]=3 648 B10R0.15 CC(C)(C)CCSCC(=O)N 62a_100000755188_100000747473 [0,0,0,0,0,1|2,0,0]=3 649 B10R0.15 CC(C)(C)CCSCC(=O)[O-] 62a_100000755188_100020667443 [0,0,0,0,0,1|1,0,1]=3 650 B10R0.15 CC(C)(C)CCSCC(=O)[O-] 62a_100020667443_100000755188 [0,0,0,0,0,1|1,0,1]=3 651 B10R0.15 CC(C)(C)CCSC[N+](=O)[O-] 62a_100000755188_100000761209 [0,0,0,0,0,1|2,0,1]=4 652 B10R0.15 CC(C)(C)CNCCC(=O)N 2230a_100000743828_100000744528 [0,0,0,0,0,1|2,0,0]=3 653 B10R0.15 CC(C)(C)CNOCC(=O)O 269956a_100000106656_100011219605 [0,0,0,0,0,1|2,0,0]=3 654 B10R0.15 CC(C)(C)COCCC(=O)N 34a_100000757172_100011219605 [0,0,0,0,0,1|2,0,0]=3 655 B10R0.15 CC(C)(C)CSCCC(=O)N 62a_100000744528_100011219605 [0,0,0,0,0,1|2,0,0]=3 656 B10R0.15 CC(C)(C)CSCCC(=O)N 62a_100011219605_100000744528 [0,0,0,0,0,1|2,0,0]=3 657 B10R0.15 CC(C)(C)NCCCC(=O)N 34a_100000739312_100000210625 [0,0,0,0,0,1|2,0,0]=3 658 B10R0.15 CC(C)(C)NCCNC(=O)N 2230a_100000715429_200000034859 [0,0,0,0,0,1|3,0,0]=4 659 B10R0.15 CC(C)(C)NCCNC(=O)N 34a_100020590234_100000210625 [0,0,0,0,0,1|3,0,0]=4 660 B10R0.15 CC(C)(C)OCCCC(=O)N 34a_100015890283_100102525003 [0,0,0,0,0,1|2,0,0]=3 661 B10R0.15 CC(C)(C)OCCCC(=O)N 7a_100015890283_100102525003 [0,0,0,0,0,1|2,0,0]=3 662 B10R0.15 CC(C)(C)OCCC[N+](=O)[O-] 34a_200000037920_100000210625 [0,0,0,0,0,1|2,0,1]=4 663 B10R0.15 CC(C)(C)OCCNC(=O)N 34a_100000181757_100000210625 [0,0,0,0,0,1|3,0,0]=4 664 B10R0.15 CC(C)(C)OCCNC(=O)N 7a_100015890283_200000034859 [0,0,0,0,0,1|3,0,0]=4 665 B10R0.15 CC(C)(C)OCCOC(=O)N 34a_100015890283_200011214921 [0,0,0,0,0,1|3,0,0]=4 666 B10R0.15 CC(C)(C)OCCOC(=O)N 7a_100015890283_200011214921 [0,0,0,0,0,1|3,0,0]=4 667 B10R0.15 CC(C)(C)SCCCC(=O)N 62a_100000211941_100102525003 [0,0,0,0,0,1|2,0,0]=3 668 B10R0.15 CC(C)(C)SCCCC(=O)N 62a_100102525003_100000211941 [0,0,0,0,0,1|2,0,0]=3 669 B10R0.15 CC(C)(C)SCCNC(=O)N 62a_100000211941_200000034859 [0,0,0,0,0,1|3,0,0]=4 670 B10R0.15 CC(C)(C)SCCNC(=O)N 62a_200000034859_100000211941 [0,0,0,0,0,1|3,0,0]=4 671 B10R0.15 CC(C)(C)SCCOC(=O)N 62a_100000211941_200011214921 [0,0,0,0,0,1|3,0,0]=4 672 B10R0.15 CC(C)(C)SCCOC(=O)N 62a_200011214921_100000211941 [0,0,0,0,0,1|3,0,0]=4 673 B10R0.15 CC(C)(F)CCNCC(=O)N 2230a_100016253952_100000747473 [0,0,0,0,0,1|3,0,0]=4 674 B10R0.15 CC(C)(F)CNCCC(=O)N 2230a_100020643315_100000744528 [0,0,0,0,0,1|3,0,0]=4 675 B10R0.15 CC(C)(F)CNOCC(=O)O 269956a_100000106656_100011997219 [0,0,0,0,0,1|3,0,0]=4 676 B10R0.15 CC(C)(F)COCCC(=O)N 34a_100000716592_100000731001 [0,0,0,0,0,1|3,0,0]=4 677 B10R0.15 CC(C)(F)COCCC(=O)N 34a_100000757172_100011997219 [0,0,0,0,0,1|3,0,0]=4 678 B10R0.15 CC(C)(F)CSCCC(=O)N 62a_100000744528_100011997219 [0,0,0,0,0,1|3,0,0]=4 679 B10R0.15 CC(C)(F)CSCCC(=O)N 62a_100011997219_100000744528 [0,0,0,0,0,1|3,0,0]=4 680 B10R0.15 CC(C)(O)CCNCC(=O)N 2230a_100000711301_100000702414 [0,0,0,0,0,1|3,0,0]=4 681 B10R0.15 CC(C)(O)CCNCC(=O)O 269956a_100016091260_100000702414 [0,0,0,0,0,1|2,0,0]=3 682 B10R0.15 CC(C)(O)CCSCC(=O)N 62a_100000702414_100000747473 [0,0,0,0,0,1|3,0,0]=4 683 B10R0.15 CC(C)(O)CCSCC(=O)N 62a_100000747473_100000702414 [0,0,0,0,0,1|3,0,0]=4 684 B10R0.15 CC(C)(O)CCSCC(=O)[O-] 62a_100000702414_100020667443 [0,0,0,0,0,1|2,0,1]=4 685 B10R0.15 CC(C)(O)CCSCC(=O)[O-] 62a_100020667443_100000702414 [0,0,0,0,0,1|2,0,1]=4 686 B10R0.15 CC(C)(O)CNCCC(=O)N 2230a_100000751335_100000744528 [0,0,0,0,0,1|3,0,0]=4 687 B10R0.15 CC(C)(O)CNOCC(=O)O 269956a_100000106656_100000764493 [0,0,0,0,0,1|3,0,0]=4 688 B10R0.15 CC(C)(O)COCCC(=O)N 34a_100000757172_100000764493 [0,0,0,0,0,1|3,0,0]=4 689 B10R0.15 CC(C)(O)COCCC(=O)N 7a_100000757172_100000764493 [0,0,0,0,0,1|3,0,0]=4 690 B10R0.15 CC(C)(O)CSCCC(=O)N 62a_100000744528_100000764493 [0,0,0,0,0,1|3,0,0]=4 691 B10R0.15 CC(C)(O)CSCCC(=O)N 62a_100000764493_100000744528 [0,0,0,0,0,1|3,0,0]=4 692 B10R0.15 CC(C)CCSC[N+](C)(C)C 62a_100000210312_200000036245 [0,0,0,0,0,1|2,0,1]=4 693 B10R0.15 CC(C)CCSC[N+](C)(C)C 62a_200000036245_100000210312 [0,0,0,0,0,1|2,0,1]=4 694 B10R0.15 CC(C)CNCC[N+](C)(C)C 270004a_100000106457_100000210432 [0,0,0,0,0,1|2,0,1]=4 695 B10R0.15 CC(C)CNCC[N+](C)(C)C 34a_100000210953_100000085578 [0,0,0,0,0,1|2,0,1]=4 696 B10R0.15 CC(C)COCC[N+](C)(C)C 34a_100000210257_100000085578 [0,0,0,0,0,1|2,0,1]=4 697 B10R0.15 CC(C)COCC[N+](C)(C)C 7a_200020618287_100000210760 [0,0,0,0,0,1|2,0,1]=4 698 B10R0.15 CC(C)CSCC[N+](C)(C)C 62a_100000085578_100000210760 [0,0,0,0,0,1|2,0,1]=4 699 B10R0.15 CC(C)CSCC[N+](C)(C)C 62a_100000210624_100000085578 [0,0,0,0,0,1|2,0,1]=4 700 B10R0.15 CC(C)NCCC[N+](C)(C)C 2230a_100138425928_100016990835 [0,0,0,0,0,1|2,0,1]=4 701 B10R0.15 CC(C)NCCC[N+](C)(C)C 34a_100138425928_100016990835 [0,0,0,0,0,1|2,0,1]=4 702 B10R0.15 CC(C)OCCC[N+](C)(C)C 34a_100000212225_100016990835 [0,0,0,0,0,1|2,0,1]=4 703 B10R0.15 CC(C)SCCC[N+](C)(C)C 62a_100000210206_100016990835 [0,0,0,0,0,1|2,0,1]=4 704 B10R0.15 CC(C)SCCC[N+](C)(C)C 62a_100016990835_100000210206 [0,0,0,0,0,1|2,0,1]=4 705 B10R0.15 CC(F)COCC[N+](C)(C)C 34a_100015925927_100000085578 [0,0,0,0,0,1|2,0,1]=4 706 B10R0.15 CC(O)CCCNC(C)(C)C 2230a_100000715429_200000718107 [0,0,0,0,0,1|2,0,1]=4 707 B10R0.15 CC(O)CCCOC(C)(C)C 34a_100015890283_200000718107 [0,0,0,0,0,1|2,0,1]=4 708 B10R0.15 CC(O)CCCOC(C)(C)C 7a_100015890283_200000718107 [0,0,0,0,0,1|2,0,1]=4 709 B10R0.15 CC(O)CCCSC(C)(C)C 62a_100000211941_200000718107 [0,0,0,0,0,1|2,0,1]=4 710 B10R0.15 CC(O)CCCSC(C)(C)C 62a_200000718107_100000211941 [0,0,0,0,0,1|2,0,1]=4 711 B10R0.15 CC(O)CCNCC(C)(C)C 2230a_100000743828_100012276601 [0,0,0,0,0,1|2,0,1]=4 712 B10R0.15 CC(O)CCNCC(C)(C)C 270004a_200000755665_100011204126 [0,0,0,0,0,1|2,0,1]=4 713 B10R0.15 CC(O)CCNC[Si](C)(C)C 2230a_200000755665_100000037933 [0,0,0,0,0,1|2,0,1]=4 714 B10R0.15 CC(O)CCSCC(C)(C)C 62a_100011219605_100012276601 [0,0,0,0,0,1|2,0,1]=4 715 B10R0.15 CC(O)CCSCC(C)(C)C 62a_100012276601_100011219605 [0,0,0,0,0,1|2,0,1]=4 716 B10R0.15 CC(O)CCSC[N+](C)(C)C 62a_100012276601_200000036245 [0,0,0,0,0,1|1,0,1]=3 717 B10R0.15 CC(O)CCSC[N+](C)(C)C 62a_200000036245_100012276601 [0,0,0,0,0,1|1,0,1]=3 718 B10R0.15 CC(O)CCSC[Si](C)(C)C 62a_100000037933_100012276601 [0,0,0,0,0,1|2,0,1]=4 719 B10R0.15 CC(O)CCSC[Si](C)(C)C 62a_100012276601_100000037933 [0,0,0,0,0,1|2,0,1]=4 720 B10R0.15 CC(O)CNCCC(C)(C)C 2230a_100000210904_100000755188 [0,0,0,0,0,1|2,0,1]=4 721 B10R0.15 CC(O)CNCCC(C)(C)C 2230a_100000738805_100011218427 [0,0,0,0,0,1|2,0,1]=4 722 B10R0.15 CC(O)CNCCC(C)(C)C 34a_100000210904_100000755188 [0,0,0,0,0,1|2,0,1]=4 723 B10R0.15 CC(O)CNCC[N+](C)(C)C 34a_100000210904_100000085578 [0,0,0,0,0,1|1,0,1]=3 724 B10R0.15 CC(O)CNCC[Si](C)(C)C 2230a_100000210904_200000733723 [0,0,0,0,0,1|2,0,1]=4 725 B10R0.15 CC(O)CNCC[Si](C)(C)C 34a_100000210904_200000733723 [0,0,0,0,0,1|2,0,1]=4 726 B10R0.15 CC(O)COCCC(C)(C)C 7a_100000765024_100011218427 [0,0,0,0,0,1|2,0,1]=4 727 B10R0.15 CC(O)COCC[N+](C)(C)C 7a_200020618287_100011218427 [0,0,0,0,0,1|1,0,1]=3 728 B10R0.15 CC(O)COCC[Si](C)(C)C 7a_100000039746_100011218427 [0,0,0,0,0,1|2,0,1]=4 729 B10R0.15 CC(O)CSCCC(C)(C)C 62a_100000755188_100011218427 [0,0,0,0,0,1|2,0,1]=4 730 B10R0.15 CC(O)CSCCC(C)(C)C 62a_100011218427_100000755188 [0,0,0,0,0,1|2,0,1]=4 731 B10R0.15 CC(O)CSCC[N+](C)(C)C 62a_100000085578_100011218427 [0,0,0,0,0,1|1,0,1]=3 732 B10R0.15 CC(O)CSCC[N+](C)(C)C 62a_100011218427_100000085578 [0,0,0,0,0,1|1,0,1]=3 733 B10R0.15 CC(O)CSCC[Si](C)(C)C 62a_100011218427_200000733723 [0,0,0,0,0,1|2,0,1]=4 734 B10R0.15 CC(O)CSCC[Si](C)(C)C 62a_200000733723_100011218427 [0,0,0,0,0,1|2,0,1]=4 735 B10R0.15 CN(C)CCSC[N+](C)(C)C 62a_200000036245_100000755713 [0,0,0,0,0,1|3,0,0]=4 736 B10R0.15 CS(=O)(=O)CCNCC(=O)O 269956a_100016091260_100000731031 [0,0,0,0,0,1|3,0,0]=4 737 B10R0.15 C[C@@H](Cl)COCC[N+](C)(C)C 34a_100016084084_100000085578 [0,0,0,0,0,1|2,0,1]=4 738 B10R0.15 C[C@@H](N)COCC[N+](C)(C)C 34a_100000737577_100000085578 [0,0,0,0,0,1|2,0,1]=4 739 B10R0.15 C[C@@H](O)CNCCC(C)(C)C 2230a_100000738805_100009817552 [0,0,0,0,0,1|2,0,1]=4 740 B10R0.15 C[C@@H](O)COCCC(C)(C)C 7a_100000765024_100009817552 [0,0,0,0,0,1|2,0,1]=4 741 B10R0.15 C[C@@H](O)COCC[N+](C)(C)C 7a_200020618287_100009817552 [0,0,0,0,0,1|1,0,1]=3 742 B10R0.15 C[C@@H](O)COCC[Si](C)(C)C 7a_100000039746_100009817552 [0,0,0,0,0,1|2,0,1]=4 743 B10R0.15 C[C@@H](O)CSCCC(C)(C)C 62a_100000755188_100009817552 [0,0,0,0,0,1|2,0,1]=4 744 B10R0.15 C[C@@H](O)CSCCC(C)(C)C 62a_100009817552_100000755188 [0,0,0,0,0,1|2,0,1]=4 745 B10R0.15 C[C@@H](O)CSCC[N+](C)(C)C 62a_100000085578_100009817552 [0,0,0,0,0,1|1,0,1]=3 746 B10R0.15 C[C@@H](O)CSCC[N+](C)(C)C 62a_100009817552_100000085578 [0,0,0,0,0,1|1,0,1]=3 747 B10R0.15 C[C@@H](O)CSCC[Si](C)(C)C 62a_100009817552_200000733723 [0,0,0,0,0,1|2,0,1]=4 748 B10R0.15 C[C@@H](O)CSCC[Si](C)(C)C 62a_200000733723_100009817552 [0,0,0,0,0,1|2,0,1]=4 749 B10R0.15 C[N+](C)(C)CCNCC(=O)O 269956a_100016091260_100000085578 [0,0,0,0,0,1|0,0,0]=1 750 B10R0.15 C[N+](C)(C)CCNCC(F)F 34a_100000765723_100000085578 [0,0,0,0,0,1|2,0,1]=4 751 B10R0.15 C[N+](C)(C)CCOCC(=O)N 7a_200020618287_100000187820 [0,0,0,0,0,1|1,0,0]=2 752 B10R0.15 C[N+](C)(C)CCOCC(F)F 34a_100000743014_100000085578 [0,0,0,0,0,1|2,0,1]=4 753 B10R0.15 C[N+](C)(C)CCOCC(F)F 7a_200020618287_100011934356 [0,0,0,0,0,1|2,0,1]=4 754 B10R0.15 C[N+](C)(C)CCSCC(=O)N 62a_100000085578_100000747473 [0,0,0,0,0,1|1,0,0]=2 755 B10R0.15 C[N+](C)(C)CCSCC(=O)N 62a_100000747473_100000085578 [0,0,0,0,0,1|1,0,0]=2 756 B10R0.15 C[N+](C)(C)CCSCC(=O)[O-] 62a_100000085578_100020667443 [0,0,0,0,0,1|0,0,1]=2 757 B10R0.15 C[N+](C)(C)CCSCC(=O)[O-] 62a_100020667443_100000085578 [0,0,0,0,0,1|0,0,1]=2 758 B10R0.15 C[N+](C)(C)CCSCC(F)F 62a_100000085578_100011934356 [0,0,0,0,0,1|2,0,1]=4 759 B10R0.15 C[N+](C)(C)CCSCC(F)F 62a_100011934356_100000085578 [0,0,0,0,0,1|2,0,1]=4 760 B10R0.15 C[N+](C)(C)CCSC[N+](=O)[O-] 62a_100000085578_100000761209 [0,0,0,0,0,1|1,0,1]=3 761 B10R0.15 C[N+](C)(C)CNOCC(=O)O 269956a_100000106656_200000036245 [0,0,0,0,0,1|1,0,0]=2 762 B10R0.15 C[N+](C)(C)CSCCC(=O)N 62a_100000744528_200000036245 [0,0,0,0,0,1|1,0,0]=2 763 B10R0.15 C[N+](C)(C)CSCCC(=O)N 62a_200000036245_100000744528 [0,0,0,0,0,1|1,0,0]=2 764 B10R0.15 C[Si](C)(C)CCNCC(=O)N 2230a_100000711301_200000733723 [0,0,0,0,0,1|2,0,0]=3 765 B10R0.15 C[Si](C)(C)CCNCC(=O)O 269956a_100016091260_200000733723 [0,0,0,0,0,1|1,0,0]=2 766 B10R0.15 C[Si](C)(C)CCOCC(=O)N 7a_100000039746_100000187820 [0,0,0,0,0,1|2,0,0]=3 767 B10R0.15 C[Si](C)(C)CCSCC(=O)N 62a_100000747473_200000733723 [0,0,0,0,0,1|2,0,0]=3 768 B10R0.15 C[Si](C)(C)CCSCC(=O)N 62a_200000733723_100000747473 [0,0,0,0,0,1|2,0,0]=3 769 B10R0.15 C[Si](C)(C)CCSCC(=O)[O-] 62a_100020667443_200000733723 [0,0,0,0,0,1|1,0,1]=3 770 B10R0.15 C[Si](C)(C)CCSCC(=O)[O-] 62a_200000733723_100020667443 [0,0,0,0,0,1|1,0,1]=3 771 B10R0.15 C[Si](C)(C)CCSC[N+](=O)[O-] 62a_200000733723_100000761209 [0,0,0,0,0,1|2,0,1]=4 772 B10R0.15 C[Si](C)(C)CNOCC(=O)O 269956a_100000106656_100000037933 [0,0,0,0,0,1|2,0,0]=3 773 B10R0.15 C[Si](C)(C)COCCC(=O)N 7a_100000757172_100000233785 [0,0,0,0,0,1|2,0,0]=3 774 B10R0.15 C[Si](C)(C)CSCCC(=O)N 62a_100000037933_100000744528 [0,0,0,0,0,1|2,0,0]=3 775 B10R0.15 C[Si](C)(C)CSCCC(=O)N 62a_100000744528_100000037933 [0,0,0,0,0,1|2,0,0]=3 776 B7R0.4 C=CCCCN(C)C 2230a_100102631434_100011713584 [2,0,0,0,0,0|1,0,1]=4 777 B7R0.4 C=CCCCN(C)C 269982a_100102631434_100000757094 [2,0,0,0,0,0|1,0,1]=4 778 B7R0.4 CC(=O)CCCO[13CH3] 34a_100000759063_200025704644 [2,0,0,0,0,0|2,0,0]=4 779 B7R0.4 CC(=O)CCCO[13CH3] 7a_100000759063_200025704644 [2,0,0,0,0,0|2,0,0]=4 780 B7R0.4 CC(=O)CCCS[13CH3] 62a_100011215641_200025704644 [2,0,0,0,0,0|2,0,0]=4 781 B7R0.4 CC(=O)CCCS[13CH3] 62a_200025704644_100011215641 [2,0,0,0,0,0|2,0,0]=4 782 B7R0.4 CC(C)CNCC=O 2230a_100000210953_200015260668 [2,0,0,0,0,0|2,0,0]=4 783 B7R0.4 CC(C)CNCC=O 34a_100000210953_200009817547 [2,0,0,0,0,0|2,0,0]=4 784 B7R0.4 CC(C)COCC=O 34a_100000210257_200009817547 [2,0,0,0,0,0|2,0,0]=4 785 B7R0.4 CC(C)CSCC=O 62a_100000210624_200015260668 [2,0,0,0,0,0|2,0,0]=4 786 B7R0.4 CC(C)CSCC=O 62a_200015260668_100000210760 [2,0,0,0,0,0|2,0,0]=4 787 B7R0.4 CCCCCC(=O)C 1458a_100000070787_100000210326 [2,0,0,0,0,0|2,0,0]=4 788 B7R0.4 CCCCCC(=O)C 1458a_100000212188_200000210301 [2,0,0,0,0,0|2,0,0]=4 789 B7R0.4 CCCCCC(=O)[13CH3] 1458a_100000212188_200025704644 [2,0,0,0,0,0|2,0,0]=4 790 B7R0.4 CCCNCC(=O)O 269956a_100016091260_100000210207 [2,0,0,0,0,0|2,0,0]=4 791 B7R0.4 CN(C)CCCC=O 2230a_100102631434_200011292268 [2,0,0,0,0,0|0,0,1]=3 792 B7R0.4 CN(C)CCCC=O 269982a_100102631434_200011292268 [2,0,0,0,0,0|0,0,1]=3 793 B7R0.4 CN(C)CCCCO 2230a_100000717598_200000210301 [2,0,0,0,0,0|0,0,2]=4 794 B7R0.4 CN(C)CCCCO 2230a_100102631434_100000210776 [2,0,0,0,0,0|0,0,2]=4 795 B7R0.4 CN(C)CCCCO 269982a_100000717598_200000210301 [2,0,0,0,0,0|0,0,2]=4 796 B7R0.4 CN(C)CCCCO 269982a_100102631434_100000210776 [2,0,0,0,0,0|0,0,2]=4 797 B7R0.4 CN([13CH3])CCCCO 2230a_100000717598_200025704644 [2,0,0,0,0,0|0,0,2]=4 798 B7R0.4 CN([13CH3])CCCCO 269982a_100000717598_200025704644 [2,0,0,0,0,0|0,0,2]=4 799 B7R0.4 CNCCCC(=O)C 34a_100102657272_100000685027 [2,0,0,0,0,0|1,0,1]=4 800 B7R0.4 CNCCCC(=O)C 7a_106832991635_100011215641 [2,0,0,0,0,0|1,0,1]=4 801 B7R0.4 CNCCCC(=O)N 34a_100000739312_200000210301 [2,0,0,0,0,0|1,0,1]=4 802 B7R0.4 CNCCCC(=O)N 34a_100102657272_100102525003 [2,0,0,0,0,0|1,0,1]=4 803 B7R0.4 CNCCCC(=O)N 7a_106832991635_100102525003 [2,0,0,0,0,0|1,0,1]=4 804 B7R0.4 COCCCC(=O)C 1458a_100000070787_100000740836 [2,0,0,0,0,0|2,0,0]=4 805 B7R0.4 COCCCC(=O)C 1458a_100000741012_200000210301 [2,0,0,0,0,0|2,0,0]=4 806 B7R0.4 COCCCC(=O)C 34a_100000759063_200000210301 [2,0,0,0,0,0|2,0,0]=4 807 B7R0.4 COCCCC(=O)C 34a_100138415774_100000685027 [2,0,0,0,0,0|2,0,0]=4 808 B7R0.4 COCCCC(=O)C 7a_100000759063_200000210301 [2,0,0,0,0,0|2,0,0]=4 809 B7R0.4 COCCCC(=O)N 34a_100138415774_100102525003 [2,0,0,0,0,0|2,0,0]=4 810 B7R0.4 COCCCC(=O)[13CH3] 1458a_100000741012_200025704644 [2,0,0,0,0,0|2,0,0]=4 811 B7R0.4 COCNCC(=O)O 269956a_100016091260_100000766300 [2,0,0,0,0,0|2,0,0]=4 812 B7R0.4 CSCCCC(=O)C 1458a_100000173376_200000210301 [2,0,0,0,0,0|2,0,0]=4 813 B7R0.4 CSCCCC(=O)C 62a_100011215641_200000210301 [2,0,0,0,0,0|2,0,0]=4 814 B7R0.4 CSCCCC(=O)C 62a_200000210301_100011215641 [2,0,0,0,0,0|2,0,0]=4 815 B7R0.4 CSCCCC(=O)N 62a_100102525003_200000210301 [2,0,0,0,0,0|2,0,0]=4 816 B7R0.4 CSCCCC(=O)N 62a_200000210301_100102525003 [2,0,0,0,0,0|2,0,0]=4 817 B7R0.4 CSCCCC(=O)[13CH3] 1458a_100000173376_200025704644 [2,0,0,0,0,0|2,0,0]=4 818 B7R0.4 CSCNCC(=O)O 269956a_100016091260_100011218213 [2,0,0,0,0,0|2,0,0]=4 819 B7R0.4 [13CH3]NCCCC(=O)N 34a_100000739312_200025704644 [2,0,0,0,0,0|1,0,1]=4 820 B7R0.4 [13CH3]SCCCC(=O)N 62a_100102525003_200025704644 [2,0,0,0,0,0|2,0,0]=4 821 B7R0.4 [13CH3]SCCCC(=O)N 62a_200025704644_100102525003 [2,0,0,0,0,0|2,0,0]=4 822 B7R0.8 CC(C)(C)NCC=O 2230a_100000715429_200015260668 [2,0,0,0,0,0|2,0,0]=4 823 B7R0.8 CC(C)(C)NCCO 2230a_100000715429_100000211926 [2,0,0,0,0,0|2,0,0]=4 824 B7R0.8 CC(C)(C)NCCO 34a_100016990907_100000210625 [2,0,0,0,0,0|2,0,0]=4 825 B7R0.8 CC(C)(C)OCC=O 34a_100015890283_200009817547 [2,0,0,0,0,0|2,0,0]=4 826 B7R0.8 CC(C)(C)OCC=O 7a_100015890283_200015260668 [2,0,0,0,0,0|2,0,0]=4 827 B7R0.8 CC(C)(C)OCCO 34a_100015890283_100000211926 [2,0,0,0,0,0|2,0,0]=4 828 B7R0.8 CC(C)(C)OCCO 7a_100015890283_100000211926 [2,0,0,0,0,0|2,0,0]=4 829 B7R0.8 CC(C)(C)SCC=O 62a_100000211941_200015260668 [2,0,0,0,0,0|2,0,0]=4 830 B7R0.8 CC(C)(C)SCC=O 62a_200015260668_100000211941 [2,0,0,0,0,0|2,0,0]=4 831 B7R0.8 CC(C)(C)SCCO 62a_100000211926_100000211941 [2,0,0,0,0,0|2,0,0]=4 832 B7R0.8 CC(C)(C)SCCO 62a_100000211941_100000211926 [2,0,0,0,0,0|2,0,0]=4 833 B7R0.8 CCSC[N+](C)(C)C 62a_100000210202_200000036245 [2,0,0,0,0,0|1,0,1]=4 834 B7R0.8 CCSC[N+](C)(C)C 62a_200000036245_100000210202 [2,0,0,0,0,0|1,0,1]=4 835 B7R0.8 CNCC[N+](C)(C)C 34a_100102657272_100000085578 [2,0,0,0,0,0|1,0,1]=4 836 B7R0.8 CNCC[N+](C)(C)C 7a_106832991635_100000085578 [2,0,0,0,0,0|1,0,1]=4 837 B7R0.8 COCC[N+](C)(C)C 34a_100138415774_100000085578 [2,0,0,0,0,0|1,0,1]=4 838 B7R0.8 COCC[N+](C)(C)C 7a_200020618287_200000210301 [2,0,0,0,0,0|1,0,1]=4 839 B7R0.8 CSCC[N+](C)(C)C 62a_100000085578_200000210301 [2,0,0,0,0,0|1,0,1]=4 840 B7R0.8 CSCC[N+](C)(C)C 62a_200000210301_100000085578 [2,0,0,0,0,0|1,0,1]=4 841 B7R0.8 C[N+](C)(C)CCO[13CH3] 7a_200020618287_200025704644 [2,0,0,0,0,0|1,0,1]=4 842 B7R0.8 C[N+](C)(C)CCS[13CH3] 62a_100000085578_200025704644 [2,0,0,0,0,0|1,0,1]=4 843 B7R0.8 C[N+](C)(C)CCS[13CH3] 62a_200025704644_100000085578 [2,0,0,0,0,0|1,0,1]=4 844 B7R0.8 C[N+](C)(C)CSCF 62a_100015361967_200000036245 [2,0,0,0,0,0|2,0,0]=4 845 B7R0.8 C[N+](C)(C)CSCF 62a_200000036245_100015361967 [2,0,0,0,0,0|2,0,0]=4 846 B9R0.3 C[C@@H](NCC=O)C(C)(C)C 2230a_100025703359_200015260668 [1,1,0,0,0,0|2,0,0]=4 847 B9R0.20 CC(C)(CCl)COCC=O 7a_100011217199_200015260668 [1,1,0,0,0,0|2,0,0]=4 848 B9R0.20 CC(C)(CO)CNCC=O 2230a_100020635058_200015260668 [1,1,0,0,0,0|2,0,0]=4 849 B9R0.20 CC(C)(CO)CSCC=O 62a_100009813988_200015260668 [1,1,0,0,0,0|2,0,0]=4 850 B9R0.20 CC(C)(CO)CSCC=O 62a_200015260668_100009813988 [1,1,0,0,0,0|2,0,0]=4 851 B9R0.20 CCC(C)(C)COCC=O 7a_100000765029_200015260668 [1,1,0,0,0,0|2,0,0]=4 852 B9R0.20 COC(C)(C)CNCC=O 2230a_100000763424_200015260668 [1,1,0,0,0,0|2,0,0]=4 853 B9R0.20 COC(C)(C)CSCC=O 62a_100000701081_200015260668 [1,1,0,0,0,0|2,0,0]=4 854 B9R0.20 COC(C)(C)CSCC=O 62a_200015260668_100000701081 [1,1,0,0,0,0|2,0,0]=4 855 B9R0.21 C=CC(=O)CC[N+](C)(C)C 1458a_100000185746_100000085578 [1,1,0,0,0,0|1,0,1]=4 856 B9R0.21 C=CC(C)SC[N+](C)(C)C 62a_100011215867_200000036245 [1,1,0,0,0,0|2,0,0]=4 857 B9R0.21 CC(CO)SC[N+](C)(C)C 62a_100012180447_200000036245 [1,1,0,0,0,0|1,0,1]=4 858 B9R0.21 C[C@H](CO)SC[N+](C)(C)C 62a_100016084084_200000036245 [1,1,0,0,0,0|1,0,1]=4 859 B9R0.21 C[C@H](CO)SC[N+](C)(C)C 62a_200000036245_100016084084 [1,1,0,0,0,0|1,0,1]=4 860 B9R0.21 C[N+](C)(C)CCC(=O)CO 1458a_100000210174_100000085578 [1,1,0,0,0,0|0,0,2]=4 861 B9R0.38 C#CCCSC[N+](C)(C)C 62a_100000688953_200000036245 [1,1,0,0,0,0|1,0,1]=4 862 B9R0.38 C#CCCSC[N+](C)(C)C 62a_200000036245_100000688953 [1,1,0,0,0,0|1,0,1]=4 863 B9R0.38 C#CCNCC[N+](C)(C)C 34a_100000212058_100000085578 [1,1,0,0,0,0|1,0,1]=4 864 B9R0.38 C#CCOCC[N+](C)(C)C 34a_100000210247_100000085578 [1,1,0,0,0,0|1,0,1]=4 865 B9R0.38 C#CCOCC[N+](C)(C)C 7a_200020618287_100000038162 [1,1,0,0,0,0|1,0,1]=4 866 B9R0.38 C#CCSCC[N+](C)(C)C 62a_100000038162_100000085578 [1,1,0,0,0,0|1,0,1]=4 867 B9R0.38 C/C=C/CSC[N+](C)(C)C 62a_100102629194_200000036245 [1,1,0,0,0,0|1,0,1]=4 868 B9R0.38 C/C=C/CSC[N+](C)(C)C 62a_200000036245_100102629194 [1,1,0,0,0,0|1,0,1]=4 869 B9R0.38 C=CCCCNC(C)(C)C 2230a_100000715429_100011713584 [1,1,0,0,0,0|2,0,0]=4 870 B9R0.38 C=CCCCNC(C)(C)C 34a_100000700776_100000210625 [1,1,0,0,0,0|2,0,0]=4 871 B9R0.38 C=CCCCOC(C)(C)C 34a_100000758997_100000210625 [1,1,0,0,0,0|2,0,0]=4 872 B9R0.38 C=CCCCOC(C)(C)C 34a_100015890283_100000757094 [1,1,0,0,0,0|2,0,0]=4 873 B9R0.38 C=CCCCOC(C)(C)C 7a_100015890283_100000757094 [1,1,0,0,0,0|2,0,0]=4 874 B9R0.38 C=CCCCSC(C)(C)C 62a_100000211941_100000757094 [1,1,0,0,0,0|2,0,0]=4 875 B9R0.38 C=CCCCSC(C)(C)C 62a_100011713584_100000211941 [1,1,0,0,0,0|2,0,0]=4 876 B9R0.38 C=CCCNCC(C)(C)C 2230a_100000743828_100000754431 [1,1,0,0,0,0|2,0,0]=4 877 B9R0.38 C=CCCNCC(C)(C)C 270004a_100015191253_100011204126 [1,1,0,0,0,0|2,0,0]=4 878 B9R0.38 C=CCCNC[Si](C)(C)C 2230a_100015191253_100000037933 [1,1,0,0,0,0|2,0,0]=4 879 B9R0.38 C=CCCOCC(C)(C)C 34a_100011205117_100011219605 [1,1,0,0,0,0|2,0,0]=4 880 B9R0.38 C=CCCSCC(C)(C)C 62a_100000754431_100011219605 [1,1,0,0,0,0|2,0,0]=4 881 B9R0.38 C=CCCSCC(C)(C)C 62a_100011219605_100000754431 [1,1,0,0,0,0|2,0,0]=4 882 B9R0.38 C=CCCSC[N+](C)(C)C 62a_100000754431_200000036245 [1,1,0,0,0,0|1,0,0]=3 883 B9R0.38 C=CCCSC[N+](C)(C)C 62a_200000036245_100000754431 [1,1,0,0,0,0|1,0,0]=3 884 B9R0.38 C=CCCSC[Si](C)(C)C 62a_100000037933_100000754431 [1,1,0,0,0,0|2,0,0]=4 885 B9R0.38 C=CCCSC[Si](C)(C)C 62a_100000754431_100000037933 [1,1,0,0,0,0|2,0,0]=4 886 B9R0.38 C=CCNCCC(C)(C)C 2230a_100000738805_100000210623 [1,1,0,0,0,0|2,0,0]=4 887 B9R0.38 C=CCNCCC(C)(C)C 2230a_100020586998_100000755188 [1,1,0,0,0,0|2,0,0]=4 888 B9R0.38 C=CCNCC[Si](C)(C)C 2230a_100020586998_200000733723 [1,1,0,0,0,0|2,0,0]=4 889 B9R0.38 C=CCOCCC(C)(C)C 34a_200000210373_100000755188 [1,1,0,0,0,0|2,0,0]=4 890 B9R0.38 C=CCOCCC(C)(C)C 7a_100000765024_100015514636 [1,1,0,0,0,0|2,0,0]=4 891 B9R0.38 C=CCOCC[N+](C)(C)C 34a_200000210373_100000085578 [1,1,0,0,0,0|1,0,0]=3 892 B9R0.38 C=CCOCC[N+](C)(C)C 7a_200020618287_100015514636 [1,1,0,0,0,0|1,0,0]=3 893 B9R0.38 C=CCOCC[Si](C)(C)C 34a_200000210373_200000733723 [1,1,0,0,0,0|2,0,0]=4 894 B9R0.38 C=CCOCC[Si](C)(C)C 7a_100000039746_100015514636 [1,1,0,0,0,0|2,0,0]=4 895 B9R0.38 C=CCSCCC(C)(C)C 62a_100000210623_100000755188 [1,1,0,0,0,0|2,0,0]=4 896 B9R0.38 C=CCSCCC(C)(C)C 62a_100000755188_100000210623 [1,1,0,0,0,0|2,0,0]=4 897 B9R0.38 C=CCSCC[N+](C)(C)C 62a_100000085578_100000210623 [1,1,0,0,0,0|1,0,0]=3 898 B9R0.38 C=CCSCC[N+](C)(C)C 62a_100000210623_100000085578 [1,1,0,0,0,0|1,0,0]=3 899 B9R0.38 C=CCSCC[Si](C)(C)C 62a_100000210623_200000733723 [1,1,0,0,0,0|2,0,0]=4 900 B9R0.38 C=CCSCC[Si](C)(C)C 62a_200000733723_100000210623 [1,1,0,0,0,0|2,0,0]=4 901 B9R0.38 CC(C)(C)CCNCC=O 2230a_100000738805_200015260668 [1,1,0,0,0,0|1,0,0]=3 902 B9R0.38 CC(C)(C)CCNCCO 2230a_100000738805_100000211926 [1,1,0,0,0,0|1,0,1]=4 903 B9R0.38 CC(C)(C)CCNCCO 2230a_100016997473_100000755188 [1,1,0,0,0,0|1,0,1]=4 904 B9R0.38 CC(C)(C)CCNCCO 34a_100016990907_100000755188 [1,1,0,0,0,0|1,0,1]=4 905 B9R0.38 CC(C)(C)CCOCC=O 7a_100000765024_200015260668 [1,1,0,0,0,0|1,0,0]=3 906 B9R0.38 CC(C)(C)CCOCCO 7a_100000765024_100000211926 [1,1,0,0,0,0|1,0,1]=4 907 B9R0.38 CC(C)(C)CCSCC=O 62a_100000755188_200015260668 [1,1,0,0,0,0|1,0,0]=3 908 B9R0.38 CC(C)(C)CCSCC=O 62a_200015260668_100000755188 [1,1,0,0,0,0|1,0,0]=3 909 B9R0.38 CC(C)(C)CCSCCO 62a_100000211926_100000755188 [1,1,0,0,0,0|1,0,1]=4 910 B9R0.38 CC(C)(C)CCSCCO 62a_100000755188_100000211926 [1,1,0,0,0,0|1,0,1]=4 911 B9R0.38 CC(C)(C)CNCCCO 2230a_100000743828_100000230001 [1,1,0,0,0,0|1,0,1]=4 912 B9R0.38 CC(C)(C)CNCCCO 270004a_100000182051_100011204126 [1,1,0,0,0,0|1,0,1]=4 913 B9R0.38 CC(C)(C)CSCCCO 62a_100011215043_100011219605 [1,1,0,0,0,0|1,0,1]=4 914 B9R0.38 CC(C)(C)CSCCCO 62a_100011219605_100011215043 [1,1,0,0,0,0|1,0,1]=4 915 B9R0.38 CC(C)(C)NCCCC=O 2230a_100000715429_200011292268 [1,1,0,0,0,0|1,0,0]=3 916 B9R0.38 CC(C)(C)NCCCCO 2230a_100000715429_100000210776 [1,1,0,0,0,0|1,0,1]=4 917 B9R0.38 CC(C)(C)NCCCCO 34a_100000750430_100000210625 [1,1,0,0,0,0|1,0,1]=4 918 B9R0.38 CC(C)(C)OCCCC=O 7a_100015890283_200011292268 [1,1,0,0,0,0|1,0,0]=3 919 B9R0.38 CC(C)(C)OCCCCO 34a_100015890283_100011216708 [1,1,0,0,0,0|1,0,1]=4 920 B9R0.38 CC(C)(C)OCCCCO 7a_100015890283_100000210776 [1,1,0,0,0,0|1,0,1]=4 921 B9R0.38 CC(C)(C)SCCCC=O 62a_100000211941_200011292268 [1,1,0,0,0,0|1,0,0]=3 922 B9R0.38 CC(C)(C)SCCCC=O 62a_200011292268_100000211941 [1,1,0,0,0,0|1,0,0]=3 923 B9R0.38 CC(C)(C)SCCCCO 62a_100000210776_100000211941 [1,1,0,0,0,0|1,0,1]=4 924 B9R0.38 CC(C)(C)SCCCCO 62a_100000211941_100000210776 [1,1,0,0,0,0|1,0,1]=4 925 B9R0.38 CC(C)(F)CCNCC=O 2230a_100016253952_200015260668 [1,1,0,0,0,0|2,0,0]=4 926 B9R0.38 CC(C)(O)CCSCC=O 62a_100000702414_200015260668 [1,1,0,0,0,0|2,0,0]=4 927 B9R0.38 CC(C)(O)CCSCC=O 62a_200015260668_100000702414 [1,1,0,0,0,0|2,0,0]=4 928 B9R0.38 CC=CCSC[N+](C)(C)C 62a_100000070051_200000036245 [1,1,0,0,0,0|1,0,1]=4 929 B9R0.38 CC=CCSC[N+](C)(C)C 62a_200000036245_100000070051 [1,1,0,0,0,0|1,0,1]=4 930 B9R0.38 CCCCSC[N+](C)(C)C 62a_100000210211_200000036245 [1,1,0,0,0,0|1,0,1]=4 931 B9R0.38 CCCCSC[N+](C)(C)C 62a_200000036245_100000210210 [1,1,0,0,0,0|1,0,1]=4 932 B9R0.38 CCCOCC[N+](C)(C)C 34a_100000210258_100000085578 [1,1,0,0,0,0|1,0,1]=4 933 B9R0.38 CCCOCC[N+](C)(C)C 7a_200020618287_100000210303 [1,1,0,0,0,0|1,0,1]=4 934 B9R0.38 CCCSCC[N+](C)(C)C 62a_100000085578_100000210303 [1,1,0,0,0,0|1,0,1]=4 935 B9R0.38 CCCSCC[N+](C)(C)C 62a_100000210303_100000085578 [1,1,0,0,0,0|1,0,1]=4 936 B9R0.38 CCNCCC[N+](C)(C)C 2230a_100015525214_100016990835 [1,1,0,0,0,0|1,0,1]=4 937 B9R0.38 CCOCCC[N+](C)(C)C 34a_100121572206_100016990835 [1,1,0,0,0,0|1,0,1]=4 938 B9R0.38 CCSCCC[N+](C)(C)C 62a_100000210202_100016990835 [1,1,0,0,0,0|1,0,1]=4 939 B9R0.38 CCSCCC[N+](C)(C)C 62a_100016990835_100000210202 [1,1,0,0,0,0|1,0,1]=4 940 B9R0.38 COCCCC[Si](C)(C)C 7a_200009881916_200000210301 [1,1,0,0,0,0|1,0,1]=4 941 B9R0.38 COCCSC[N+](C)(C)C 62a_100000233755_200000036245 [1,1,0,0,0,0|1,0,1]=4 942 B9R0.38 COCCSC[N+](C)(C)C 62a_200000036245_100000233755 [1,1,0,0,0,0|1,0,1]=4 943 B9R0.38 COCSCC[N+](C)(C)C 62a_100000085578_100000766300 [1,1,0,0,0,0|1,0,1]=4 944 B9R0.38 COCSCC[N+](C)(C)C 62a_100000766300_100000085578 [1,1,0,0,0,0|1,0,1]=4 945 B9R0.38 CSCCSC[N+](C)(C)C 62a_100000212216_200000036245 [1,1,0,0,0,0|2,0,0]=4 946 B9R0.38 CSCCSC[N+](C)(C)C 62a_200000036245_100000751147 [1,1,0,0,0,0|2,0,0]=4 947 B9R0.38 CSCSCC[N+](C)(C)C 62a_100000085578_100011218213 [1,1,0,0,0,0|2,0,0]=4 948 B9R0.38 CSCSCC[N+](C)(C)C 62a_100011218213_100000085578 [1,1,0,0,0,0|2,0,0]=4 949 B9R0.38 C[N+](C)(C)CCCSCF 62a_100015361967_100016990835 [1,1,0,0,0,0|1,0,1]=4 950 B9R0.38 C[N+](C)(C)CCCSCF 62a_100016990835_100015361967 [1,1,0,0,0,0|1,0,1]=4 951 B9R0.38 C[N+](C)(C)CCNCCF 34a_100000724931_100000085578 [1,1,0,0,0,0|1,0,1]=4 952 B9R0.38 C[N+](C)(C)CCNCCO 34a_100016990907_100000085578 [1,1,0,0,0,0|0,0,1]=3 953 B9R0.38 C[N+](C)(C)CCOCC#N 7a_200020618287_100011215382 [1,1,0,0,0,0|1,0,1]=4 954 B9R0.38 C[N+](C)(C)CCOCC=O 7a_200020618287_200015260668 [1,1,0,0,0,0|0,0,0]=2 955 B9R0.38 C[N+](C)(C)CCOCCBr 34a_100000211926_100000085578 [1,1,0,0,0,0|1,0,1]=4 956 B9R0.38 C[N+](C)(C)CCOCCF 7a_200020618287_100011217306 [1,1,0,0,0,0|1,0,1]=4 957 B9R0.38 C[N+](C)(C)CCOCCN 34a_100000210304_100000085578 [1,1,0,0,0,0|1,0,1]=4 958 B9R0.38 C[N+](C)(C)CCOCCO 7a_200020618287_100000211926 [1,1,0,0,0,0|0,0,1]=3 959 B9R0.38 C[N+](C)(C)CCSCC#N 62a_100000085578_100011215382 [1,1,0,0,0,0|1,0,1]=4 960 B9R0.38 C[N+](C)(C)CCSCC#N 62a_100011215382_100000085578 [1,1,0,0,0,0|1,0,1]=4 961 B9R0.38 C[N+](C)(C)CCSCC=O 62a_100000085578_200015260668 [1,1,0,0,0,0|0,0,0]=2 962 B9R0.38 C[N+](C)(C)CCSCC=O 62a_200015260668_100000085578 [1,1,0,0,0,0|0,0,0]=2 963 B9R0.38 C[N+](C)(C)CCSCCF 62a_100000085578_100011217306 [1,1,0,0,0,0|1,0,1]=4 964 B9R0.38 C[N+](C)(C)CCSCCF 62a_100011217306_100000085578 [1,1,0,0,0,0|1,0,1]=4 965 B9R0.38 C[N+](C)(C)CCSCCO 62a_100000085578_100000211926 [1,1,0,0,0,0|0,0,1]=3 966 B9R0.38 C[N+](C)(C)CCSCCO 62a_100000211926_100000085578 [1,1,0,0,0,0|0,0,1]=3 967 B9R0.38 C[N+](C)(C)CSCCC#N 62a_100011215226_200000036245 [1,1,0,0,0,0|1,0,1]=4 968 B9R0.38 C[N+](C)(C)CSCCC#N 62a_200000036245_100011215226 [1,1,0,0,0,0|1,0,1]=4 969 B9R0.38 C[N+](C)(C)CSCCCF 62a_100011934791_200000036245 [1,1,0,0,0,0|1,0,1]=4 970 B9R0.38 C[N+](C)(C)CSCCCF 62a_200000036245_100011934791 [1,1,0,0,0,0|1,0,1]=4 971 B9R0.38 C[N+](C)(C)CSCCCO 62a_100011215043_200000036245 [1,1,0,0,0,0|0,0,1]=3 972 B9R0.38 C[N+](C)(C)CSCCCO 62a_200000036245_100011215043 [1,1,0,0,0,0|0,0,1]=3 973 B9R0.38 C[Si](C)(C)CCCCO[13CH3] 7a_200009881916_200025704644 [1,1,0,0,0,0|1,0,1]=4 974 B9R0.38 C[Si](C)(C)CCNCCO 2230a_100016997473_200000733723 [1,1,0,0,0,0|1,0,1]=4 975 B9R0.38 C[Si](C)(C)CCNCCO 34a_100016990907_200000733723 [1,1,0,0,0,0|1,0,1]=4 976 B9R0.38 C[Si](C)(C)CCOCC=O 7a_100000039746_200015260668 [1,1,0,0,0,0|1,0,0]=3 977 B9R0.38 C[Si](C)(C)CCOCCO 7a_100000039746_100000211926 [1,1,0,0,0,0|1,0,1]=4 978 B9R0.38 C[Si](C)(C)CCSCC=O 62a_200000733723_200015260668 [1,1,0,0,0,0|1,0,0]=3 979 B9R0.38 C[Si](C)(C)CCSCC=O 62a_200015260668_200000733723 [1,1,0,0,0,0|1,0,0]=3 980 B9R0.38 C[Si](C)(C)CCSCCO 62a_100000211926_200000733723 [1,1,0,0,0,0|1,0,1]=4 981 B9R0.38 C[Si](C)(C)CCSCCO 62a_200000733723_100000211926 [1,1,0,0,0,0|1,0,1]=4 982 B9R0.38 C[Si](C)(C)CSCCCO 62a_100000037933_100011215043 [1,1,0,0,0,0|1,0,1]=4 983 B9R0.38 C[Si](C)(C)CSCCCO 62a_100011215043_100000037933 [1,1,0,0,0,0|1,0,1]=4 984 B9R0.44 C=CCC(=O)C[N+](C)(C)C 1458a_100000033712_100000210623 [1,1,0,0,0,0|1,0,1]=4 985 B9R0.44 C=CCN(C)C[N+](C)(C)C 269982a_100000225617_200000036245 [1,1,0,0,0,0|2,0,0]=4 986 B9R0.44 CN(CC=O)CC(C)(C)C 2230a_100000742839_200015260668 [1,1,0,0,0,0|2,0,0]=4 987 B9R0.44 CN(CC=O)CC(C)(C)C 269982a_100000742839_200015260668 [1,1,0,0,0,0|2,0,0]=4 988 B9R0.44 CN(CC=O)C[Si](C)(C)C 269982a_200020589227_200015260668 [1,1,0,0,0,0|2,0,0]=4 989 B9R0.44 CN(CCO)C[N+](C)(C)C 269982a_100000210263_200000036245 [1,1,0,0,0,0|1,0,1]=4 990 B9R0.44 CNCC(O)C[N+](C)(C)C 2230a_106832991635_100000032816 [1,1,0,0,0,0|2,0,0]=4 991 B9R0.44 CNCC(O)C[N+](C)(C)C 34a_100102657272_100000032816 [1,1,0,0,0,0|2,0,0]=4 992 B9R0.44 CNCC(O)C[N+](C)(C)C 7a_106832991635_100000032816 [1,1,0,0,0,0|2,0,0]=4 993 B9R0.44 COCC(O)C[N+](C)(C)C 34a_100138415774_100000032816 [1,1,0,0,0,0|2,0,0]=4 994 B9R0.44 CSCC(O)C[N+](C)(C)C 62a_100000032816_200000210301 [1,1,0,0,0,0|2,0,0]=4 995 B9R0.44 CSCC(O)C[N+](C)(C)C 62a_200000210301_100000032816 [1,1,0,0,0,0|2,0,0]=4 996 B9R0.44 C[N+](C)(C)CC(=O)CCO 1458a_100000033712_100000211926 [1,1,0,0,0,0|0,0,2]=4 997 B9R0.44 C[N+](C)(C)CC(O)CS[13CH3] 62a_100000032816_200025704644 [1,1,0,0,0,0|2,0,0]=4 998 B9R0.44 C[N+](C)(C)CC(O)CS[13CH3] 62a_200025704644_100000032816 [1,1,0,0,0,0|2,0,0]=4 999 B9R0.1 C#CC(=O)CCCC(C)C 1458a_100000211873_100011214892 [1,1,0,0,0,0|2,0,0]=4 1000 B9R0.1 C#CC(=O)CCCN(C)C 1458a_100000211873_100000695564 [1,1,0,0,0,0|1,0,1]=4 1001 B9R0.1 C=CC(=O)CCCC(C)C 1458a_100000185746_100011214892 [1,1,0,0,0,0|2,0,0]=4 1002 B9R0.1 C=CC(=O)CCCN(C)C 1458a_100000185746_100000695564 [1,1,0,0,0,0|1,0,1]=4 1003 B9R0.1 CC(=CCCC(=O)CO)C 1458a_100000210174_100011217483 [1,1,0,0,0,0|1,0,1]=4 1004 B9R0.1 CC(=O)CCCC(=O)CO 1458a_100000210174_100011215641 [1,1,0,0,0,0|2,0,0]=4 1005 B9R0.1 CC(C)CCCC(=O)CF 1458a_100011216857_100015361967 [1,1,0,0,0,0|2,0,0]=4 1006 B9R0.1 CC(C)CCCC(=O)CO 1458a_100000210174_100011214892 [1,1,0,0,0,0|1,0,0]=3 1007 B9R0.1 CC(C)CCNC(=O)CO 240690a_100000210545_100000210174 [1,1,0,0,0,0|2,0,0]=4 1008 B9R0.1 CC(C)CCNC(=O)CO 527a_100000210545_100000210174 [1,1,0,0,0,0|2,0,0]=4 1009 B9R0.1 CC(C)OCCC(=O)CO 1458a_100000210174_100000211751 [1,1,0,0,0,0|2,0,0]=4 1010 B9R0.1 CC(C)SCCC(=O)CO 1458a_100000210174_100000730970 [1,1,0,0,0,0|2,0,0]=4 1011 B9R0.1 CC(CCCC(=O)[O-])O[13CH3] 7a_100000761597_200025704644 [1,1,0,0,0,0|1,0,1]=4 1012 B9R0.1 CC(O)CCCC(=O)CO 1458a_100000210174_200000718107 [1,1,0,0,0,0|2,0,0]=4 1013 B9R0.1 CCC(=O)CCCC(C)C 1458a_100000210414_100011214892 [1,1,0,0,0,0|2,0,0]=4 1014 B9R0.1 CCC(=O)CCCC(C)C 1458a_100011216857_100000210202 [1,1,0,0,0,0|2,0,0]=4 1015 B9R0.1 CCC(=O)CCCN(C)C 1458a_100000210414_100000695564 [1,1,0,0,0,0|1,0,1]=4 1016 B9R0.1 CCC(C)CNCC(=O)O 269956a_100016091260_100000748023 [1,1,0,0,0,0|2,0,0]=4 1017 B9R0.1 CCN(C)CCCC(=O)C 1458a_100000070787_100015186262 [1,1,0,0,0,0|1,0,1]=4 1018 B9R0.1 CCN(C)CCCC(=O)C 269982a_100000225621_100011215641 [1,1,0,0,0,0|1,0,1]=4 1019 B9R0.1 CCN(C)CCCC(=O)N 269982a_100000225621_100102525003 [1,1,0,0,0,0|1,0,1]=4 1020 B9R0.1 CCN(C)CCCC(=O)O 269956a_100000719178_100000210202 [1,1,0,0,0,0|0,0,1]=3 1021 B9R0.1 CC[C@H](C)CNCC(=O)O 269956a_100016091260_100009816398 [1,1,0,0,0,0|2,0,0]=4 1022 B9R0.1 CN(C)CCCC(=O)CO 1458a_100000210174_100000695564 [1,1,0,0,0,0|0,0,1]=3 1023 B9R0.1 CN(C)CCNC(=O)CO 240690a_100000210585_100000210174 [1,1,0,0,0,0|1,0,1]=4 1024 B9R0.1 CN(C)CCNC(=O)CO 527a_100000210585_100000210174 [1,1,0,0,0,0|1,0,1]=4 1025 B9R0.1 CN(CF)CCCC(=O)O 269956a_100000719178_100015361967 [1,1,0,0,0,0|0,0,1]=3 1026 B9R0.1 CNC(=O)CCCC(C)C 11a_106832991635_100011216857 [1,1,0,0,0,0|2,0,0]=4 1027 B9R0.1 CNC(=O)CCCC(C)C 1626a_100102657272_100011216857 [1,1,0,0,0,0|2,0,0]=4 1028 B9R0.1 CNC(=O)CCCC(C)C 240690a_100102657272_100011216857 [1,1,0,0,0,0|2,0,0]=4 1029 B9R0.1 CNC(=O)CCCC(C)C 527a_100102657272_100011216857 [1,1,0,0,0,0|2,0,0]=4 1030 B9R0.1 CNC(=O)CCCN(C)C 11a_106832991635_100000740757 [1,1,0,0,0,0|1,0,1]=4 1031 B9R0.1 CNC(=O)CCCN(C)C 2230a_100102631434_100000741757 [1,1,0,0,0,0|1,0,1]=4 1032 B9R0.1 CNC(=O)CCCN(C)C 240690a_100102657272_100000740757 [1,1,0,0,0,0|1,0,1]=4 1033 B9R0.1 CNC(=O)CCCN(C)C 269982a_100102631434_100000741757 [1,1,0,0,0,0|1,0,1]=4 1034 B9R0.1 COC(=O)CCCC(=O)C 1458a_100000070787_100011218270 [1,1,0,0,0,0|2,0,0]=4 1035 B9R0.1 COC(=O)CCCC(=O)C 1458a_100000239890_200000210301 [1,1,0,0,0,0|2,0,0]=4 1036 B9R0.1 COC(=O)CCCC(=O)[13CH3] 1458a_100000239890_200025704644 [1,1,0,0,0,0|2,0,0]=4 1037 B9R0.1 COC(=O)CCCN(C)C 2230a_100102631434_100011218270 [1,1,0,0,0,0|0,0,1]=3 1038 B9R0.1 COC(=O)CCCN(C)C 269982a_100000739225_200000210301 [1,1,0,0,0,0|0,0,1]=3 1039 B9R0.1 COC(=O)CCCN(C)C 269982a_100102631434_100011218270 [1,1,0,0,0,0|0,0,1]=3 1040 B9R0.1 COC(=O)CCCN(C)[13CH3] 269982a_100000739225_200025704644 [1,1,0,0,0,0|0,0,1]=3 1041 B9R0.1 COC(=O)CCNC(C)C 2230a_100138425928_100000204255 [1,1,0,0,0,0|2,0,0]=4 1042 B9R0.1 COC(=O)CCNC(C)C 34a_100138425928_100000742370 [1,1,0,0,0,0|2,0,0]=4 1043 B9R0.1 COC(=O)CCOC(C)C 34a_100000212225_100000742370 [1,1,0,0,0,0|2,0,0]=4 1044 B9R0.1 COC(=O)CCSC(C)C 62a_100000204255_100000210206 [1,1,0,0,0,0|2,0,0]=4 1045 B9R0.1 COC(=O)CCSC(C)C 62a_100000210206_100000204255 [1,1,0,0,0,0|2,0,0]=4 1046 B9R0.1 COC(=O)CNCC(C)C 2230a_100000210953_100000747449 [1,1,0,0,0,0|2,0,0]=4 1047 B9R0.1 COC(=O)CNCC(C)C 34a_100000210953_100000747449 [1,1,0,0,0,0|2,0,0]=4 1048 B9R0.1 COC(=O)COCC(C)C 34a_100000210257_100000747449 [1,1,0,0,0,0|2,0,0]=4 1049 B9R0.1 COC(=O)CSCC(C)C 62a_100000210624_100000747449 [1,1,0,0,0,0|2,0,0]=4 1050 B9R0.1 COC(=O)CSCC(C)C 62a_100000747449_100000210760 [1,1,0,0,0,0|2,0,0]=4 1051 B9R0.1 COC(C)CCCC(=O)[O-] 7a_100000761597_200000210301 [1,1,0,0,0,0|1,0,1]=4 1052 B9R0.1 C[C@@H](CO)CNCC(=O)O 269956a_100016091260_100000059175 [1,1,0,0,0,0|2,0,0]=4 1053 B9R0.7 CC(=O)C(C)CCC(C)C 1458a_100000070787_100011261404 [1,1,0,0,0,0|2,0,0]=4 1054 B9R0.7 CC(C)CN[C@@H](C)C(=O)O 269956a_100000743915_100000210760 [1,1,0,0,0,0|2,0,0]=4 1055 B9R0.7 CC(C)NCC(C)C(=O)O 269956a_100000749485_100000210206 [1,1,0,0,0,0|2,0,0]=4 1056 B9R0.7 CC(C)NCC(F)C(=O)O 269956a_100000084737_100000210206 [1,1,0,0,0,0|2,0,0]=4 1057 B9R0.53 CC(C)CN(C)CC(=O)O 269956a_100000746989_100000210760 [1,1,0,0,0,0|2,0,0]=4 1058 B9R0.10 CC(C)(C)N([13CH3])CC(=O)O 269956a_100000745166_200025704644 [0,1,0,0,1,0|2,0,0]=4 1059 B9R0.10 CN(CC(=O)O)C(C)(C)C 269956a_100000745166_200000210301 [0,1,0,0,1,0|2,0,0]=4 1060 B9R0.10 CN(CC(=O)O)C(C)(C)C 269956a_100000746989_100000211941 [0,1,0,0,1,0|2,0,0]=4 1061 B9R0.57 C[C@H](NC(C)(C)C)C(=O)O 269956a_100000743915_100000211941 [0,1,0,0,1,0|2,0,0]=4 1062 B9R0.64 CCC(C)(C)NCC(=O)O 269956a_100016091260_100000032637 [0,1,0,0,1,0|2,0,0]=4 1063 B11R0.34 C=C(C)CCC(=O)C[N+](C)(C)C 1458a_100000033712_100000730704 [0,1,0,0,0,1|2,0,0]=4 1064 B11R0.34 CC(=O)CCN(C)CC(C)(C)C 269982a_100000742839_100000053229 [0,1,0,0,0,1|2,0,0]=4 1065 B11R0.34 CC(=O)CCN(C)C[Si](C)(C)C 269982a_200020589227_100000053229 [0,1,0,0,0,1|2,0,0]=4 1066 B11R0.34 CC(CC(C)(C)C)OCC(=O)N 7a_200011218616_100000187820 [0,1,0,0,0,1|2,0,0]=4 1067 B11R0.34 CC(O)CCC(=O)C[N+](C)(C)C 1458a_100000033712_100012276601 [0,1,0,0,0,1|1,0,1]=4 1068 B11R0.34 CN(CCC(=O)N)CC(C)(C)C 2230a_100000742839_100000744528 [0,1,0,0,0,1|2,0,0]=4 1069 B11R0.34 CN(CCC(=O)N)CC(C)(C)C 269982a_100000742839_100000744528 [0,1,0,0,0,1|2,0,0]=4 1070 B11R0.34 CN(CCC(=O)N)CC(C)(C)C 270004a_100000730477_100011204126 [0,1,0,0,0,1|2,0,0]=4 1071 B11R0.34 CN(CCC(=O)N)C[Si](C)(C)C 2230a_100000730477_100000037933 [0,1,0,0,0,1|2,0,0]=4 1072 B11R0.34 CN(CCC(=O)N)C[Si](C)(C)C 269982a_200020589227_100000744528 [0,1,0,0,0,1|2,0,0]=4 1073 B11R0.34 C[C@@H](CC(C)(C)C)NCC(=O)N 2230a_106358413534_100000747473 [0,1,0,0,0,1|2,0,0]=4 1074 B11R0.34 C[N+](C)(C)CC(=O)NCC(=O)N 11a_100000711301_100000033712 [0,1,0,0,0,1|1,0,1]=4 1075 B11R0.34 C[N+](C)(C)CC(=O)NCC(=O)N 240690a_100000711301_100000033712 [0,1,0,0,0,1|1,0,1]=4 1076 B11R0.34 C[N+](C)(C)CC(=O)NCC(=O)N 527a_100000711301_100000033712 [0,1,0,0,0,1|1,0,1]=4 1077 B11R0.34 C[Si](C)(C)CC(=O)CCC(=O)N 1458a_100011215257_100000233785 [0,1,0,0,0,1|2,0,0]=4 1078 B11R0.84 CC(=O)CCCC(=O)C(C)(C)C 1458a_106744555173_100011215641 [0,1,0,0,0,1|2,0,0]=4 1079 B11R0.84 CC(=O)CCCN(C)C(C)(C)C 269982a_100011215553_100011215641 [0,1,0,0,0,1|2,0,0]=4 1080 B11R0.84 CC(C)(C)C(=O)CCCC(=O)N 1458a_106744555173_100102525003 [0,1,0,0,0,1|2,0,0]=4 1081 B11R0.84 CC(C)(C)C(=O)CNCC(=O)O 269956a_100016091260_100000210923 [0,1,0,0,0,1|1,0,1]=4 1082 B11R0.84 CN(CCCC(=O)N)C(C)(C)C 269982a_100011215553_100102525003 [0,1,0,0,0,1|2,0,0]=4 1083 B11R0.84 CN(CCCC(=O)O)C(C)(C)C 269956a_100000719178_100000211941 [0,1,0,0,0,1|1,0,0]=3 1084 B11R0.84 C[C@@H](NCCC(=O)N)C(C)(C)C 2230a_100025703359_100000744528 [0,1,0,0,0,1|2,0,0]=4 1085 B11R0.114 C#CC(=O)COCC[Si](C)(C)C 1458a_100000211873_100000032501 [0,1,0,0,0,1|2,0,0]=4 1086 B11R0.114 C=C(C#N)CSCC[N+](C)(C)C 62a_100000085578_100000694840 [0,1,0,0,0,1|2,0,0]=4 1087 B11R0.114 C=CC(=O)COCC[Si](C)(C)C 1458a_100000185746_100000032501 [0,1,0,0,0,1|2,0,0]=4 1088 B11R0.114 C=CC(=O)NCCC[Si](C)(C)C 1626a_100000725946_100000185746 [0,1,0,0,0,1|2,0,0]=4 1089 B11R0.114 C=CC(=O)NCCC[Si](C)(C)C 240690a_100000725946_200121576911 [0,1,0,0,0,1|2,0,0]=4 1090 B11R0.114 C=CC(O)COCC[N+](C)(C)C 7a_200020618287_100000730141 [0,1,0,0,0,1|1,0,1]=4 1091 B11R0.114 C=CC(O)CSCC[N+](C)(C)C 62a_100000085578_100000730141 [0,1,0,0,0,1|1,0,1]=4 1092 B11R0.114 C=CC(O)CSCC[N+](C)(C)C 62a_100000730141_100000085578 [0,1,0,0,0,1|1,0,1]=4 1093 B11R0.114 CC(C)(C)COCCC(=NO)N 34a_100000749954_100011219605 [0,1,0,0,0,1|2,0,0]=4 1094 B11R0.114 CC(C)(C)OCCCC(=O)NN 34a_100000211488_100000210625 [0,1,0,0,0,1|2,0,0]=4 1095 B11R0.114 CC(C)(C)OCCNC(=O)CO 240690a_100000747557_100000210174 [0,1,0,0,0,1|2,0,0]=4 1096 B11R0.114 CC(C)(C)OCCNC(=O)CO 527a_100000747557_100000210174 [0,1,0,0,0,1|2,0,0]=4 1097 B11R0.114 CC(C)(C)SCCNC(=O)CO 240690a_100000689375_100000210174 [0,1,0,0,0,1|2,0,0]=4 1098 B11R0.114 CC(C)(C)SCCNC(=O)CO 527a_100000689375_100000210174 [0,1,0,0,0,1|2,0,0]=4 1099 B11R0.114 CC(CO)CNCC[N+](C)(C)C 34a_100000744482_100000085578 [0,1,0,0,0,1|1,0,1]=4 1100 B11R0.114 CC(CO)SCCC[N+](C)(C)C 62a_100012180447_100016990835 [0,1,0,0,0,1|1,0,1]=4 1101 B11R0.114 CCC(=O)COCCC(C)(C)C 34a_100000725409_100000755188 [0,1,0,0,0,1|2,0,0]=4 1102 B11R0.114 CCC(=O)COCCC(C)(C)C 7a_100000765024_100000747405 [0,1,0,0,0,1|2,0,0]=4 1103 B11R0.114 CCC(=O)COCC[N+](C)(C)C 34a_100000725409_100000085578 [0,1,0,0,0,1|1,0,0]=3 1104 B11R0.114 CCC(=O)COCC[N+](C)(C)C 7a_200020618287_100000747405 [0,1,0,0,0,1|1,0,0]=3 1105 B11R0.114 CCC(=O)COCC[Si](C)(C)C 1458a_100000210414_100000032501 [0,1,0,0,0,1|2,0,0]=4 1106 B11R0.114 CCC(=O)COCC[Si](C)(C)C 34a_100000725409_200000733723 [0,1,0,0,0,1|2,0,0]=4 1107 B11R0.114 CCC(=O)COCC[Si](C)(C)C 7a_100000039746_100000747405 [0,1,0,0,0,1|2,0,0]=4 1108 B11R0.114 CCC(=O)CSCCC(C)(C)C 62a_100000747405_100000755188 [0,1,0,0,0,1|2,0,0]=4 1109 B11R0.114 CCC(=O)CSCCC(C)(C)C 62a_100000755188_100000747405 [0,1,0,0,0,1|2,0,0]=4 1110 B11R0.114 CCC(=O)CSCC[N+](C)(C)C 62a_100000085578_100000747405 [0,1,0,0,0,1|1,0,0]=3 1111 B11R0.114 CCC(=O)CSCC[N+](C)(C)C 62a_100000747405_100000085578 [0,1,0,0,0,1|1,0,0]=3 1112 B11R0.114 CCC(=O)CSCC[Si](C)(C)C 62a_100000747405_200000733723 [0,1,0,0,0,1|2,0,0]=4 1113 B11R0.114 CCC(=O)CSCC[Si](C)(C)C 62a_200000733723_100000747405 [0,1,0,0,0,1|2,0,0]=4 1114 B11R0.114 CCC(=O)NCCC[Si](C)(C)C 1626a_100000725946_100000210414 [0,1,0,0,0,1|2,0,0]=4 1115 B11R0.114 CCC(=O)NCCC[Si](C)(C)C 240690a_100000725946_100000210414 [0,1,0,0,0,1|2,0,0]=4 1116 B11R0.114 CCC(=O)NCCC[Si](C)(C)C 527a_100000725946_100000210414 [0,1,0,0,0,1|2,0,0]=4 1117 B11R0.114 CCC(O)COCC[N+](C)(C)C 7a_200020618287_100011218378 [0,1,0,0,0,1|1,0,1]=4 1118 B11R0.114 CCC(O)CSCC[N+](C)(C)C 62a_100000085578_100011218378 [0,1,0,0,0,1|1,0,1]=4 1119 B11R0.114 CCC(O)CSCC[N+](C)(C)C 62a_100011218378_100000085578 [0,1,0,0,0,1|1,0,1]=4 1120 B11R0.114 CNC(=O)CCCNC(C)(C)C 2230a_100000715429_100000741757 [0,1,0,0,0,1|2,0,0]=4 1121 B11R0.114 CNC(=O)CCCNC(C)(C)C 34a_100000740002_100000210625 [0,1,0,0,0,1|2,0,0]=4 1122 B11R0.114 CNC(=O)CCCOC(C)(C)C 34a_100015890283_100000741757 [0,1,0,0,0,1|2,0,0]=4 1123 B11R0.114 CNC(=O)CCCOC(C)(C)C 7a_100015890283_100000741757 [0,1,0,0,0,1|2,0,0]=4 1124 B11R0.114 CNC(=O)CCCSC(C)(C)C 62a_100000211941_100000741757 [0,1,0,0,0,1|2,0,0]=4 1125 B11R0.114 CNC(=O)CCCSC(C)(C)C 62a_100000741757_100000211941 [0,1,0,0,0,1|2,0,0]=4 1126 B11R0.114 CNC(=O)CCNCC(C)(C)C 2230a_100000743828_100000737683 [0,1,0,0,0,1|2,0,0]=4 1127 B11R0.114 CNC(=O)CCNCC(C)(C)C 270004a_100000738227_100011204126 [0,1,0,0,0,1|2,0,0]=4 1128 B11R0.114 CNC(=O)CCNCC(C)(C)C 34a_100000738227_100011219605 [0,1,0,0,0,1|2,0,0]=4 1129 B11R0.114 CNC(=O)CCNC[Si](C)(C)C 2230a_100000738227_100000037933 [0,1,0,0,0,1|2,0,0]=4 1130 B11R0.114 CNC(=O)CCOCC(C)(C)C 34a_100000754576_100011219605 [0,1,0,0,0,1|2,0,0]=4 1131 B11R0.114 CNC(=O)CCSCC(C)(C)C 62a_100000737683_100011219605 [0,1,0,0,0,1|2,0,0]=4 1132 B11R0.114 CNC(=O)CCSCC(C)(C)C 62a_100011219605_100000737683 [0,1,0,0,0,1|2,0,0]=4 1133 B11R0.114 CNC(=O)CCSC[N+](C)(C)C 62a_100000737683_200000036245 [0,1,0,0,0,1|1,0,0]=3 1134 B11R0.114 CNC(=O)CCSC[N+](C)(C)C 62a_200000036245_100000737683 [0,1,0,0,0,1|1,0,0]=3 1135 B11R0.114 CNC(=O)CCSC[Si](C)(C)C 62a_100000037933_100000737683 [0,1,0,0,0,1|2,0,0]=4 1136 B11R0.114 CNC(=O)CCSC[Si](C)(C)C 62a_100000737683_100000037933 [0,1,0,0,0,1|2,0,0]=4 1137 B11R0.114 CNC(=O)CNCCC(C)(C)C 2230a_100000693194_100000755188 [0,1,0,0,0,1|2,0,0]=4 1138 B11R0.114 CNC(=O)CNCCC(C)(C)C 2230a_100000738805_100000183359 [0,1,0,0,0,1|2,0,0]=4 1139 B11R0.114 CNC(=O)CNCC[Si](C)(C)C 2230a_100000693194_200000733723 [0,1,0,0,0,1|2,0,0]=4 1140 B11R0.114 CNC(=O)COCCC(C)(C)C 34a_100000750040_100000755188 [0,1,0,0,0,1|2,0,0]=4 1141 B11R0.114 CNC(=O)COCCC(C)(C)C 7a_100000765024_100000183359 [0,1,0,0,0,1|2,0,0]=4 1142 B11R0.114 CNC(=O)COCC[N+](C)(C)C 34a_100000750040_100000085578 [0,1,0,0,0,1|1,0,0]=3 1143 B11R0.114 CNC(=O)COCC[N+](C)(C)C 7a_200020618287_100000183359 [0,1,0,0,0,1|1,0,0]=3 1144 B11R0.114 CNC(=O)COCC[Si](C)(C)C 34a_100000750040_200000733723 [0,1,0,0,0,1|2,0,0]=4 1145 B11R0.114 CNC(=O)COCC[Si](C)(C)C 7a_100000039746_100000183359 [0,1,0,0,0,1|2,0,0]=4 1146 B11R0.114 CNC(=O)CSCCC(C)(C)C 62a_100000183359_100000755188 [0,1,0,0,0,1|2,0,0]=4 1147 B11R0.114 CNC(=O)CSCCC(C)(C)C 62a_100000755188_100000183359 [0,1,0,0,0,1|2,0,0]=4 1148 B11R0.114 CNC(=O)CSCC[N+](C)(C)C 62a_100000085578_100000183359 [0,1,0,0,0,1|1,0,0]=3 1149 B11R0.114 CNC(=O)CSCC[N+](C)(C)C 62a_100000183359_100000085578 [0,1,0,0,0,1|1,0,0]=3 1150 B11R0.114 CNC(=O)CSCC[Si](C)(C)C 62a_100000183359_200000733723 [0,1,0,0,0,1|2,0,0]=4 1151 B11R0.114 CNC(=O)CSCC[Si](C)(C)C 62a_200000733723_100000183359 [0,1,0,0,0,1|2,0,0]=4 1152 B11R0.114 CNC(=O)NCCC[Si](C)(C)C 2708a_100000725946_106832991635 [0,1,0,0,0,1|2,0,0]=4 1153 B11R0.114 CNC(=O)NCCC[Si](C)(C)C 2708a_100102657272_100000725946 [0,1,0,0,0,1|2,0,0]=4 1154 B11R0.114 CNC(=O)NCCC[Si](C)(C)C 273464a_100000725946_100102657272 [0,1,0,0,0,1|2,0,0]=4 1155 B11R0.114 CNC(=O)NCCC[Si](C)(C)C 273464a_100102657272_100000725946 [0,1,0,0,0,1|2,0,0]=4 1156 B11R0.114 CNC(=O)NCCC[Si](C)(C)C 512a_100000725946_100102657272 [0,1,0,0,0,1|2,0,0]=4 1157 B11R0.114 CNC(=O)NCCC[Si](C)(C)C 512a_106832991638_100000725946 [0,1,0,0,0,1|2,0,0]=4 1158 B11R0.114 COC(=O)CCCNC(C)(C)C 2230a_100000715429_100011218270 [0,1,0,0,0,1|1,0,0]=3 1159 B11R0.114 COC(=O)CCCOC(C)(C)C 34a_100015890283_100000742333 [0,1,0,0,0,1|1,0,0]=3 1160 B11R0.114 COC(=O)CCCOC(C)(C)C 7a_100015890283_100011218270 [0,1,0,0,0,1|1,0,0]=3 1161 B11R0.114 COC(=O)CCCSC(C)(C)C 62a_100000211941_100011218270 [0,1,0,0,0,1|1,0,0]=3 1162 B11R0.114 COC(=O)CCCSC(C)(C)C 62a_100011218270_100000211941 [0,1,0,0,0,1|1,0,0]=3 1163 B11R0.114 COC(=O)CCNCC(C)(C)C 2230a_100000743828_100000204255 [0,1,0,0,0,1|1,0,0]=3 1164 B11R0.114 COC(=O)CCNCC(C)(C)F 2230a_100020643315_100000204255 [0,1,0,0,0,1|2,0,0]=4 1165 B11R0.114 COC(=O)CCNCC(C)(C)O 2230a_100000751335_100000204255 [0,1,0,0,0,1|2,0,0]=4 1166 B11R0.114 COC(=O)CCOCC(C)(C)F 34a_100000716592_100000742370 [0,1,0,0,0,1|2,0,0]=4 1167 B11R0.114 COC(=O)CCSCC(C)(C)C 62a_100000204255_100011219605 [0,1,0,0,0,1|1,0,0]=3 1168 B11R0.114 COC(=O)CCSCC(C)(C)C 62a_100011219605_100000204255 [0,1,0,0,0,1|1,0,0]=3 1169 B11R0.114 COC(=O)CCSCC(C)(C)F 62a_100000204255_100011997219 [0,1,0,0,0,1|2,0,0]=4 1170 B11R0.114 COC(=O)CCSCC(C)(C)F 62a_100011997219_100000204255 [0,1,0,0,0,1|2,0,0]=4 1171 B11R0.114 COC(=O)CCSCC(C)(C)O 62a_100000204255_100000764493 [0,1,0,0,0,1|2,0,0]=4 1172 B11R0.114 COC(=O)CCSCC(C)(C)O 62a_100000764493_100000204255 [0,1,0,0,0,1|2,0,0]=4 1173 B11R0.114 COC(=O)CCSC[N+](C)(C)C 62a_100000204255_200000036245 [0,1,0,0,0,1|0,0,0]=2 1174 B11R0.114 COC(=O)CCSC[N+](C)(C)C 62a_200000036245_100000204255 [0,1,0,0,0,1|0,0,0]=2 1175 B11R0.114 COC(=O)CCSC[Si](C)(C)C 62a_100000037933_100000204255 [0,1,0,0,0,1|1,0,0]=3 1176 B11R0.114 COC(=O)CCSC[Si](C)(C)C 62a_100000204255_100000037933 [0,1,0,0,0,1|1,0,0]=3 1177 B11R0.114 COC(=O)CNCCC(C)(C)C 2230a_100000738805_100000747449 [0,1,0,0,0,1|1,0,0]=3 1178 B11R0.114 COC(=O)CNCCC(C)(C)F 2230a_100016253952_100000747449 [0,1,0,0,0,1|2,0,0]=4 1179 B11R0.114 COC(=O)COCCC(C)(C)C 7a_100000765024_100000747449 [0,1,0,0,0,1|1,0,0]=3 1180 B11R0.114 COC(=O)COCC[N+](C)(C)C 7a_200020618287_100000747449 [0,1,0,0,0,1|0,0,0]=2 1181 B11R0.114 COC(=O)COCC[Si](C)(C)C 7a_100000039746_100000747449 [0,1,0,0,0,1|1,0,0]=3 1182 B11R0.114 COC(=O)CSCCC(C)(C)C 62a_100000747449_100000755188 [0,1,0,0,0,1|1,0,0]=3 1183 B11R0.114 COC(=O)CSCCC(C)(C)C 62a_100000755188_100000747449 [0,1,0,0,0,1|1,0,0]=3 1184 B11R0.114 COC(=O)CSCCC(C)(C)O 62a_100000702414_100000747449 [0,1,0,0,0,1|2,0,0]=4 1185 B11R0.114 COC(=O)CSCCC(C)(C)O 62a_100000747449_100000702414 [0,1,0,0,0,1|2,0,0]=4 1186 B11R0.114 COC(=O)CSCC[N+](C)(C)C 62a_100000085578_100000747449 [0,1,0,0,0,1|0,0,0]=2 1187 B11R0.114 COC(=O)CSCC[N+](C)(C)C 62a_100000747449_100000085578 [0,1,0,0,0,1|0,0,0]=2 1188 B11R0.114 COC(=O)CSCC[Si](C)(C)C 62a_100000747449_200000733723 [0,1,0,0,0,1|1,0,0]=3 1189 B11R0.114 COC(=O)CSCC[Si](C)(C)C 62a_200000733723_100000747449 [0,1,0,0,0,1|1,0,0]=3 1190 B11R0.114 COC(=O)NCCOC(C)(C)C 34a_100000757965_100000210625 [0,1,0,0,0,1|2,0,0]=4 1191 B11R0.114 COC(=O)OCCOC(C)(C)C 34a_100010262106_100000210625 [0,1,0,0,0,1|2,0,0]=4 1192 B11R0.114 COC(=O)OCSCC(C)(C)C 62a_100011219605_100000139417 [0,1,0,0,0,1|2,0,0]=4 1193 B11R0.114 COC(=O)OCSC[N+](C)(C)C 62a_200000036245_100000139417 [0,1,0,0,0,1|1,0,0]=3 1194 B11R0.114 COC(=O)OCSC[Si](C)(C)C 62a_100000037933_100000139417 [0,1,0,0,0,1|2,0,0]=4 1195 B11R0.114 COC(C)COCC[N+](C)(C)C 34a_100000690652_100000085578 [0,1,0,0,0,1|1,0,1]=4 1196 B11R0.114 COC(C)SCCC[N+](C)(C)C 62a_100009879195_100016990835 [0,1,0,0,0,1|1,0,1]=4 1197 B11R0.114 COC(C)SCCC[N+](C)(C)C 62a_100016990835_100009879195 [0,1,0,0,0,1|1,0,1]=4 1198 B11R0.114 C[C@@H](CO)COCC[N+](C)(C)C 7a_200020618287_100000059175 [0,1,0,0,0,1|1,0,1]=4 1199 B11R0.114 C[C@@H](CO)CSCC[N+](C)(C)C 62a_100000059175_100000085578 [0,1,0,0,0,1|1,0,1]=4 1200 B11R0.114 C[C@@H](CO)CSCC[N+](C)(C)C 62a_100000085578_100000059175 [0,1,0,0,0,1|1,0,1]=4 1201 B11R0.114 C[C@H](CO)NCCC[N+](C)(C)C 2230a_100000737577_100016990835 [0,1,0,0,0,1|1,0,1]=4 1202 B11R0.114 C[C@H](CO)SCCC[N+](C)(C)C 62a_100016084084_100016990835 [0,1,0,0,0,1|1,0,1]=4 1203 B11R0.114 C[C@H](CO)SCCC[N+](C)(C)C 62a_100016990835_100016084084 [0,1,0,0,0,1|1,0,1]=4 1204 B11R0.114 C[N+](C)(C)CCNC[C@@H](F)CO 34a_100015665980_100000085578 [0,1,0,0,0,1|1,0,1]=4 1205 B11R0.114 C[N+](C)(C)CCOCC(O)CO 7a_200020618287_100011219619 [0,1,0,0,0,1|0,0,2]=4 1206 B11R0.114 C[N+](C)(C)CCOC[C@@H](O)CF 7a_200020618287_100015614560 [0,1,0,0,0,1|1,0,1]=4 1207 B11R0.114 C[N+](C)(C)CCOC[C@@H](O)CO 7a_200020618287_100009815848 [0,1,0,0,0,1|0,0,2]=4 1208 B11R0.114 C[N+](C)(C)CCSCC(O)CO 62a_100000085578_100011219619 [0,1,0,0,0,1|0,0,2]=4 1209 B11R0.114 C[N+](C)(C)CCSCC(O)CO 62a_100011219619_100000085578 [0,1,0,0,0,1|0,0,2]=4 1210 B11R0.114 C[N+](C)(C)CCSC[C@@H](O)CF 62a_100000085578_100015614560 [0,1,0,0,0,1|1,0,1]=4 1211 B11R0.114 C[N+](C)(C)CCSC[C@@H](O)CF 62a_100015614560_100000085578 [0,1,0,0,0,1|1,0,1]=4 1212 B11R0.114 C[N+](C)(C)CCSC[C@@H](O)CO 62a_100000085578_100009815848 [0,1,0,0,0,1|0,0,2]=4 1213 B11R0.114 C[N+](C)(C)CCSC[C@@H](O)CO 62a_100009815848_100000085578 [0,1,0,0,0,1|0,0,2]=4 1214 B11R0.114 C[Si](C)(C)C#CCCC(=O)CO 1458a_100000210174_100010401983 [0,1,0,0,0,1|1,0,1]=4 1215 B11R0.114 C[Si](C)(C)CCCNC(=O)CO 240690a_100000725946_100000210174 [0,1,0,0,0,1|1,0,0]=3 1216 B11R0.114 C[Si](C)(C)CCCNC(=O)CO 527a_100000725946_100000210174 [0,1,0,0,0,1|1,0,0]=3 1217 B11R0.114 C[Si](C)(C)CCOCC(=O)CO 1458a_100000210174_100000032501 [0,1,0,0,0,1|1,0,0]=3 1218 B11R0.127 CC(=O)CCCOC(C)(C)CCl 7a_100000764493_100011215641 [0,1,0,0,0,1|2,0,0]=4 1219 B11R0.127 CC(=O)CCOCC(C)(C)CCl 7a_100011217199_100000053229 [0,1,0,0,0,1|2,0,0]=4 1220 B11R0.127 CC(=O)CCOCC(C)(C)CO 34a_100000759926_100009813988 [0,1,0,0,0,1|2,0,0]=4 1221 B11R0.127 CC(=O)CCOCC(C)(C)CO 7a_100000759926_100009813988 [0,1,0,0,0,1|2,0,0]=4 1222 B11R0.127 CC(=O)CCSCC(C)(C)CO 62a_100000053229_100009813988 [0,1,0,0,0,1|2,0,0]=4 1223 B11R0.127 CC(=O)CCSCC(C)(C)CO 62a_100009813988_100000053229 [0,1,0,0,0,1|2,0,0]=4 1224 B11R0.127 CC(=O)NCCCC(C)(C)CO 240690a_100000039164_100015343762 [0,1,0,0,0,1|2,0,0]=4 1225 B11R0.127 CC(=O)NCCCC(C)(C)CO 527a_100000039164_100103153847 [0,1,0,0,0,1|2,0,0]=4 1226 B11R0.127 CC(C)(CCl)COCCC(=O)N 7a_100011217199_100000744528 [0,1,0,0,0,1|2,0,0]=4 1227 B11R0.127 CC(C)(CCl)OCCCC(=O)N 7a_100000764493_100102525003 [0,1,0,0,0,1|2,0,0]=4 1228 B11R0.127 CC(C)(CO)CNCCC(=O)N 2230a_100020635058_100000744528 [0,1,0,0,0,1|2,0,0]=4 1229 B11R0.127 CC(C)(CO)CNOCC(=O)O 269956a_100000106656_100009813988 [0,1,0,0,0,1|2,0,0]=4 1230 B11R0.127 CC(C)(CO)COCCC(=O)N 34a_100000757172_100009813988 [0,1,0,0,0,1|2,0,0]=4 1231 B11R0.127 CC(C)(CO)COCCC(=O)N 7a_100000757172_100009813988 [0,1,0,0,0,1|2,0,0]=4 1232 B11R0.127 CC(C)(CO)CSCCC(=O)N 62a_100000744528_100009813988 [0,1,0,0,0,1|2,0,0]=4 1233 B11R0.127 CC(C)(CO)CSCCC(=O)N 62a_100009813988_100000744528 [0,1,0,0,0,1|2,0,0]=4 1234 B11R0.127 CCC(C)(C)COCCC(=O)C 7a_100000765029_100000053229 [0,1,0,0,0,1|2,0,0]=4 1235 B11R0.127 CCC(C)(C)COCCC(=O)N 7a_100000765029_100000744528 [0,1,0,0,0,1|2,0,0]=4 1236 B11R0.127 CCC(C)(C)OCCCC(=O)C 7a_100000210230_100011215641 [0,1,0,0,0,1|2,0,0]=4 1237 B11R0.127 CCC(C)(C)OCCCC(=O)C 7a_100000759063_100000210677 [0,1,0,0,0,1|2,0,0]=4 1238 B11R0.127 CCC(C)(C)OCCCC(=O)N 7a_100000210230_100102525003 [0,1,0,0,0,1|2,0,0]=4 1239 B11R0.127 CCC(C)(C)SCCCC(=O)C 62a_100000032637_100011215641 [0,1,0,0,0,1|2,0,0]=4 1240 B11R0.127 CCC(C)(C)SCCCC(=O)C 62a_100011215641_100000032637 [0,1,0,0,0,1|2,0,0]=4 1241 B11R0.127 CCC(C)(C)SCCCC(=O)N 62a_100000032637_100102525003 [0,1,0,0,0,1|2,0,0]=4 1242 B11R0.127 CCC(C)(C)SCCCC(=O)N 62a_100102525003_100000032637 [0,1,0,0,0,1|2,0,0]=4 1243 B11R0.127 COC(C)(C)CCOCC(=O)N 7a_100000699976_100000187820 [0,1,0,0,0,1|2,0,0]=4 1244 B11R0.127 COC(C)(C)CNCCC(=O)N 2230a_100000763424_100000744528 [0,1,0,0,0,1|2,0,0]=4 1245 B11R0.127 COC(C)(C)CNOCC(=O)O 269956a_100000106656_100000701081 [0,1,0,0,0,1|2,0,0]=4 1246 B11R0.127 COC(C)(C)COCCC(=O)C 34a_100000759926_100000701081 [0,1,0,0,0,1|2,0,0]=4 1247 B11R0.127 COC(C)(C)COCCC(=O)N 34a_100000757172_100000701081 [0,1,0,0,0,1|2,0,0]=4 1248 B11R0.127 COC(C)(C)CSCCC(=O)C 62a_100000053229_100000701081 [0,1,0,0,0,1|2,0,0]=4 1249 B11R0.127 COC(C)(C)CSCCC(=O)C 62a_100000701081_100000053229 [0,1,0,0,0,1|2,0,0]=4 1250 B11R0.127 COC(C)(C)CSCCC(=O)N 62a_100000701081_100000744528 [0,1,0,0,0,1|2,0,0]=4 1251 B11R0.127 COC(C)(C)CSCCC(=O)N 62a_100000744528_100000701081 [0,1,0,0,0,1|2,0,0]=4 1252 B11R0.127 CO[Si](C)(C)CCCNC(=O)C 1626a_200000066741_100015343762 [0,1,0,0,0,1|2,0,0]=4 1253 B11R0.127 CO[Si](C)(C)CCCNC(=O)C 240690a_200000066741_100015343762 [0,1,0,0,0,1|2,0,0]=4 1254 B11R0.127 CO[Si](C)(C)CCCNC(=O)C 527a_200000066741_100103153847 [0,1,0,0,0,1|2,0,0]=4 1255 B11R0.199 CC(C)(O)CCSC[N+](C)(C)C 62a_100000702414_200000036245 [0,1,0,0,0,1|1,0,1]=4 1256 B11R0.199 CC(C)(O)CCSC[N+](C)(C)C 62a_200000036245_100000702414 [0,1,0,0,0,1|1,0,1]=4 1257 B11R0.199 CC(C)(O)COCC[N+](C)(C)C 7a_200020618287_100000764493 [0,1,0,0,0,1|1,0,1]=4 1258 B11R0.199 CC(C)(O)CSCC[N+](C)(C)C 62a_100000085578_100000764493 [0,1,0,0,0,1|1,0,1]=4 1259 B11R0.199 CC(C)(O)CSCC[N+](C)(C)C 62a_100000764493_100000085578 [0,1,0,0,0,1|1,0,1]=4 1260 B11R0.199 C[N+](C)(C)CCSCS(=O)(=O)N 62a_100000085578_100000741382 [0,1,0,0,0,1|1,0,1]=4 1261 B11R0.199 C[N+](C)(C)CCSCS(=O)(=O)N 62a_100000741382_100000085578 [0,1,0,0,0,1|1,0,1]=4 1262 B11R0.199 C[N+](C)(C)CCSCS(=O)(=O)[O-] 62a_100000085578_100009817235 [0,1,0,0,0,1|1,0,1]=4 1263 B11R0.199 C[N+](C)(C)CCSCS(=O)(=O)[O-] 62a_100009817235_100000085578 [0,1,0,0,0,1|1,0,1]=4 1264 B11R0.199 C[N+](C)(C)CSCCS(=O)(=O)C 62a_100000731031_200000036245 [0,1,0,0,0,1|1,0,1]=4 1265 B11R0.199 C[N+](C)(C)CSCCS(=O)(=O)C 62a_200000036245_100000230027 [0,1,0,0,0,1|1,0,1]=4 1266 B11R0.199 C[N+](C)(C)CSCCS(=O)(=O)[O-] 62a_100000762736_200000036245 [0,1,0,0,0,1|1,0,1]=4 1267 B11R0.199 C[N+](C)(C)CSCCS(=O)(=O)[O-] 62a_200000036245_100000762736 [0,1,0,0,0,1|1,0,1]=4 1268 B11R0.318 C=C(C)C(=O)CCC[N+](C)(C)C 1458a_100000185857_100016990835 [0,1,0,0,0,1|2,0,0]=4 1269 B11R0.318 C=C(C)C(C)NCC[N+](C)(C)C 269862a_100000106457_100011216138 [0,1,0,0,0,1|2,0,0]=4 1270 B11R0.318 CC(=O)C(=O)CSC[N+](C)(C)C 62a_100011261029_200000036245 [0,1,0,0,0,1|1,0,1]=4 1271 B11R0.318 CC(=O)C(=O)CSC[N+](C)(C)C 62a_200000036245_100011261029 [0,1,0,0,0,1|1,0,1]=4 1272 B11R0.318 CC(=O)C(C)COCC(C)(C)C 34a_100000032740_100011219605 [0,1,0,0,0,1|2,0,0]=4 1273 B11R0.318 CC(=O)C(C)COC[Si](C)(C)C 7a_100000032740_100000233785 [0,1,0,0,0,1|2,0,0]=4 1274 B11R0.318 CC(=O)C(C)NCCC(C)(C)C 2230a_100000738805_100009814033 [0,1,0,0,0,1|2,0,0]=4 1275 B11R0.318 CC(=O)C(C)OCCC(C)(C)C 34a_100000212229_100000755188 [0,1,0,0,0,1|2,0,0]=4 1276 B11R0.318 CC(=O)C(C)OCCC(C)(C)C 7a_100000765024_100000179758 [0,1,0,0,0,1|2,0,0]=4 1277 B11R0.318 CC(=O)C(C)OCC[N+](C)(C)C 34a_100000212229_100000085578 [0,1,0,0,0,1|1,0,0]=3 1278 B11R0.318 CC(=O)C(C)OCC[N+](C)(C)C 7a_200020618287_100000179758 [0,1,0,0,0,1|1,0,0]=3 1279 B11R0.318 CC(=O)C(C)OCC[Si](C)(C)C 34a_100000212229_200000733723 [0,1,0,0,0,1|2,0,0]=4 1280 B11R0.318 CC(=O)C(C)OCC[Si](C)(C)C 7a_100000039746_100000179758 [0,1,0,0,0,1|2,0,0]=4 1281 B11R0.318 CC(=O)C(C)SCCC(C)(C)C 62a_100000755188_100009814033 [0,1,0,0,0,1|2,0,0]=4 1282 B11R0.318 CC(=O)C(C)SCCC(C)(C)C 62a_100009814033_100000755188 [0,1,0,0,0,1|2,0,0]=4 1283 B11R0.318 CC(=O)C(C)SCC[N+](C)(C)C 62a_100000085578_100009814033 [0,1,0,0,0,1|1,0,0]=3 1284 B11R0.318 CC(=O)C(C)SCC[N+](C)(C)C 62a_100009814033_100000085578 [0,1,0,0,0,1|1,0,0]=3 1285 B11R0.318 CC(=O)C(C)SCC[Si](C)(C)C 62a_100009814033_200000733723 [0,1,0,0,0,1|2,0,0]=4 1286 B11R0.318 CC(=O)C(C)SCC[Si](C)(C)C 62a_200000733723_100009814033 [0,1,0,0,0,1|2,0,0]=4 1287 B11R0.318 CC(C)(C)CCNC(F)C(=O)N 2230a_100000738805_100009813875 [0,1,0,0,0,1|2,0,0]=4 1288 B11R0.318 CC(C)(C)CCOC(F)C(=O)N 7a_100000765024_100009813875 [0,1,0,0,0,1|2,0,0]=4 1289 B11R0.318 CC(C)(C)CCSC(F)C(=O)N 62a_100000755188_100009813875 [0,1,0,0,0,1|2,0,0]=4 1290 B11R0.318 CC(C)(C)CCSC(F)C(=O)N 62a_100009813875_100000755188 [0,1,0,0,0,1|2,0,0]=4 1291 B11R0.318 CC(C)(C)CCSC(F)C(=O)[O-] 62a_100000755188_100020610796 [0,1,0,0,0,1|1,0,1]=4 1292 B11R0.318 CC(C)(C)CCSC(F)C(=O)[O-] 62a_100020610796_100000755188 [0,1,0,0,0,1|1,0,1]=4 1293 B11R0.318 CC(C)(C)CNCC(F)C(=O)O 269956a_100000084737_100011219605 [0,1,0,0,0,1|1,0,0]=3 1294 B11R0.318 CC(C)(C)COC[C@H](N)C(=O)N 34a_100000729942_100011219605 [0,1,0,0,0,1|2,0,0]=4 1295 B11R0.318 CC(C)(F)CNCC(F)C(=O)O 269956a_100000084737_100011997219 [0,1,0,0,0,1|2,0,0]=4 1296 B11R0.318 CC(C)(O)CNCC(F)C(=O)O 269956a_100000084737_100000764493 [0,1,0,0,0,1|2,0,0]=4 1297 B11R0.318 CC(CNCC(C)(C)C)C(=O)O 269956a_100000749485_100011219605 [0,1,0,0,0,1|1,0,0]=3 1298 B11R0.318 CC(CNCC(C)(C)F)C(=O)O 269956a_100000749485_100011997219 [0,1,0,0,0,1|2,0,0]=4 1299 B11R0.318 CC(CNCC(C)(C)O)C(=O)O 269956a_100000749485_100000764493 [0,1,0,0,0,1|2,0,0]=4 1300 B11R0.318 CC(CNC[N+](C)(C)C)C(=O)O 269956a_100000749485_200000036245 [0,1,0,0,0,1|0,0,0]=2 1301 B11R0.318 CC(CNC[Si](C)(C)C)C(=O)O 269956a_100000749485_100000037933 [0,1,0,0,0,1|1,0,0]=3 1302 B11R0.318 CC(NCCC(C)(C)C)C(=O)N 2230a_100000738805_100000702099 [0,1,0,0,0,1|2,0,0]=4 1303 B11R0.318 CC(OCCC(C)(C)C)C(=O)N 7a_100000765024_100000702099 [0,1,0,0,0,1|2,0,0]=4 1304 B11R0.318 CC(OCC[N+](C)(C)C)C(=O)N 7a_200020618287_100000702099 [0,1,0,0,0,1|1,0,0]=3 1305 B11R0.318 CC(OCC[Si](C)(C)C)C(=O)N 7a_100000039746_100000702099 [0,1,0,0,0,1|2,0,0]=4 1306 B11R0.318 CC(SCCC(C)(C)C)C(=O)N 62a_100000702099_100000755188 [0,1,0,0,0,1|2,0,0]=4 1307 B11R0.318 CC(SCCC(C)(C)C)C(=O)N 62a_100000755188_100000702099 [0,1,0,0,0,1|2,0,0]=4 1308 B11R0.318 CC(SCC[N+](C)(C)C)C(=O)N 62a_100000085578_100000702099 [0,1,0,0,0,1|1,0,0]=3 1309 B11R0.318 CC(SCC[N+](C)(C)C)C(=O)N 62a_100000702099_100000085578 [0,1,0,0,0,1|1,0,0]=3 1310 B11R0.318 CC(SCC[Si](C)(C)C)C(=O)N 62a_100000702099_200000733723 [0,1,0,0,0,1|2,0,0]=4 1311 B11R0.318 CC(SCC[Si](C)(C)C)C(=O)N 62a_200000733723_100000702099 [0,1,0,0,0,1|2,0,0]=4 1312 B11R0.318 C[C@@H](NCCC(C)(C)C)C(=O)N 2230a_100000119354_100000755188 [0,1,0,0,0,1|2,0,0]=4 1313 B11R0.318 C[C@@H](NCCC(C)(C)C)C(=O)N 34a_100000119354_100000755188 [0,1,0,0,0,1|2,0,0]=4 1314 B11R0.318 C[C@@H](NCC[N+](C)(C)C)C(=O)N 34a_100000119354_100000085578 [0,1,0,0,0,1|1,0,0]=3 1315 B11R0.318 C[C@@H](NCC[Si](C)(C)C)C(=O)N 2230a_100000119354_200000733723 [0,1,0,0,0,1|2,0,0]=4 1316 B11R0.318 C[C@@H](NCC[Si](C)(C)C)C(=O)N 34a_100000119354_200000733723 [0,1,0,0,0,1|2,0,0]=4 1317 B11R0.318 C[C@@H](O)C(=O)CCC[N+](C)(C)C 1458a_100000717761_100016990835 [0,1,0,0,0,1|1,0,1]=4 1318 B11R0.318 C[C@@H](OCCC(C)(C)C)C(=O)N 34a_100000731257_100000755188 [0,1,0,0,0,1|2,0,0]=4 1319 B11R0.318 C[C@@H](OCCC(C)(C)C)C(=O)N 7a_100000731257_100000755188 [0,1,0,0,0,1|2,0,0]=4 1320 B11R0.318 C[C@@H](OCC[N+](C)(C)C)C(=O)N 34a_100000731257_100000085578 [0,1,0,0,0,1|1,0,0]=3 1321 B11R0.318 C[C@@H](OCC[N+](C)(C)C)C(=O)N 7a_100000731257_100000085578 [0,1,0,0,0,1|1,0,0]=3 1322 B11R0.318 C[C@@H](OCC[Si](C)(C)C)C(=O)N 34a_100000731257_200000733723 [0,1,0,0,0,1|2,0,0]=4 1323 B11R0.318 C[C@@H](OCC[Si](C)(C)C)C(=O)N 7a_100000731257_200000733723 [0,1,0,0,0,1|2,0,0]=4 1324 B11R0.318 C[C@H](NCCC(C)(C)C)C(=O)O 269956a_100000743915_100000755188 [0,1,0,0,0,1|1,0,0]=3 1325 B11R0.318 C[C@H](NCCC(C)(C)O)C(=O)O 269956a_100000743915_100000702414 [0,1,0,0,0,1|2,0,0]=4 1326 B11R0.318 C[C@H](NCC[N+](C)(C)C)C(=O)O 269956a_100000743915_100000085578 [0,1,0,0,0,1|0,0,0]=2 1327 B11R0.318 C[C@H](NCC[Si](C)(C)C)C(=O)O 269956a_100000743915_200000733723 [0,1,0,0,0,1|1,0,0]=3 1328 B11R0.318 C[C@H](O)C(=O)CCC[N+](C)(C)C 1458a_217856618621_100016990835 [0,1,0,0,0,1|1,0,1]=4 1329 B11R0.318 C[C@H](OCCC(C)(C)C)C(=O)[O-] 7a_217856618621_100000755188 [0,1,0,0,0,1|1,0,1]=4 1330 B11R0.318 C[C@H](OCC[N+](C)(C)C)C(=O)[O-] 7a_217856618621_100000085578 [0,1,0,0,0,1|0,0,1]=3 1331 B11R0.318 C[C@H](OCC[Si](C)(C)C)C(=O)[O-] 7a_217856618621_200000733723 [0,1,0,0,0,1|1,0,1]=4 1332 B11R0.318 C[N+](C)(C)CCCC(=O)C(O)O 1458a_100000233687_100016990835 [0,1,0,0,0,1|0,0,2]=4 1333 B11R0.318 C[N+](C)(C)CCNC(=O)C(=O)N 240690a_100000106457_100011215815 [0,1,0,0,0,1|1,0,1]=4 1334 B11R0.318 C[N+](C)(C)CCOC(F)C(=O)N 7a_200020618287_100009813875 [0,1,0,0,0,1|1,0,0]=3 1335 B11R0.318 C[N+](C)(C)CCSC(F)C(=O)N 62a_100000085578_100009813875 [0,1,0,0,0,1|1,0,0]=3 1336 B11R0.318 C[N+](C)(C)CCSC(F)C(=O)N 62a_100009813875_100000085578 [0,1,0,0,0,1|1,0,0]=3 1337 B11R0.318 C[N+](C)(C)CCSC(F)C(=O)[O-] 62a_100000085578_100020610796 [0,1,0,0,0,1|0,0,1]=3 1338 B11R0.318 C[N+](C)(C)CCSC(F)C(=O)[O-] 62a_100020610796_100000085578 [0,1,0,0,0,1|0,0,1]=3 1339 B11R0.318 C[N+](C)(C)CNCC(F)C(=O)O 269956a_100000084737_200000036245 [0,1,0,0,0,1|0,0,0]=2 1340 B11R0.318 C[Si](C)(C)CCOC(F)C(=O)N 7a_100000039746_100009813875 [0,1,0,0,0,1|2,0,0]=4 1341 B11R0.318 C[Si](C)(C)CCSC(F)C(=O)N 62a_100009813875_200000733723 [0,1,0,0,0,1|2,0,0]=4 1342 B11R0.318 C[Si](C)(C)CCSC(F)C(=O)N 62a_200000733723_100009813875 [0,1,0,0,0,1|2,0,0]=4 1343 B11R0.318 C[Si](C)(C)CCSC(F)C(=O)[O-] 62a_100020610796_200000733723 [0,1,0,0,0,1|1,0,1]=4 1344 B11R0.318 C[Si](C)(C)CCSC(F)C(=O)[O-] 62a_200000733723_100020610796 [0,1,0,0,0,1|1,0,1]=4 1345 B11R0.318 C[Si](C)(C)CNCC(F)C(=O)O 269956a_100000084737_100000037933 [0,1,0,0,0,1|1,0,0]=3 1346 B11R0.337 C=C(C)CN(C)CC[N+](C)(C)C 269982a_100000225649_100000085578 [0,1,0,0,0,1|2,0,0]=4 1347 B11R0.337 CC(=O)OC(C)SC[N+](C)(C)C 62a_100009818208_200000036245 [0,1,0,0,0,1|2,0,0]=4 1348 B11R0.337 CC(=O)OC(C)SC[N+](C)(C)C 62a_200000036245_100009818208 [0,1,0,0,0,1|2,0,0]=4 1349 B11R0.337 CC(C)(C)CCC(=O)CC(=O)N 1458a_100000757465_100000187820 [0,1,0,0,0,1|2,0,0]=4 1350 B11R0.337 CC(C)(C)CCC(=O)CC(=O)N 1458a_100134613110_100000755188 [0,1,0,0,0,1|2,0,0]=4 1351 B11R0.337 CC(C)(C)CCC(=O)CC(=O)[O-] 1458a_100000757465_100020667443 [0,1,0,0,0,1|1,0,1]=4 1352 B11R0.337 CC(C)(C)NCC(O)CC(=O)O 269956a_100011218706_100000211941 [0,1,0,0,0,1|1,0,0]=3 1353 B11R0.337 CC(O)CN(C)CC[N+](C)(C)C 269982a_100000227577_100000085578 [0,1,0,0,0,1|1,0,1]=4 1354 B11R0.337 CN(CCC(C)(C)C)CC(=O)N 2230a_100000739694_100000755188 [0,1,0,0,0,1|2,0,0]=4 1355 B11R0.337 CN(CCC(C)(C)C)CC(=O)O 269956a_100000746989_100000755188 [0,1,0,0,0,1|1,0,0]=3 1356 B11R0.337 CN(CCC(C)(C)O)CC(=O)O 269956a_100000746989_100000702414 [0,1,0,0,0,1|2,0,0]=4 1357 B11R0.337 CN(CC[N+](C)(C)C)CC(=O)O 269956a_100000746989_100000085578 [0,1,0,0,0,1|0,0,0]=2 1358 B11R0.337 CN(CC[Si](C)(C)C)CC(=O)N 2230a_100000739694_200000733723 [0,1,0,0,0,1|2,0,0]=4 1359 B11R0.337 CN(CC[Si](C)(C)C)CC(=O)O 269956a_100000746989_200000733723 [0,1,0,0,0,1|1,0,0]=3 1360 B11R0.337 C[C@@H](O)CC(=O)CC[N+](C)(C)C 1458a_100011933948_100000085578 [0,1,0,0,0,1|1,0,1]=4 1361 B11R0.337 C[N+](C)(C)CCC(=O)CC(=O)N 1458a_100134613110_100000085578 [0,1,0,0,0,1|1,0,0]=3 1362 B11R0.337 C[Si](C)(C)CCC(=O)CC(=O)N 1458a_100011215282_100000187820 [0,1,0,0,0,1|2,0,0]=4 1363 B11R0.337 C[Si](C)(C)CCC(=O)CC(=O)N 1458a_100134613110_200000733723 [0,1,0,0,0,1|2,0,0]=4 1364 B11R0.337 C[Si](C)(C)CCC(=O)CC(=O)[O-] 1458a_100011215282_100020667443 [0,1,0,0,0,1|1,0,1]=4 1365 B11R0.86 C[Si](C)(C)C(F)(F)NCC(=O)O 269956a_100016091260_100010009690 [0,2,0,0,0,0|2,0,0]=4 1366 B11R0.89 COC(=O)CCN(C)C(C)(C)C 269982a_100011215553_100000204255 [0,2,0,0,0,0|2,0,0]=4 1367 B11R0.89 COC(=O)CCN(C)C(C)(C)C 269982a_100025711912_100000210625 [0,2,0,0,0,0|2,0,0]=4 1368 B11R0.89 COC(=O)CN[C@H](C)C(C)(C)C 2230a_100025703359_100000747449 [0,2,0,0,0,0|2,0,0]=4 1369 B11R0.119 C#CC(=O)CC(O)C[N+](C)(C)C 1458a_100000211873_100000032816 [0,2,0,0,0,0|1,0,0]=3 1370 B11R0.119 C=CC(=O)CC(O)C[N+](C)(C)C 1458a_100000185746_100000032816 [0,2,0,0,0,0|1,0,0]=3 1371 B11R0.119 CC(CC(=O)CF)CC(C)(C)C 1458a_100000239893_100015361967 [0,2,0,0,0,0|2,0,0]=4 1372 B11R0.119 CCC(=O)CC(=O)C[N+](C)(C)C 1458a_100000033712_100000747405 [0,2,0,0,0,0|1,0,1]=4 1373 B11R0.119 CCC(=O)CC(C)CC(C)(C)C 1458a_100000239893_100000210202 [0,2,0,0,0,0|2,0,0]=4 1374 B11R0.119 CCC(=O)CC(O)C[N+](C)(C)C 1458a_100000210414_100000032816 [0,2,0,0,0,0|1,0,0]=3 1375 B11R0.119 CCC(=O)C[C@@H](O)C[N+](C)(C)C 1458a_100000004043_100000210202 [0,2,0,0,0,0|1,0,0]=3 1376 B11R0.119 CNC(=O)CC(=O)C[N+](C)(C)C 1458a_100000033712_100000183359 [0,2,0,0,0,0|1,0,1]=4 1377 B11R0.119 CNC(=O)CC(C)CC(C)(C)C 11a_106832991635_100000239893 [0,2,0,0,0,0|2,0,0]=4 1378 B11R0.119 CNC(=O)CC(C)CC(C)(C)C 1626a_100102657272_100000239893 [0,2,0,0,0,0|2,0,0]=4 1379 B11R0.119 CNC(=O)CC(C)CC(C)(C)C 240690a_100102657272_100000239893 [0,2,0,0,0,0|2,0,0]=4 1380 B11R0.119 CNC(=O)CC(C)CC(C)(C)C 527a_100102657272_100000239893 [0,2,0,0,0,0|2,0,0]=4 1381 B11R0.119 CNC(=O)C[C@@H](O)C[N+](C)(C)C 1626a_100102657272_100000004043 [0,2,0,0,0,0|1,0,0]=3 1382 B11R0.119 CNC(=O)C[C@@H](O)C[N+](C)(C)C 240690a_100102657272_100000004043 [0,2,0,0,0,0|1,0,0]=3 1383 B11R0.119 COC(=O)CC(=O)CC(C)(C)C 1458a_100000211214_100000747449 [0,2,0,0,0,0|1,0,1]=4 1384 B11R0.119 COC(=O)CC(=O)C[N+](C)(C)C 1458a_100000033712_100000747449 [0,2,0,0,0,0|0,0,1]=3 1385 B11R0.119 COC(=O)CC(=O)C[Si](C)(C)C 1458a_100000211351_100000233785 [0,2,0,0,0,0|1,0,1]=4 1386 B11R0.119 COC(=O)CC(=O)C[Si](C)(C)C 1458a_100011218504_100000747449 [0,2,0,0,0,0|1,0,1]=4 1387 B11R0.119 COC(=O)CC(C)NC(C)(C)C 2230a_100000715429_100009817358 [0,2,0,0,0,0|2,0,0]=4 1388 B11R0.119 COC(=O)CC(C)OC(C)(C)C 34a_100015890283_100009817358 [0,2,0,0,0,0|2,0,0]=4 1389 B11R0.119 COC(=O)CC(C)OC(C)(C)C 7a_100015890283_100009817358 [0,2,0,0,0,0|2,0,0]=4 1390 B11R0.119 COC(=O)CC(C)SC(C)(C)C 62a_100000211941_100009817358 [0,2,0,0,0,0|2,0,0]=4 1391 B11R0.119 COC(=O)CC(C)SC(C)(C)C 62a_100009817358_100000211941 [0,2,0,0,0,0|2,0,0]=4 1392 B11R0.119 COC(=O)CN(C)CC(C)(C)C 2230a_100000742839_100000747449 [0,2,0,0,0,0|2,0,0]=4 1393 B11R0.119 COC(=O)CN(C)CC(C)(C)C 269982a_100000742839_100000747449 [0,2,0,0,0,0|2,0,0]=4 1394 B11R0.119 COC(=O)CN(C)CC(C)(C)C 270004a_100000198492_100011204126 [0,2,0,0,0,0|2,0,0]=4 1395 B11R0.119 COC(=O)CN(C)C[Si](C)(C)C 2230a_100000198492_100000037933 [0,2,0,0,0,0|2,0,0]=4 1396 B11R0.119 COC(=O)CN(C)C[Si](C)(C)C 269982a_200020589227_100000747449 [0,2,0,0,0,0|2,0,0]=4 1397 B11R0.119 C[C@@H](CC(C)(C)C)NC(=O)CO 240690a_106358413534_100000210174 [0,2,0,0,0,0|2,0,0]=4 1398 B11R0.119 C[C@@H](CC(C)(C)C)NC(=O)CO 527a_106358413534_100000210174 [0,2,0,0,0,0|2,0,0]=4 1399 B11R0.119 C[N+](C)(C)CC(O)CC(=O)CO 1458a_100000210174_100000032816 [0,2,0,0,0,0|0,0,0]=2 1400 B11R0.119 C[N+](C)(C)C[C@H](O)CC(=O)CF 1458a_100000004043_100015361967 [0,2,0,0,0,0|1,0,0]=3 1401 B11R0.208 CC(C)(C)NC(C)(C)CC(=O)O 269956a_100000755897_100000211941 [0,2,0,0,0,0|2,0,0]=4 1402 B11R0.274 CC(C)(C)N[C@H](CO)CC(=O)O 269956a_100009816507_100000211941 [0,2,0,0,0,0|2,0,0]=4 1403 B11R0.274 CCN(CC(=O)O)CC(C)(C)C 269956a_100000746405_100011219605 [0,2,0,0,0,0|2,0,0]=4 1404 B11R0.274 CCN(CC(=O)O)C[N+](C)(C)C 269956a_100000746405_200000036245 [0,2,0,0,0,0|1,0,0]=3 1405 B11R0.274 CCN(CC(=O)O)C[Si](C)(C)C 269956a_100000746405_100000037933 [0,2,0,0,0,0|2,0,0]=4 1406 B11R0.274 CC[C@H](CC(=O)O)NC(C)(C)C 269956a_100016995926_100000211941 [0,2,0,0,0,0|2,0,0]=4 1407 B11R0.274 C[N+](C)(C)CN(CO)CC(=O)[O-] 269956a_100016989150_200000036245 [0,2,0,0,0,0|1,0,1]=4 1408 B11R0.300 CN(CC(=O)O)CC(C)(C)CO 269956a_100000746989_100009813988 [0,2,0,0,0,0|2,0,0]=4 1409 B11R0.300 COC(C)(C)CN(C)CC(=O)O 269956a_100000746989_100000701081 [0,2,0,0,0,0|2,0,0]=4 1410 B11R0.308 CC(=O)C(C)C(=O)C[N+](C)(C)C 1458a_100000033712_100000179758 [0,2,0,0,0,0|1,0,1]=4 1411 B11R0.308 CC(C(=O)N)C(=O)C[N+](C)(C)C 1458a_100000033712_100000702099 [0,2,0,0,0,0|1,0,1]=4 1412 B11R0.308 CC(C(=O)O)N(C)CC(C)(C)C 269956a_100000749554_100011219605 [0,2,0,0,0,0|2,0,0]=4 1413 B11R0.308 CC(C(=O)O)N(C)C[N+](C)(C)C 269956a_100000749554_200000036245 [0,2,0,0,0,0|1,0,0]=3 1414 B11R0.308 CC(C(=O)O)N(C)C[Si](C)(C)C 269956a_100000749554_100000037933 [0,2,0,0,0,0|2,0,0]=4 1415 B11R0.308 C[N+](C)(C)CC(=O)C(F)C(=O)N 1458a_100000033712_100009813875 [0,2,0,0,0,0|1,0,1]=4 1416 B11R0.308 C[N+](C)(C)CC(=O)C(F)C(=O)[O-] 1458a_100000033712_100020610796 [0,2,0,0,0,0|0,0,2]=4 1417 B11R0.180 C#CCC(=O)CCC[N+](C)(C)C 1458a_100000085584_100000184674 [0,2,0,0,0,0|1,0,0]=3 1418 B11R0.180 C#CCC(=O)CCC[N+](C)(C)C 1458a_100011220946_100016990835 [0,2,0,0,0,0|1,0,0]=3 1419 B11R0.180 C#CCC(=O)CCC[Si](C)(C)C 1458a_100011220946_100011219597 [0,2,0,0,0,0|2,0,0]=4 1420 B11R0.180 C#CCC(=O)NCC[N+](C)(C)C 1626a_100000106457_100011220946 [0,2,0,0,0,0|2,0,0]=4 1421 B11R0.180 C#CCC(=O)NCC[N+](C)(C)C 527a_100000106457_100011220946 [0,2,0,0,0,0|2,0,0]=4 1422 B11R0.180 C=CCC(=O)CCC[N+](C)(C)C 1458a_100000085584_100000210623 [0,2,0,0,0,0|1,0,0]=3 1423 B11R0.180 C=CCC(=O)CCC[N+](C)(C)C 1458a_100000210193_100016990835 [0,2,0,0,0,0|1,0,0]=3 1424 B11R0.180 C=CCC(=O)CCC[Si](C)(C)C 1458a_100000210193_100011219597 [0,2,0,0,0,0|2,0,0]=4 1425 B11R0.180 C=CCC(=O)NCC[N+](C)(C)C 1626a_100000106457_100000210193 [0,2,0,0,0,0|2,0,0]=4 1426 B11R0.180 C=CCC(=O)NCC[N+](C)(C)C 240690a_100000106457_100000210193 [0,2,0,0,0,0|2,0,0]=4 1427 B11R0.180 C=CCC(=O)NCC[N+](C)(C)C 527a_100000106457_100000210193 [0,2,0,0,0,0|2,0,0]=4 1428 B11R0.180 C=COC(=O)CNCC(C)(C)C 2230a_100000743828_100000036128 [0,2,0,0,0,0|2,0,0]=4 1429 B11R0.180 C=COC(=O)CSCC(C)(C)C 62a_100000036128_100011219605 [0,2,0,0,0,0|2,0,0]=4 1430 B11R0.180 C=COC(=O)CSCC(C)(C)C 62a_100011219605_100000036128 [0,2,0,0,0,0|2,0,0]=4 1431 B11R0.180 C=COC(=O)CSC[N+](C)(C)C 62a_100000036128_200000036245 [0,2,0,0,0,0|1,0,0]=3 1432 B11R0.180 C=COC(=O)CSC[N+](C)(C)C 62a_200000036245_100000036128 [0,2,0,0,0,0|1,0,0]=3 1433 B11R0.180 C=COC(=O)CSC[Si](C)(C)C 62a_100000036128_100000037933 [0,2,0,0,0,0|2,0,0]=4 1434 B11R0.180 C=COC(=O)CSC[Si](C)(C)C 62a_100000037933_100000036128 [0,2,0,0,0,0|2,0,0]=4 1435 B11R0.180 CC#CC(=O)CCC[N+](C)(C)C 1458a_100000763181_100016990835 [0,2,0,0,0,0|1,0,0]=3 1436 B11R0.180 CC#CC(=O)CCC[Si](C)(C)C 1458a_100000763181_100011219597 [0,2,0,0,0,0|2,0,0]=4 1437 B11R0.180 CC(C)(C)CCNC(=O)CCO 240690a_100000738805_100011216618 [0,2,0,0,0,0|2,0,0]=4 1438 B11R0.180 CC(C)(C)CNCC(=O)NCO 2230a_100000743828_100000185155 [0,2,0,0,0,0|2,0,0]=4 1439 B11R0.180 CC(C)(C)CSCC(=O)NCO 62a_100000185155_100011219605 [0,2,0,0,0,0|2,0,0]=4 1440 B11R0.180 CC(C)(C)CSCC(=O)NCO 62a_100011219605_100000185155 [0,2,0,0,0,0|2,0,0]=4 1441 B11R0.180 CC=CC(=O)CCC[N+](C)(C)C 1458a_100000210699_100016990835 [0,2,0,0,0,0|1,0,0]=3 1442 B11R0.180 CC=CC(=O)CCC[Si](C)(C)C 1458a_100000210699_100011219597 [0,2,0,0,0,0|2,0,0]=4 1443 B11R0.180 CC=CC(=O)NCC[N+](C)(C)C 1626a_100000106457_100000210699 [0,2,0,0,0,0|2,0,0]=4 1444 B11R0.180 CC=CC(=O)NCC[N+](C)(C)C 240690a_100000106457_100000210699 [0,2,0,0,0,0|2,0,0]=4 1445 B11R0.180 CCCC(=O)CCC[N+](C)(C)C 1458a_100000085584_100000210303 [0,2,0,0,0,0|1,0,0]=3 1446 B11R0.180 CCCC(=O)CCC[N+](C)(C)C 1458a_100000211992_100016990835 [0,2,0,0,0,0|1,0,0]=3 1447 B11R0.180 CCCC(=O)CCC[Si](C)(C)C 1458a_100000211992_100011219597 [0,2,0,0,0,0|2,0,0]=4 1448 B11R0.180 CCCC(=O)CSC[N+](C)(C)C 62a_100000747444_200000036245 [0,2,0,0,0,0|2,0,0]=4 1449 B11R0.180 CCCC(=O)CSC[N+](C)(C)C 62a_200000036245_100000747444 [0,2,0,0,0,0|2,0,0]=4 1450 B11R0.180 CCCC(=O)NCC[N+](C)(C)C 1626a_100000106457_100000211992 [0,2,0,0,0,0|2,0,0]=4 1451 B11R0.180 CCCC(=O)NCC[N+](C)(C)C 240690a_100000106457_100000211992 [0,2,0,0,0,0|2,0,0]=4 1452 B11R0.180 CCCC(=O)NCC[N+](C)(C)C 527a_100000106457_100000211992 [0,2,0,0,0,0|2,0,0]=4 1453 B11R0.180 CCNC(=O)CCC[N+](C)(C)C 11a_100015525214_100000085584 [0,2,0,0,0,0|1,0,0]=3 1454 B11R0.180 CCNC(=O)CCC[N+](C)(C)C 240690a_100015525214_100000085584 [0,2,0,0,0,0|1,0,0]=3 1455 B11R0.180 CCNC(=O)CCC[N+](C)(C)C 527a_100015525214_100000085584 [0,2,0,0,0,0|1,0,0]=3 1456 B11R0.180 CCNC(=O)CSC[N+](C)(C)C 62a_100000183381_200000036245 [0,2,0,0,0,0|2,0,0]=4 1457 B11R0.180 CCNC(=O)CSC[N+](C)(C)C 62a_200000036245_100000183381 [0,2,0,0,0,0|2,0,0]=4 1458 B11R0.180 CCNC(=O)NCC[N+](C)(C)C 2708a_100015525214_100000106457 [0,2,0,0,0,0|2,0,0]=4 1459 B11R0.180 CCNC(=O)NCC[N+](C)(C)C 273464a_100000106457_100015525214 [0,2,0,0,0,0|2,0,0]=4 1460 B11R0.180 CCNC(=O)NCC[N+](C)(C)C 273464a_100015525214_100000106457 [0,2,0,0,0,0|2,0,0]=4 1461 B11R0.180 CCNC(=O)NCC[N+](C)(C)C 512a_100000106457_100015525214 [0,2,0,0,0,0|2,0,0]=4 1462 B11R0.180 CCNC(=O)NCC[N+](C)(C)C 512a_100015525214_100000106457 [0,2,0,0,0,0|2,0,0]=4 1463 B11R0.180 CCOC(=O)CCNC(C)(C)C 2230a_100000715429_100011206558 [0,2,0,0,0,0|2,0,0]=4 1464 B11R0.180 CCOC(=O)CCOC(C)(C)C 34a_100015890283_100000765890 [0,2,0,0,0,0|2,0,0]=4 1465 B11R0.180 CCOC(=O)CCOC(C)(C)C 7a_100015890283_100011206558 [0,2,0,0,0,0|2,0,0]=4 1466 B11R0.180 CCOC(=O)CCSC(C)(C)C 62a_100000211941_100000765890 [0,2,0,0,0,0|2,0,0]=4 1467 B11R0.180 CCOC(=O)CCSC(C)(C)C 62a_100000765890_100000211941 [0,2,0,0,0,0|2,0,0]=4 1468 B11R0.180 CCOC(=O)CNCC(C)(C)C 2230a_100000743828_100000188475 [0,2,0,0,0,0|2,0,0]=4 1469 B11R0.180 CCOC(=O)CSCC(C)(C)C 62a_100000188475_100011219605 [0,2,0,0,0,0|2,0,0]=4 1470 B11R0.180 CCOC(=O)CSCC(C)(C)C 62a_100011219605_100000188475 [0,2,0,0,0,0|2,0,0]=4 1471 B11R0.180 CCOC(=O)CSC[N+](C)(C)C 62a_100000188475_200000036245 [0,2,0,0,0,0|1,0,0]=3 1472 B11R0.180 CCOC(=O)CSC[N+](C)(C)C 62a_200000036245_100000188475 [0,2,0,0,0,0|1,0,0]=3 1473 B11R0.180 CCOC(=O)CSC[Si](C)(C)C 62a_100000037933_100000188475 [0,2,0,0,0,0|2,0,0]=4 1474 B11R0.180 CCOC(=O)CSC[Si](C)(C)C 62a_100000188475_100000037933 [0,2,0,0,0,0|2,0,0]=4 1475 B11R0.180 CN(CCO)CCC[N+](C)(C)C 2230a_100000210263_100016990835 [0,2,0,0,0,0|2,0,0]=4 1476 B11R0.180 CN(CCO)CCC[N+](C)(C)C 269982a_100000210263_100016990835 [0,2,0,0,0,0|2,0,0]=4 1477 B11R0.180 CNNC(=O)CCC[N+](C)(C)C 22a_100016993582_100000085584 [0,2,0,0,0,0|1,0,0]=3 1478 B11R0.180 CNNC(=O)NCC[N+](C)(C)C 273464a_100000106457_100016993582 [0,2,0,0,0,0|2,0,0]=4 1479 B11R0.180 CNNC(=O)NCC[N+](C)(C)C 512a_100000106457_100016993582 [0,2,0,0,0,0|2,0,0]=4 1480 B11R0.180 CNNC(=O)NCC[N+](C)(C)C 512a_100016993582_100000106457 [0,2,0,0,0,0|2,0,0]=4 1481 B11R0.180 COCC(=O)CCC[N+](C)(C)C 1458a_100000210968_100016990835 [0,2,0,0,0,0|0,0,0]=2 1482 B11R0.180 COCC(=O)CCC[Si](C)(C)C 1458a_100000210968_100011219597 [0,2,0,0,0,0|1,0,0]=3 1483 B11R0.180 COCC(=O)CCO[Si](C)(C)C 1458a_100000210968_200000032530 [0,2,0,0,0,0|2,0,0]=4 1484 B11R0.180 COCC(=O)NCCC(C)(C)C 11a_100000738805_100000210968 [0,2,0,0,0,0|2,0,0]=4 1485 B11R0.180 COCC(=O)NCCC(C)(C)C 1626a_100000738805_100000210968 [0,2,0,0,0,0|2,0,0]=4 1486 B11R0.180 COCC(=O)NCCC(C)(C)C 240690a_100000738805_100000210968 [0,2,0,0,0,0|2,0,0]=4 1487 B11R0.180 COCC(=O)NCCC(C)(C)C 527a_100000738805_100000210968 [0,2,0,0,0,0|2,0,0]=4 1488 B11R0.180 COCC(=O)NCC[N+](C)(C)C 1626a_100000106457_100000210968 [0,2,0,0,0,0|1,0,0]=3 1489 B11R0.180 COCC(=O)NCC[N+](C)(C)C 240690a_100000106457_100000210968 [0,2,0,0,0,0|1,0,0]=3 1490 B11R0.180 COCC(=O)NCC[N+](C)(C)C 527a_100000106457_100000210968 [0,2,0,0,0,0|1,0,0]=3 1491 B11R0.180 CSCC(=O)CCC[N+](C)(C)C 1458a_100000184570_100016990835 [0,2,0,0,0,0|0,1,0]=3 1492 B11R0.180 CSCC(=O)CCC[Si](C)(C)C 1458a_100000184570_100011219597 [0,2,0,0,0,0|1,1,0]=4 1493 B11R0.180 CSCC(=O)NCC[N+](C)(C)C 1626a_100000106457_100000184570 [0,2,0,0,0,0|1,1,0]=4 1494 B11R0.180 CSCC(=O)NCC[N+](C)(C)C 240690a_100000106457_100000184570 [0,2,0,0,0,0|1,1,0]=4 1495 B11R0.180 CSCC(=O)NCC[N+](C)(C)C 527a_100000106457_100000184570 [0,2,0,0,0,0|1,1,0]=4 1496 B11R0.180 C[N+](C)(C)CCCC(=O)C=CBr 1458a_100016273825_100016990835 [0,2,0,0,0,0|1,0,0]=3 1497 B11R0.180 C[N+](C)(C)CCCC(=O)C=CCl 1458a_200016279998_100016990835 [0,2,0,0,0,0|1,0,0]=3 1498 B11R0.180 C[N+](C)(C)CCCC(=O)C=CI 1458a_100016256311_100016990835 [0,2,0,0,0,0|1,0,0]=3 1499 B11R0.180 C[N+](C)(C)CCCC(=O)CC#N 1458a_100000085584_100011214920 [0,2,0,0,0,0|1,0,0]=3 1500 B11R0.180 C[N+](C)(C)CCCC(=O)CC#N 1458a_100051588842_100016990835 [0,2,0,0,0,0|1,0,0]=3 1501 B11R0.180 C[N+](C)(C)CCCC(=O)CCF 1458a_100000085584_100011217306 [0,2,0,0,0,0|1,0,0]=3 1502 B11R0.180 C[N+](C)(C)CCCC(=O)CCO 1458a_100000085584_100000211926 [0,2,0,0,0,0|0,0,0]=2 1503 B11R0.180 C[N+](C)(C)CCCC(=O)CCO 1458a_100011216618_100016990835 [0,2,0,0,0,0|0,0,0]=2 1504 B11R0.180 C[N+](C)(C)CCNC(=O)C=CBr 1626a_100000106457_100016273825 [0,2,0,0,0,0|2,0,0]=4 1505 B11R0.180 C[N+](C)(C)CCNC(=O)C=CBr 240690a_100000106457_100016273825 [0,2,0,0,0,0|2,0,0]=4 1506 B11R0.180 C[N+](C)(C)CCNC(=O)C=CCl 1626a_100000106457_200016279998 [0,2,0,0,0,0|2,0,0]=4 1507 B11R0.180 C[N+](C)(C)CCNC(=O)C=CCl 240690a_100000106457_200016279998 [0,2,0,0,0,0|2,0,0]=4 1508 B11R0.180 C[N+](C)(C)CCNC(=O)C=CI 1626a_100000106457_100016256311 [0,2,0,0,0,0|2,0,0]=4 1509 B11R0.180 C[N+](C)(C)CCNC(=O)CC#N 1626a_100000106457_100051588842 [0,2,0,0,0,0|2,0,0]=4 1510 B11R0.180 C[N+](C)(C)CCNC(=O)CC#N 240690a_100000106457_100051588842 [0,2,0,0,0,0|2,0,0]=4 1511 B11R0.180 C[N+](C)(C)CCNC(=O)CCO 240690a_100000106457_100011216618 [0,2,0,0,0,0|1,0,0]=3 1512 B11R0.180 C[N+](C)(C)CSCC(=O)NCO 62a_100000185155_200000036245 [0,2,0,0,0,0|1,0,0]=3 1513 B11R0.180 C[N+](C)(C)CSCC(=O)NCO 62a_200000036245_100000185155 [0,2,0,0,0,0|1,0,0]=3 1514 B11R0.180 C[Si](C)(C)CCCC(=O)C=CBr 1458a_100016273825_100011219597 [0,2,0,0,0,0|2,0,0]=4 1515 B11R0.180 C[Si](C)(C)CCCC(=O)C=CCl 1458a_200016279998_100011219597 [0,2,0,0,0,0|2,0,0]=4 1516 B11R0.180 C[Si](C)(C)CCCC(=O)C=CI 1458a_100016256311_100011219597 [0,2,0,0,0,0|2,0,0]=4 1517 B11R0.180 C[Si](C)(C)CCCC(=O)CC#N 1458a_100051588842_100011219597 [0,2,0,0,0,0|2,0,0]=4 1518 B11R0.180 C[Si](C)(C)CCCC(=O)CCO 1458a_100011216618_100011219597 [0,2,0,0,0,0|1,0,0]=3 1519 B11R0.180 C[Si](C)(C)CSCC(=O)NCO 62a_100000037933_100000185155 [0,2,0,0,0,0|2,0,0]=4 1520 B11R0.180 C[Si](C)(C)CSCC(=O)NCO 62a_100000185155_100000037933 [0,2,0,0,0,0|2,0,0]=4 1521 B11R0.180 C[Si](C)(C)OCCC(=O)CCO 1458a_100011216618_200000032530 [0,2,0,0,0,0|2,0,0]=4 1522 B11R0.290 CCC(=O)C(C)SC[N+](C)(C)C 62a_100000742827_200000036245 [0,2,0,0,0,0|2,0,0]=4 1523 B11R0.290 CCC(=O)C(C)SC[N+](C)(C)C 62a_200000036245_100000742827 [0,2,0,0,0,0|2,0,0]=4 1524 B11R0.290 CNC(=O)C(=O)CC[N+](C)(C)C 1458a_100011218921_100000085578 [0,2,0,0,0,0|1,0,1]=4 1525 B11R0.290 CNC(=O)C(C)SC[N+](C)(C)C 62a_100000209862_200000036245 [0,2,0,0,0,0|2,0,0]=4 1526 B11R0.290 CNC(=O)C(C)SC[N+](C)(C)C 62a_200000036245_100000731044 [0,2,0,0,0,0|2,0,0]=4 1527 B11R0.290 CNC(=O)C(F)SC[N+](C)(C)C 62a_100009813575_200000036245 [0,2,0,0,0,0|2,0,0]=4 1528 B11R0.290 CNC(=O)C(F)SC[N+](C)(C)C 62a_200000036245_100009813575 [0,2,0,0,0,0|2,0,0]=4 1529 B11R0.290 COC(=O)C(C)COC(C)(C)C 34a_100000749362_100000210625 [0,2,0,0,0,0|2,0,0]=4 1530 B11R0.290 COC(=O)C(C)COC(C)(C)C 34a_100015890283_100000698445 [0,2,0,0,0,0|2,0,0]=4 1531 B11R0.290 COC(=O)C(C)CSC(C)(C)C 62a_100000211941_100000698445 [0,2,0,0,0,0|2,0,0]=4 1532 B11R0.290 COC(=O)C(C)CSC(C)(C)C 62a_100000698445_100000211941 [0,2,0,0,0,0|2,0,0]=4 1533 B11R0.290 COC(=O)C(C)NCC(C)(C)C 2230a_100000743828_100000211248 [0,2,0,0,0,0|2,0,0]=4 1534 B11R0.290 COC(=O)C(C)OCC(C)(C)C 34a_100011215400_100011219605 [0,2,0,0,0,0|2,0,0]=4 1535 B11R0.290 COC(=O)C(C)SCC(C)(C)C 62a_100000211248_100011219605 [0,2,0,0,0,0|2,0,0]=4 1536 B11R0.290 COC(=O)C(C)SCC(C)(C)C 62a_100011219605_100000211248 [0,2,0,0,0,0|2,0,0]=4 1537 B11R0.290 COC(=O)C(C)SC[N+](C)(C)C 62a_100000211248_200000036245 [0,2,0,0,0,0|1,0,0]=3 1538 B11R0.290 COC(=O)C(C)SC[N+](C)(C)C 62a_200000036245_100000211248 [0,2,0,0,0,0|1,0,0]=3 1539 B11R0.290 COC(=O)C(C)SC[Si](C)(C)C 62a_100000037933_100000211248 [0,2,0,0,0,0|2,0,0]=4 1540 B11R0.290 COC(=O)C(C)SC[Si](C)(C)C 62a_100000211248_100000037933 [0,2,0,0,0,0|2,0,0]=4 1541 B11R0.290 COC(=O)C(F)COC(C)(C)C 34a_200009849844_100000210625 [0,2,0,0,0,0|2,0,0]=4 1542 B11R0.290 COC(=O)[C@H](N)COC(C)(C)C 34a_100000003586_100000210625 [0,2,0,0,0,0|2,0,0]=4 1543 B11R0.320 CC(C)(C#N)CCCC(=O)CO 1458a_100000210174_100000759902 [0,2,0,0,0,0|1,0,1]=4 1544 B11R0.320 CCC(C)(C)COCC(=O)OC 7a_100000765029_100000747449 [0,2,0,0,0,0|2,0,0]=4 1545 B11R0.320 CCC(C)(C)NCCC(=O)OC 2230a_100000211385_100000204255 [0,2,0,0,0,0|2,0,0]=4 1546 B11R0.320 CCC(C)(C)OCCC(=O)OC 7a_100000210230_100000204255 [0,2,0,0,0,0|2,0,0]=4 1547 B11R0.320 CCC(C)(C)SCCC(=O)OC 62a_100000032637_100000204255 [0,2,0,0,0,0|2,0,0]=4 1548 B11R0.320 CCC(C)(C)SCCC(=O)OC 62a_100000204255_100000032637 [0,2,0,0,0,0|2,0,0]=4 1549 B11R0.320 COC(=O)CCNC(C)(C)CO 2230a_100000210608_100000204255 [0,2,0,0,0,0|2,0,0]=4 1550 B11R0.320 COC(=O)CCOC(C)(C)CCl 7a_100000764493_100000204255 [0,2,0,0,0,0|2,0,0]=4 1551 B11R0.320 COC(=O)CNCC(C)(C)CO 2230a_100020635058_100000747449 [0,2,0,0,0,0|2,0,0]=4 1552 B11R0.320 COC(=O)CNCC(C)(C)OC 2230a_100000763424_100000747449 [0,2,0,0,0,0|2,0,0]=4 1553 B11R0.320 COC(=O)COCC(C)(C)CCl 7a_100011217199_100000747449 [0,2,0,0,0,0|2,0,0]=4 1554 B11R0.320 COC(=O)CSCC(C)(C)CO 62a_100000747449_100009813988 [0,2,0,0,0,0|2,0,0]=4 1555 B11R0.320 COC(=O)CSCC(C)(C)CO 62a_100009813988_100000747449 [0,2,0,0,0,0|2,0,0]=4 1556 B11R0.320 COC(=O)CSCC(C)(C)OC 62a_100000701081_100000747449 [0,2,0,0,0,0|2,0,0]=4 1557 B11R0.320 COC(=O)CSCC(C)(C)OC 62a_100000747449_100000701081 [0,2,0,0,0,0|2,0,0]=4 1558 B11R0.104 C=CC[Si](C)(C)CNCC(=O)O 269956a_100016091260_100000046978 [0,2,0,0,0,0|2,0,0]=4 1559 B11R0.104 CCO[Si](C)(C)CCCC(=O)C 1458a_100000070787_100000070546 [0,2,0,0,0,0|2,0,0]=4 1560 B11R0.104 CCO[Si](C)(C)CNCC(=O)O 269956a_100016091260_200000065227 [0,2,0,0,0,0|2,0,0]=4 1561 B11R0.104 C[N+](C)(CCO)CNCC(=O)O 269956a_100016091260_200010270792 [0,2,0,0,0,0|1,0,0]=3 1562 B11R0.104 C[N+](C)(CCO)CSCC(=O)N 62a_100000747473_200010270792 [0,2,0,0,0,0|2,0,0]=4 1563 B11R0.104 C[N+](C)(CCO)CSCC(=O)N 62a_200010270792_100000747473 [0,2,0,0,0,0|2,0,0]=4 1564 B11R0.104 C[N+](C)(CCO)CSCC(=O)[O-] 62a_100020667443_200010270792 [0,2,0,0,0,0|1,0,1]=4 1565 B11R0.104 C[N+](C)(CCO)CSCC(=O)[O-] 62a_200010270792_100020667443 [0,2,0,0,0,0|1,0,1]=4 1566 B11R0.213 COC(C)(CNCC(=O)O)OC 269956a_100016091260_100000766008 [0,2,0,0,0,0|2,0,0]=4 1567 B11R0.213 CO[Si](C)(CNCC(=O)O)OC 269956a_100016091260_100000067953 [0,2,0,0,0,0|2,0,0]=4 1568 B11R0.302 CCC(C)(C)NCC(C)C(=O)O 269956a_100000749485_100000032637 [0,2,0,0,0,0|2,0,0]=4 1569 B11R0.302 CCC(C)(C)NCC(F)C(=O)O 269956a_100000084737_100000032637 [0,2,0,0,0,0|2,0,0]=4 1570 B11R0.302 COC(C)(C)CN[C@@H](C)C(=O)O 269956a_100000743915_100000701081 [0,2,0,0,0,0|2,0,0]=4 1571 B11R0.302 C[C@H](NCC(C)(C)CO)C(=O)O 269956a_100000743915_100009813988 [0,2,0,0,0,0|2,0,0]=4 1572 B11R0.313 C=C[C@H](NCC(C)(C)C)C(=O)O 269956a_100016992060_100011219605 [0,2,0,0,0,0|2,0,0]=4 1573 B11R0.313 C=C[C@H](NC[N+](C)(C)C)C(=O)O 269956a_100016992060_200000036245 [0,2,0,0,0,0|1,0,0]=3 1574 B11R0.313 C=C[C@H](NC[Si](C)(C)C)C(=O)O 269956a_100016992060_100000037933 [0,2,0,0,0,0|2,0,0]=4 1575 B11R0.313 CC(C)(C)CC[C@H](N[13CH3])C(=O)O 269956a_200014094532_200025704644 [0,2,0,0,0,0|1,0,0]=3 1576 B11R0.313 CC(C)(C)CNC(CO)C(=O)O 269956a_100000187304_100011219605 [0,2,0,0,0,0|2,0,0]=4 1577 B11R0.313 CC(C)(C)OC[C@H](N[13CH3])C(=O)O 269956a_100000704425_200025704644 [0,2,0,0,0,0|2,0,0]=4 1578 B11R0.313 CC(C)(C)SC[C@@H](N[13CH3])C(=O)O 269956a_100015207734_200025704644 [0,2,0,0,0,0|2,0,0]=4 1579 B11R0.313 CCC(SC[N+](C)(C)C)C(=O)N 62a_100000750255_200000036245 [0,2,0,0,0,0|2,0,0]=4 1580 B11R0.313 CCC(SC[N+](C)(C)C)C(=O)N 62a_200000036245_100000750255 [0,2,0,0,0,0|2,0,0]=4 1581 B11R0.313 CC[C@@H](NCC(C)(C)C)C(=O)O 269956a_100000747097_100011219605 [0,2,0,0,0,0|2,0,0]=4 1582 B11R0.313 CC[C@@H](NC[N+](C)(C)C)C(=O)O 269956a_100000747097_200000036245 [0,2,0,0,0,0|1,0,0]=3 1583 B11R0.313 CC[C@@H](NC[Si](C)(C)C)C(=O)O 269956a_100000747097_100000037933 [0,2,0,0,0,0|2,0,0]=4 1584 B11R0.313 CN[C@@H](CCC(C)(C)C)C(=O)O 269956a_200014094532_200000210301 [0,2,0,0,0,0|1,0,0]=3 1585 B11R0.313 CN[C@@H](COC(C)(C)C)C(=O)O 269956a_100000704425_200000210301 [0,2,0,0,0,0|2,0,0]=4 1586 B11R0.313 CN[C@H](CSC(C)(C)C)C(=O)O 269956a_100015207734_200000210301 [0,2,0,0,0,0|2,0,0]=4 1587 B11R0.313 C[N+](C)(C)CNC(CO)C(=O)O 269956a_100000187304_200000036245 [0,2,0,0,0,0|1,0,0]=3 1588 B11R0.313 C[Si](C)(C)CNC(CO)C(=O)O 269956a_100000187304_100000037933 [0,2,0,0,0,0|2,0,0]=4 1589 B11R0.429 CC(=O)C(C)(C)SC[N+](C)(C)C 62a_100000075568_200000036245 [0,2,0,0,0,0|2,0,0]=4 1590 B11R0.429 CC(=O)C(C)(C)SC[N+](C)(C)C 62a_200000036245_100000075568 [0,2,0,0,0,0|2,0,0]=4 1591 B11R0.429 CC(C)(C)NCC(C)(C)C(=O)O 269956a_100000693527_100000211941 [0,2,0,0,0,0|2,0,0]=4 1592 B11R0.429 CC(C)(C)NCC(F)(F)C(=O)O 269956a_100000734215_100000211941 [0,2,0,0,0,0|2,0,0]=4 1593 B11R0.429 CC(C)(SC[N+](C)(C)C)C(=O)N 62a_100000702505_200000036245 [0,2,0,0,0,0|2,0,0]=4 1594 B11R0.429 CC(C)(SC[N+](C)(C)C)C(=O)N 62a_200000036245_100000702505 [0,2,0,0,0,0|2,0,0]=4 1595 B11R0.429 C[N+](C)(C)CSC(F)(F)C(=O)N 62a_100009811971_200000036245 [0,2,0,0,0,0|2,0,0]=4 1596 B11R0.429 C[N+](C)(C)CSC(F)(F)C(=O)N 62a_200000036245_100009811971 [0,2,0,0,0,0|2,0,0]=4 1597 B11R0.429 C[N+](C)(C)CSC(F)(F)C(=O)[O-] 62a_100000745680_200000036245 [0,2,0,0,0,0|1,0,1]=4 1598 B11R0.429 C[N+](C)(C)CSC(F)(F)C(=O)[O-] 62a_200000036245_100000745680 [0,2,0,0,0,0|1,0,1]=4 1599 B9R1.99 CC1(CC1)CNCC=O 2230a_100000766693_200015260668 [1,0,0,1,0,0|2,0,0]=4 1600 B9R1.99 CC1(CC1)COCC=O 7a_100000698024_200015260668 [1,0,0,1,0,0|2,0,0]=4 1601 B9R1.136 CC1(CN(C1)CC=O)C 2230a_100000753659_200015260668 [1,0,0,1,0,0|2,0,0]=4 1602 B9R1.136 CC1(CN(C1)CC=O)C 269982a_100000753659_200015260668 [1,0,0,1,0,0|2,0,0]=4 1603 B9R1.35 CC(=O)C1CCN(C1)C 1458a_100000739633_200000210301 [1,0,0,1,0,0|1,0,1]=4 1604 B9R1.35 CC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_200000210301 [1,0,0,1,0,0|2,0,0]=4 1605 B9R1.35 CN1CCC(C1)C(=O)N 2230a_100000752358_200000210301 [1,0,0,1,0,0|1,0,1]=4 1606 B9R1.35 CN1CCC(C1)C(=O)N 269982a_100000752358_200000210301 [1,0,0,1,0,0|1,0,1]=4 1607 B9R1.35 CN1CCC(C1)C(=O)N 34a_100000752358_200000210301 [1,0,0,1,0,0|1,0,1]=4 1608 B9R1.35 CN1CCC(C1)C(=O)[13CH3] 1458a_100000739633_200025704644 [1,0,0,1,0,0|1,0,1]=4 1609 B9R1.35 [13CH3]C(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_200025704644 [1,0,0,1,0,0|2,0,0]=4 1610 B9R1.35 [13CH3]N1CCC(C1)C(=O)N 2230a_100000752358_200025704644 [1,0,0,1,0,0|1,0,1]=4 1611 B9R1.35 [13CH3]N1CCC(C1)C(=O)N 269982a_100000752358_200025704644 [1,0,0,1,0,0|1,0,1]=4 1612 B9R1.35 [13CH3]N1CCC(C1)C(=O)N 34a_100000752358_200025704644 [1,0,0,1,0,0|1,0,1]=4 1613 B9R1.53 CN(C)CC1CC(=O)C1 2230a_100102631434_100009874392 [1,0,0,1,0,0|1,0,1]=4 1614 B9R1.53 CN(C)CC1CC(=O)C1 269982a_100102631434_100009874392 [1,0,0,1,0,0|1,0,1]=4 1615 B9R1.53 CN1CC(C1)CC(=O)O 269956a_100016993960_200000210301 [1,0,0,1,0,0|0,0,1]=3 1616 B9R1.53 [13CH3]N1CC(C1)CC(=O)O 269956a_100016993960_200025704644 [1,0,0,1,0,0|0,0,1]=3 1617 B9R1.85 O=C(O)CNCC1CC1 269956a_100016091260_100000742324 [1,0,0,1,0,0|2,0,0]=4 1618 B9R1.164 CC(=O)C1CC(C1)(C)C 1458a_100000695498_200000210301 [0,0,0,1,1,0|2,0,0]=4 1619 B9R1.164 CC1(CC(C1)C(=O)[13CH3])C 1458a_100000695498_200025704644 [0,0,0,1,1,0|2,0,0]=4 1620 B11R1.76 CC(C)(C)OC1CCC(=O)C1 34a_100012614533_100000210625 [0,0,0,1,0,1|2,0,0]=4 1621 B11R1.76 CC(C)(C)OC1COC(=O)O1 34a_100015890283_100000032252 [0,0,0,1,0,1|2,0,0]=4 1622 B11R1.76 CC(C)(C)SC1COC(=O)O1 62a_100000211941_100000032252 [0,0,0,1,0,1|2,0,0]=4 1623 B11R1.76 C[N+](C)(C)CN1CCC(C1)O 269982a_100011215560_200000036245 [0,0,0,1,0,1|1,0,1]=4 1624 B11R1.343 C[N+](C)(C)CCOCC1CO1 7a_200020618287_102125554688 [0,0,0,1,0,1|1,0,1]=4 1625 B11R1.343 C[N+](C)(C)CCOC[C@@H]1CO1 34a_100000757423_100000085578 [0,0,0,1,0,1|1,0,1]=4 1626 B11R1.343 C[N+](C)(C)CCOC[C@@H]1CO1 7a_200020618287_100000745022 [0,0,0,1,0,1|1,0,1]=4 1627 B11R1.343 C[N+](C)(C)CCSCC1CO1 62a_100000085578_102125554688 [0,0,0,1,0,1|1,0,1]=4 1628 B11R1.343 C[N+](C)(C)CCSCC1CO1 62a_102125554688_100000085578 [0,0,0,1,0,1|1,0,1]=4 1629 B11R1.343 C[N+](C)(C)CCSC[C@@H]1CO1 62a_100000085578_100000745022 [0,0,0,1,0,1|1,0,1]=4 1630 B11R1.343 C[N+](C)(C)CCSC[C@@H]1CO1 62a_100000745022_100000085578 [0,0,0,1,0,1|1,0,1]=4 1631 B11R1.343 C[N+](C)(C)CSCCC1CO1 62a_100000732470_200000036245 [0,0,0,1,0,1|1,0,1]=4 1632 B11R1.343 C[N+](C)(C)CSCCC1CO1 62a_200000036245_100000732470 [0,0,0,1,0,1|1,0,1]=4 1633 B11R1.577 CC(C)(C)CSC1CC(=O)C1 62a_100009894365_100011219605 [0,0,0,1,0,1|2,0,0]=4 1634 B11R1.577 CC(C)(C)NCC1CC(=O)C1 2230a_100000715429_100009874392 [0,0,0,1,0,1|2,0,0]=4 1635 B11R1.577 CC(C)(C)OCC1CC(=O)C1 34a_100000101936_100000210625 [0,0,0,1,0,1|2,0,0]=4 1636 B11R1.577 CC(C)(C)OCC1CC(=O)C1 7a_100015890283_100009874392 [0,0,0,1,0,1|2,0,0]=4 1637 B11R1.577 CC(C)(C)SCC1CC(=O)C1 62a_100000211941_100009874392 [0,0,0,1,0,1|2,0,0]=4 1638 B11R1.577 CC(C)(C)SCC1CC(=O)C1 62a_100009874392_100000211941 [0,0,0,1,0,1|2,0,0]=4 1639 B11R1.577 C[N+](C)(C)CCN1CC(C1)O 269982a_100000749847_100000085578 [0,0,0,1,0,1|1,0,1]=4 1640 B11R1.577 C[N+](C)(C)CSC1CC(=O)C1 62a_100009894365_200000036245 [0,0,0,1,0,1|1,0,0]=3 1641 B11R1.577 C[Si](C)(C)CSC1CC(=O)C1 62a_100009894365_100000037933 [0,0,0,1,0,1|2,0,0]=4 1642 B11R1.710 CC1(CCN(C1)CC(=O)N)C 2230a_100000764714_100000747473 [0,0,0,1,0,1|2,0,0]=4 1643 B11R1.710 CC1(CCN(C1)CC(=O)N)C 269982a_100000764714_100000187820 [0,0,0,1,0,1|2,0,0]=4 1644 B11R1.710 CC1(CCN(C1)CC(=O)[O-])C 269982a_100000764714_100020667443 [0,0,0,1,0,1|1,0,1]=4 1645 B11R1.714 CC(=O)CCN1CC(C1)(C)C 269982a_100000753659_100000053229 [0,0,0,1,0,1|2,0,0]=4 1646 B11R1.714 CC1(CN(C1)CCC(=O)N)C 2230a_100000753659_100000744528 [0,0,0,1,0,1|2,0,0]=4 1647 B11R1.714 CC1(CN(C1)CCC(=O)N)C 269982a_100000753659_100000744528 [0,0,0,1,0,1|2,0,0]=4 1648 B11R1.717 CC(=O)CCCOC1(CC1)C 7a_100011725673_100011215641 [0,0,0,1,0,1|2,0,0]=4 1649 B11R1.717 CC(=O)CCOCC1(CC1)C 7a_100000698024_100000053229 [0,0,0,1,0,1|2,0,0]=4 1650 B11R1.717 CC1(CC1)CNCCC(=O)N 2230a_100000766693_100000744528 [0,0,0,1,0,1|2,0,0]=4 1651 B11R1.717 CC1(CC1)COCCC(=O)N 7a_100000698024_100000744528 [0,0,0,1,0,1|2,0,0]=4 1652 B11R1.717 CC1(CC1)OCCCC(=O)N 7a_100011725673_100102525003 [0,0,0,1,0,1|2,0,0]=4 1653 B11R1.730 CC(=O)C1CCOC(C1)(C)C 1458a_100000070787_100010191092 [0,0,0,1,0,1|2,0,0]=4 1654 B11R1.730 CC(=O)N1CCCC(C1)(C)C 11a_100000716857_100015343762 [0,0,0,1,0,1|2,0,0]=4 1655 B11R1.730 CC(=O)N1CCCC(C1)(C)C 1626a_100000716857_100015343762 [0,0,0,1,0,1|2,0,0]=4 1656 B11R1.730 CC(=O)N1CCCC(C1)(C)C 240690a_100000716857_100015343762 [0,0,0,1,0,1|2,0,0]=4 1657 B11R1.730 CC(=O)N1CCCC(C1)(C)C 527a_100000716857_100103153847 [0,0,0,1,0,1|2,0,0]=4 1658 B11R1.731 CC(C)(C)N1CCC1C(=O)O 269956a_100000021838_100000211941 [0,0,0,1,0,1|1,0,0]=3 1659 B11R1.923 CC1(CC1COCC(=O)N)C 34a_100000728257_100000187820 [0,0,0,1,0,1|2,0,0]=4 1660 B11R1.923 CC1(CC1COCC(=O)N)C 7a_100000728257_100000187820 [0,0,0,1,0,1|2,0,0]=4 1661 B11R1.923 CC1(CC1COCC(=O)[O-])C 34a_100000728257_100020667443 [0,0,0,1,0,1|1,0,1]=4 1662 B11R1.160 C[N+](C)(C)CSC1CCC1=O 62a_100009892977_200000036245 [0,1,0,1,0,0|2,0,0]=4 1663 B11R1.160 C[N+](C)(C)CSC1CCC1=O 62a_200000036245_100009892977 [0,1,0,1,0,0|2,0,0]=4 1664 B11R1.866 CC1(CCN(C1)C(=O)CO)C 240690a_100000764714_100000210174 [0,1,0,1,0,0|2,0,0]=4 1665 B11R1.866 CC1(CCN(C1)C(=O)CO)C 527a_100000764714_100000210174 [0,1,0,1,0,0|2,0,0]=4 1666 B11R1.897 COC(=O)CN1CC(C1)(C)C 2230a_100000753659_100000747449 [0,1,0,1,0,0|2,0,0]=4 1667 B11R1.897 COC(=O)CN1CC(C1)(C)C 269982a_100000753659_100000747449 [0,1,0,1,0,0|2,0,0]=4 1668 B11R1.1029 COC(=O)CCNC1(CC1)C 2230a_100000757604_100000204255 [0,1,0,1,0,0|2,0,0]=4 1669 B11R1.1029 COC(=O)CCOC1(CC1)C 7a_100011725673_100000204255 [0,1,0,1,0,0|2,0,0]=4 1670 B11R1.1029 COC(=O)CNCC1(CC1)C 2230a_100000766693_100000747449 [0,1,0,1,0,0|2,0,0]=4 1671 B11R1.1029 COC(=O)COCC1(CC1)C 7a_100000698024_100000747449 [0,1,0,1,0,0|2,0,0]=4 1672 B11R1.515 CC1(SCC(N1[13CH3])C(=O)O)C 269956a_100000706825_200025704644 [0,1,0,1,0,0|2,0,0]=4 1673 B11R1.515 CN1C(CSC1(C)C)C(=O)O 269956a_100000706825_200000210301 [0,1,0,1,0,0|2,0,0]=4 1674 B11R1.924 CC1(CCC1)CNCC(=O)O 269956a_100016091260_100000726658 [0,1,0,1,0,0|2,0,0]=4 1675 B11R1.924 CC1(COC1)CNCC(=O)O 269956a_100016091260_100000066812 [0,1,0,1,0,0|2,0,0]=4 1676 B7R0.6 CC(=O)CCC(C)C 1458a_100000070787_100000210312 [1,0,0,0,1,0|2,0,0]=4 1677 B7R0.6 CC(=O)CCC(C)C 1458a_100000181311_200000210301 [1,0,0,0,1,0|2,0,0]=4 1678 B7R0.6 CC(=O)CCN(C)C 269982a_100102631434_100000053229 [1,0,0,0,1,0|1,0,1]=4 1679 B7R0.6 CC(=O)CC[S+](C)C 1458a_100009452791_200000210301 [1,0,0,0,1,0|2,0,0]=4 1680 B7R0.6 CC(C)CCC(=O)[13CH3] 1458a_100000181311_200025704644 [1,0,0,0,1,0|2,0,0]=4 1681 B7R0.6 CC(C)NCC(=O)O 269956a_100016091260_100000210206 [1,0,0,0,1,0|2,0,0]=4 1682 B7R0.6 CN(C)CCC(=O)N 2230a_100000730477_200000210301 [1,0,0,0,1,0|1,0,1]=4 1683 B7R0.6 CN(C)CCC(=O)N 2230a_100102631434_100000744528 [1,0,0,0,1,0|1,0,1]=4 1684 B7R0.6 CN(C)CCC(=O)N 269982a_100102631434_100000744528 [1,0,0,0,1,0|1,0,1]=4 1685 B7R0.6 CN([13CH3])CCC(=O)N 2230a_100000730477_200025704644 [1,0,0,0,1,0|1,0,1]=4 1686 B7R0.6 C[S+](C)CCC(=O)[13CH3] 1458a_100009452791_200025704644 [1,0,0,0,1,0|2,0,0]=4 1687 B7R0.9 CC(=O)CC(C)(C)C 1458a_100000211214_200000210301 [0,0,0,0,2,0|2,0,0]=4 1688 B7R0.9 CC(=O)C[N+](C)(C)C 1458a_100000033712_200000210301 [0,0,0,0,2,0|1,0,0]=3 1689 B7R0.9 CC(=O)C[Si](C)(C)C 1458a_100000070787_100000233785 [0,0,0,0,2,0|2,0,0]=4 1690 B7R0.9 CC(=O)C[Si](C)(C)C 1458a_100011218504_200000210301 [0,0,0,0,2,0|2,0,0]=4 1691 B7R0.9 CC(C)(C)CC(=O)[13CH3] 1458a_100000211214_200025704644 [0,0,0,0,2,0|2,0,0]=4 1692 B7R0.9 C[N+](C)(C)CC(=O)[13CH3] 1458a_100000033712_200025704644 [0,0,0,0,2,0|1,0,0]=3 1693 B7R0.9 C[Si](C)(C)CC(=O)[13CH3] 1458a_100011218504_200025704644 [0,0,0,0,2,0|2,0,0]=4 1694 B9R0.55 C=C(C)CCNCC(=O)O 269956a_100016091260_100000730704 [1,0,0,0,0,1|1,0,1]=4 1695 B9R0.55 CC(=CCNCC(=O)O)C 269956a_100016091260_100000761012 [1,0,0,0,0,1|1,0,1]=4 1696 B9R0.55 CC(=O)CCCCC(C)C 1458a_100000070787_100011216152 [1,0,0,0,0,1|2,0,0]=4 1697 B9R0.55 CC(=O)CCCCC(C)C 1458a_100011933920_200000210301 [1,0,0,0,0,1|2,0,0]=4 1698 B9R0.55 CC(=O)CCCCN(C)C 269982a_100102631434_100000735457 [1,0,0,0,0,1|1,0,1]=4 1699 B9R0.55 CC(=O)CCCNC(C)C 34a_100138425928_100000685027 [1,0,0,0,0,1|2,0,0]=4 1700 B9R0.55 CC(=O)CCCOC(C)C 34a_100000212225_100000685027 [1,0,0,0,0,1|2,0,0]=4 1701 B9R0.55 CC(=O)CCCOC(C)C 34a_100000759063_100000210206 [1,0,0,0,0,1|2,0,0]=4 1702 B9R0.55 CC(=O)CCCOC(C)C 7a_100000759063_100000210206 [1,0,0,0,0,1|2,0,0]=4 1703 B9R0.55 CC(=O)CCCSC(C)C 62a_100000210206_100011215641 [1,0,0,0,0,1|2,0,0]=4 1704 B9R0.55 CC(=O)CCCSC(C)C 62a_100011215641_100000210206 [1,0,0,0,0,1|2,0,0]=4 1705 B9R0.55 CC(=O)CCNCC(=O)O 269956a_100016091260_100000053229 [1,0,0,0,0,1|2,0,0]=4 1706 B9R0.55 CC(=O)CCOCC(C)C 34a_100000759926_100000210624 [1,0,0,0,0,1|2,0,0]=4 1707 B9R0.55 CC(=O)CCOCC(C)C 7a_100000759926_100000210760 [1,0,0,0,0,1|2,0,0]=4 1708 B9R0.55 CC(=O)CCSCC(C)C 62a_100000053229_100000210760 [1,0,0,0,0,1|2,0,0]=4 1709 B9R0.55 CC(=O)CCSCC(C)C 62a_100000210624_100000053229 [1,0,0,0,0,1|2,0,0]=4 1710 B9R0.55 CC(=O)COCCC(C)C 34a_100000211253_100000210312 [1,0,0,0,0,1|2,0,0]=4 1711 B9R0.55 CC(=O)NCCCC(C)C 11a_200000737386_100015343762 [1,0,0,0,0,1|2,0,0]=4 1712 B9R0.55 CC(=O)NCCCC(C)C 1626a_200000737386_100015343762 [1,0,0,0,0,1|2,0,0]=4 1713 B9R0.55 CC(=O)NCCCC(C)C 240690a_200000737386_100015343762 [1,0,0,0,0,1|2,0,0]=4 1714 B9R0.55 CC(=O)NCCCC(C)C 527a_200000737386_100103153847 [1,0,0,0,0,1|2,0,0]=4 1715 B9R0.55 CC(=O)NCCCN(C)C 240690a_102531767803_100015343762 [1,0,0,0,0,1|1,0,1]=4 1716 B9R0.55 CC(=O)NCCCN(C)C 527a_102531767803_100103153847 [1,0,0,0,0,1|1,0,1]=4 1717 B9R0.55 CC(=O)OCCCN(C)C 269982a_100102631434_100000042594 [1,0,0,0,0,1|1,0,1]=4 1718 B9R0.55 CC(=O)SCCCN(C)C 2230a_100102631434_100000038929 [1,0,0,0,0,1|1,0,1]=4 1719 B9R0.55 CC(=O)SCCCN(C)C 269982a_100102631434_100000038929 [1,0,0,0,0,1|1,0,1]=4 1720 B9R0.55 CC(C)CCCCC(=O)[13CH3] 1458a_100011933920_200025704644 [1,0,0,0,0,1|2,0,0]=4 1721 B9R0.55 CC(C)CCNCC(=O)N 2230a_100000711301_100000210312 [1,0,0,0,0,1|2,0,0]=4 1722 B9R0.55 CC(C)CCNCC(=O)O 269956a_100016091260_100000210312 [1,0,0,0,0,1|1,0,0]=3 1723 B9R0.55 CC(C)CCOCC(=O)N 34a_100000210254_100000187820 [1,0,0,0,0,1|2,0,0]=4 1724 B9R0.55 CC(C)CCOCC(=O)N 7a_100000210254_100000187820 [1,0,0,0,0,1|2,0,0]=4 1725 B9R0.55 CC(C)CCOCC(=O)[O-] 34a_100000210254_100020667443 [1,0,0,0,0,1|1,0,1]=4 1726 B9R0.55 CC(C)CCSCC(=O)N 62a_100000210312_100000747473 [1,0,0,0,0,1|2,0,0]=4 1727 B9R0.55 CC(C)CCSCC(=O)N 62a_100000747473_100000210312 [1,0,0,0,0,1|2,0,0]=4 1728 B9R0.55 CC(C)CCSCC(=O)[O-] 62a_100000210312_100020667443 [1,0,0,0,0,1|1,0,1]=4 1729 B9R0.55 CC(C)CCSCC(=O)[O-] 62a_100020667443_100000210312 [1,0,0,0,0,1|1,0,1]=4 1730 B9R0.55 CC(C)CNCCC(=O)N 2230a_100000210953_100000744528 [1,0,0,0,0,1|2,0,0]=4 1731 B9R0.55 CC(C)CNCCC(=O)N 34a_100000210953_100000731001 [1,0,0,0,0,1|2,0,0]=4 1732 B9R0.55 CC(C)CNOCC(=O)O 269956a_100000106656_100000210760 [1,0,0,0,0,1|2,0,0]=4 1733 B9R0.55 CC(C)COCCC(=O)N 34a_100000210257_100000731001 [1,0,0,0,0,1|2,0,0]=4 1734 B9R0.55 CC(C)COCCC(=O)N 34a_100000757172_100000210624 [1,0,0,0,0,1|2,0,0]=4 1735 B9R0.55 CC(C)COCCC(=O)N 7a_100000757172_100000210760 [1,0,0,0,0,1|2,0,0]=4 1736 B9R0.55 CC(C)CSCCC(=O)N 62a_100000210624_100000744528 [1,0,0,0,0,1|2,0,0]=4 1737 B9R0.55 CC(C)CSCCC(=O)N 62a_100000744528_100000210760 [1,0,0,0,0,1|2,0,0]=4 1738 B9R0.55 CC(C)NCCCC(=O)N 34a_100000739312_100000210206 [1,0,0,0,0,1|2,0,0]=4 1739 B9R0.55 CC(C)NCCCC(=O)N 34a_100138425928_100102525003 [1,0,0,0,0,1|2,0,0]=4 1740 B9R0.55 CC(C)OCCCC(=O)N 34a_100000212225_100102525003 [1,0,0,0,0,1|2,0,0]=4 1741 B9R0.55 CC(C)OCNCC(=O)O 269956a_100016091260_100000709892 [1,0,0,0,0,1|2,0,0]=4 1742 B9R0.55 CC(C)SCCCC(=O)N 62a_100000210206_100102525003 [1,0,0,0,0,1|2,0,0]=4 1743 B9R0.55 CC(C)SCCCC(=O)N 62a_100102525003_100000210206 [1,0,0,0,0,1|2,0,0]=4 1744 B9R0.55 CC(O)CCNCC(=O)O 269956a_100016091260_100012276601 [1,0,0,0,0,1|2,0,0]=4 1745 B9R0.55 CN(C)CCNCC(=O)O 269956a_100016091260_100000755713 [1,0,0,0,0,1|0,0,1]=3 1746 B9R0.55 CN(C)CCOCC(=O)N 2230a_100102631434_100000076697 [1,0,0,0,0,1|1,0,1]=4 1747 B9R0.55 CN(C)CCOCC(=O)N 269982a_100102631434_100000076697 [1,0,0,0,0,1|1,0,1]=4 1748 B9R0.55 CN(C)CCSCC(=O)N 62a_100000747473_100000755713 [1,0,0,0,0,1|1,0,1]=4 1749 B9R0.55 CN(C)CCSCC(=O)[O-] 62a_100020667443_100000755713 [1,0,0,0,0,1|0,0,2]=4 1750 B11R0.31 C=C(Br)CCOCC[N+](C)(C)C 34a_100009813270_100000085578 [0,0,0,0,0,2|2,0,0]=4 1751 B11R0.31 C=C(C)CCOCC[N+](C)(C)C 34a_100000764851_100000085578 [0,0,0,0,0,2|2,0,0]=4 1752 B11R0.31 C=C(C)CCOCC[N+](C)(C)C 7a_200020618287_100000730704 [0,0,0,0,0,2|2,0,0]=4 1753 B11R0.31 C=C(C)CCSCC[N+](C)(C)C 62a_100000085578_100000730704 [0,0,0,0,0,2|2,0,0]=4 1754 B11R0.31 C=C(C)CCSCC[N+](C)(C)C 62a_100000730704_100000085578 [0,0,0,0,0,2|2,0,0]=4 1755 B11R0.31 C=C(C)COCCC[N+](C)(C)C 34a_100000210245_100016990835 [0,0,0,0,0,2|2,0,0]=4 1756 B11R0.31 C=C(C)CSCCC[N+](C)(C)C 62a_100000748629_100016990835 [0,0,0,0,0,2|2,0,0]=4 1757 B11R0.31 C=C(C)CSCCC[N+](C)(C)C 62a_100016990835_100000211660 [0,0,0,0,0,2|2,0,0]=4 1758 B11R0.31 C=C(F)COCCC[N+](C)(C)C 34a_200010262243_100016990835 [0,0,0,0,0,2|2,0,0]=4 1759 B11R0.31 C=C(F)CSCCC[N+](C)(C)C 62a_100000042424_100016990835 [0,0,0,0,0,2|2,0,0]=4 1760 B11R0.31 C=C(F)CSCCC[N+](C)(C)C 62a_100016990835_100000042424 [0,0,0,0,0,2|2,0,0]=4 1761 B11R0.31 CC(=CCCSC[N+](C)(C)C)C 62a_100011217483_200000036245 [0,0,0,0,0,2|2,0,0]=4 1762 B11R0.31 CC(=CCCSC[N+](C)(C)C)C 62a_200000036245_100011217483 [0,0,0,0,0,2|2,0,0]=4 1763 B11R0.31 CC(=CCNCC[N+](C)(C)C)C 34a_100000718196_100000085578 [0,0,0,0,0,2|2,0,0]=4 1764 B11R0.31 CC(=CCOCC[N+](C)(C)C)C 34a_100000753907_100000085578 [0,0,0,0,0,2|2,0,0]=4 1765 B11R0.31 CC(=CCOCC[N+](C)(C)C)C 7a_200020618287_100000761012 [0,0,0,0,0,2|2,0,0]=4 1766 B11R0.31 CC(=CCSCC[N+](C)(C)C)C 62a_100000085578_100000761012 [0,0,0,0,0,2|2,0,0]=4 1767 B11R0.31 CC(=CCSCC[N+](C)(C)C)C 62a_100000761012_100000085578 [0,0,0,0,0,2|2,0,0]=4 1768 B11R0.31 CC(=O)CCCC#C[Si](C)(C)C 1458a_100000070787_200000066390 [0,0,0,0,0,2|2,0,0]=4 1769 B11R0.31 CC(=O)CCCCCC(C)(C)C 1458a_100012017116_200000210301 [0,0,0,0,0,2|2,0,0]=4 1770 B11R0.31 CC(=O)CCCCC[N+](C)(C)C 1458a_100000070787_100009813293 [0,0,0,0,0,2|1,0,0]=3 1771 B11R0.31 CC(=O)CCCCOC(C)(C)C 34a_100015890283_100009817362 [0,0,0,0,0,2|2,0,0]=4 1772 B11R0.31 CC(=O)CCCCOC(C)(C)C 7a_100015890283_100000735457 [0,0,0,0,0,2|2,0,0]=4 1773 B11R0.31 CC(=O)CCCCSC(C)(C)C 62a_100000211941_100000735457 [0,0,0,0,0,2|2,0,0]=4 1774 B11R0.31 CC(=O)CCCCSC(C)(C)C 62a_100000735457_100000211941 [0,0,0,0,0,2|2,0,0]=4 1775 B11R0.31 CC(=O)CCCOCC(C)(C)C 34a_100000759063_100011219605 [0,0,0,0,0,2|2,0,0]=4 1776 B11R0.31 CC(=O)CCCOC[Si](C)(C)C 7a_100000759063_100000233785 [0,0,0,0,0,2|2,0,0]=4 1777 B11R0.31 CC(=O)CCCSCC(C)(C)C 62a_100011215641_100011219605 [0,0,0,0,0,2|2,0,0]=4 1778 B11R0.31 CC(=O)CCCSCC(C)(C)C 62a_100011219605_100011215641 [0,0,0,0,0,2|2,0,0]=4 1779 B11R0.31 CC(=O)CCCSC[N+](C)(C)C 62a_100011215641_200000036245 [0,0,0,0,0,2|1,0,0]=3 1780 B11R0.31 CC(=O)CCCSC[N+](C)(C)C 62a_200000036245_100011215641 [0,0,0,0,0,2|1,0,0]=3 1781 B11R0.31 CC(=O)CCCSC[Si](C)(C)C 62a_100000037933_100011215641 [0,0,0,0,0,2|2,0,0]=4 1782 B11R0.31 CC(=O)CCCSC[Si](C)(C)C 62a_100011215641_100000037933 [0,0,0,0,0,2|2,0,0]=4 1783 B11R0.31 CC(=O)CCOCCC(C)(C)C 34a_100000759926_100000755188 [0,0,0,0,0,2|2,0,0]=4 1784 B11R0.31 CC(=O)CCOCCC(C)(C)C 7a_100000759926_100000755188 [0,0,0,0,0,2|2,0,0]=4 1785 B11R0.31 CC(=O)CCOCCC(C)(C)C 7a_100000765024_100000053229 [0,0,0,0,0,2|2,0,0]=4 1786 B11R0.31 CC(=O)CCOCC[N+](C)(C)C 34a_100000759926_100000085578 [0,0,0,0,0,2|1,0,0]=3 1787 B11R0.31 CC(=O)CCOCC[N+](C)(C)C 7a_100000759926_100000085578 [0,0,0,0,0,2|1,0,0]=3 1788 B11R0.31 CC(=O)CCOCC[N+](C)(C)C 7a_200020618287_100000053229 [0,0,0,0,0,2|1,0,0]=3 1789 B11R0.31 CC(=O)CCOCC[Si](C)(C)C 34a_100000759926_200000733723 [0,0,0,0,0,2|2,0,0]=4 1790 B11R0.31 CC(=O)CCOCC[Si](C)(C)C 7a_100000039746_100000053229 [0,0,0,0,0,2|2,0,0]=4 1791 B11R0.31 CC(=O)CCOCC[Si](C)(C)C 7a_100000759926_200000733723 [0,0,0,0,0,2|2,0,0]=4 1792 B11R0.31 CC(=O)CCSCCC(C)(C)C 62a_100000053229_100000755188 [0,0,0,0,0,2|2,0,0]=4 1793 B11R0.31 CC(=O)CCSCCC(C)(C)C 62a_100000755188_100000053229 [0,0,0,0,0,2|2,0,0]=4 1794 B11R0.31 CC(=O)CCSCC[N+](C)(C)C 62a_100000053229_100000085578 [0,0,0,0,0,2|1,0,0]=3 1795 B11R0.31 CC(=O)CCSCC[N+](C)(C)C 62a_100000085578_100000053229 [0,0,0,0,0,2|1,0,0]=3 1796 B11R0.31 CC(=O)CCSCC[Si](C)(C)C 62a_100000053229_200000733723 [0,0,0,0,0,2|2,0,0]=4 1797 B11R0.31 CC(=O)CCSCC[Si](C)(C)C 62a_200000733723_100000053229 [0,0,0,0,0,2|2,0,0]=4 1798 B11R0.31 CC(=O)COCCC[N+](C)(C)C 34a_100000211253_100016990835 [0,0,0,0,0,2|1,0,0]=3 1799 B11R0.31 CC(=O)COCCC[Si](C)(C)C 34a_100000211253_100011219597 [0,0,0,0,0,2|2,0,0]=4 1800 B11R0.31 CC(=O)COCCO[Si](C)(C)C 34a_100000211253_200000032530 [0,0,0,0,0,2|2,0,0]=4 1801 B11R0.31 CC(=O)NCCCNC(C)(C)C 34a_100000736810_100000210625 [0,0,0,0,0,2|2,0,0]=4 1802 B11R0.31 CC(=O)NCCCOC(C)(C)C 1626a_100011250582_100015343762 [0,0,0,0,0,2|2,0,0]=4 1803 B11R0.31 CC(=O)NCCCOC(C)(C)C 240690a_100011250582_100015343762 [0,0,0,0,0,2|2,0,0]=4 1804 B11R0.31 CC(=O)NCCCOC(C)(C)C 34a_100000752032_100000210625 [0,0,0,0,0,2|2,0,0]=4 1805 B11R0.31 CC(=O)NCCCOC(C)(C)C 527a_100011250582_100103153847 [0,0,0,0,0,2|2,0,0]=4 1806 B11R0.31 CC(=O)NCCNCC(C)(C)C 2230a_100000743828_100000189650 [0,0,0,0,0,2|2,0,0]=4 1807 B11R0.31 CC(=O)NCCNC[Si](C)(C)C 2230a_100000209853_100000037933 [0,0,0,0,0,2|2,0,0]=4 1808 B11R0.31 CC(=O)NCCOCC(C)(C)C 34a_100000158858_100011219605 [0,0,0,0,0,2|2,0,0]=4 1809 B11R0.31 CC(=O)NCCSCC(C)(C)C 62a_100000189650_100011219605 [0,0,0,0,0,2|2,0,0]=4 1810 B11R0.31 CC(=O)NCCSCC(C)(C)C 62a_100011219605_100000189650 [0,0,0,0,0,2|2,0,0]=4 1811 B11R0.31 CC(=O)NCCSC[N+](C)(C)C 62a_100000189650_200000036245 [0,0,0,0,0,2|1,0,0]=3 1812 B11R0.31 CC(=O)NCCSC[N+](C)(C)C 62a_200000036245_100000189650 [0,0,0,0,0,2|1,0,0]=3 1813 B11R0.31 CC(=O)NCCSC[Si](C)(C)C 62a_100000037933_100000189650 [0,0,0,0,0,2|2,0,0]=4 1814 B11R0.31 CC(=O)NCCSC[Si](C)(C)C 62a_100000189650_100000037933 [0,0,0,0,0,2|2,0,0]=4 1815 B11R0.31 CC(=O)OCCCOC(C)(C)C 34a_100015890283_100000042594 [0,0,0,0,0,2|2,0,0]=4 1816 B11R0.31 CC(=O)OCCCOC(C)(C)C 7a_100015890283_100000042594 [0,0,0,0,0,2|2,0,0]=4 1817 B11R0.31 CC(=O)OCCCSC(C)(C)C 62a_100000042594_100000211941 [0,0,0,0,0,2|2,0,0]=4 1818 B11R0.31 CC(=O)OCCCSC(C)(C)C 62a_100000211941_100000042594 [0,0,0,0,0,2|2,0,0]=4 1819 B11R0.31 CC(=O)OCCSCC(C)(C)C 62a_100009814007_100011219605 [0,0,0,0,0,2|2,0,0]=4 1820 B11R0.31 CC(=O)OCCSCC(C)(C)C 62a_100011219605_100009814007 [0,0,0,0,0,2|2,0,0]=4 1821 B11R0.31 CC(=O)OCCSC[N+](C)(C)C 62a_100009814007_200000036245 [0,0,0,0,0,2|1,0,0]=3 1822 B11R0.31 CC(=O)OCCSC[N+](C)(C)C 62a_200000036245_100009814007 [0,0,0,0,0,2|1,0,0]=3 1823 B11R0.31 CC(=O)OCCSC[Si](C)(C)C 62a_100000037933_100009814007 [0,0,0,0,0,2|2,0,0]=4 1824 B11R0.31 CC(=O)OCCSC[Si](C)(C)C 62a_100009814007_100000037933 [0,0,0,0,0,2|2,0,0]=4 1825 B11R0.31 CC(=O)OCSCCC(C)(C)C 62a_100000076356_100000755188 [0,0,0,0,0,2|2,0,0]=4 1826 B11R0.31 CC(=O)OCSCCC(C)(C)C 62a_100000755188_100000076356 [0,0,0,0,0,2|2,0,0]=4 1827 B11R0.31 CC(=O)OCSCC[N+](C)(C)C 62a_100000076356_100000085578 [0,0,0,0,0,2|1,0,0]=3 1828 B11R0.31 CC(=O)OCSCC[N+](C)(C)C 62a_100000085578_100000076356 [0,0,0,0,0,2|1,0,0]=3 1829 B11R0.31 CC(=O)OCSCC[Si](C)(C)C 62a_100000076356_200000733723 [0,0,0,0,0,2|2,0,0]=4 1830 B11R0.31 CC(=O)OCSCC[Si](C)(C)C 62a_200000733723_100000076356 [0,0,0,0,0,2|2,0,0]=4 1831 B11R0.31 CC(=O)SCCCNC(C)(C)C 2230a_100000715429_100000038929 [0,0,0,0,0,2|2,0,0]=4 1832 B11R0.31 CC(=O)SCCCOC(C)(C)C 34a_100015890283_100000038929 [0,0,0,0,0,2|2,0,0]=4 1833 B11R0.31 CC(=O)SCCCOC(C)(C)C 7a_100015890283_100000038929 [0,0,0,0,0,2|2,0,0]=4 1834 B11R0.31 CC(=O)SCCCSC(C)(C)C 62a_100000038929_100000211941 [0,0,0,0,0,2|2,0,0]=4 1835 B11R0.31 CC(=O)SCCCSC(C)(C)C 62a_100000211941_100000038929 [0,0,0,0,0,2|2,0,0]=4 1836 B11R0.31 CC(C)(C)CCCCCC(=O)[13CH3] 1458a_100012017116_200025704644 [0,0,0,0,0,2|2,0,0]=4 1837 B11R0.31 CC(C)(C)CCNCCC(=O)N 2230a_100000738805_100000744528 [0,0,0,0,0,2|2,0,0]=4 1838 B11R0.31 CC(C)(C)CCNOCC(=O)O 269956a_100000106656_100000755188 [0,0,0,0,0,2|1,0,0]=3 1839 B11R0.31 CC(C)(C)CCOCCC(=O)N 34a_100000757172_100000755188 [0,0,0,0,0,2|2,0,0]=4 1840 B11R0.31 CC(C)(C)CCOCCC(=O)N 7a_100000757172_100000755188 [0,0,0,0,0,2|2,0,0]=4 1841 B11R0.31 CC(C)(C)CCOCCC(=O)N 7a_100000765024_100000744528 [0,0,0,0,0,2|2,0,0]=4 1842 B11R0.31 CC(C)(C)CCSCCC(=O)N 62a_100000744528_100000755188 [0,0,0,0,0,2|2,0,0]=4 1843 B11R0.31 CC(C)(C)CCSCCC(=O)N 62a_100000755188_100000744528 [0,0,0,0,0,2|2,0,0]=4 1844 B11R0.31 CC(C)(C)CNCCCC(=O)N 34a_100000739312_100011219605 [0,0,0,0,0,2|2,0,0]=4 1845 B11R0.31 CC(C)(C)CNCCNC(=O)N 2230a_100000743828_200000034859 [0,0,0,0,0,2|2,0,0]=4 1846 B11R0.31 CC(C)(C)CNCCNC(=O)N 34a_100020590234_100011219605 [0,0,0,0,0,2|2,0,0]=4 1847 B11R0.31 CC(C)(C)COCCNC(=O)N 34a_100000181757_100011219605 [0,0,0,0,0,2|2,0,0]=4 1848 B11R0.31 CC(C)(C)CSCCCC(=O)N 62a_100011219605_100102525003 [0,0,0,0,0,2|2,0,0]=4 1849 B11R0.31 CC(C)(C)CSCCCC(=O)N 62a_100102525003_100011219605 [0,0,0,0,0,2|2,0,0]=4 1850 B11R0.31 CC(C)(C)CSCCNC(=O)N 62a_100011219605_200000034859 [0,0,0,0,0,2|2,0,0]=4 1851 B11R0.31 CC(C)(C)CSCCNC(=O)N 62a_200000034859_100011219605 [0,0,0,0,0,2|2,0,0]=4 1852 B11R0.31 CC(C)(C)CSCCOC(=O)N 62a_100011219605_200011214921 [0,0,0,0,0,2|2,0,0]=4 1853 B11R0.31 CC(C)(C)CSCCOC(=O)N 62a_200011214921_100011219605 [0,0,0,0,0,2|2,0,0]=4 1854 B11R0.31 CC(C)(C)NCCCCC(=O)N 34a_100000696515_100000210625 [0,0,0,0,0,2|2,0,0]=4 1855 B11R0.31 CC(C)(C)NCCOCC(=O)N 2230a_100000715429_100000076697 [0,0,0,0,0,2|2,0,0]=4 1856 B11R0.31 CC(C)(C)NCCOCC(=O)O 269956a_100000700818_100000211941 [0,0,0,0,0,2|1,0,0]=3 1857 B11R0.31 CC(C)(C)OCCCCC(=O)N 34a_100012022536_100000210625 [0,0,0,0,0,2|2,0,0]=4 1858 B11R0.31 CC(C)(C)OCCNCC(=O)N 2230a_100000747557_100000747473 [0,0,0,0,0,2|2,0,0]=4 1859 B11R0.31 CC(C)(C)OCCOCC(=O)N 34a_100000693234_100000187820 [0,0,0,0,0,2|2,0,0]=4 1860 B11R0.31 CC(C)(C)OCCOCC(=O)N 34a_100015890283_100000076697 [0,0,0,0,0,2|2,0,0]=4 1861 B11R0.31 CC(C)(C)OCCOCC(=O)N 7a_100000693234_100000187820 [0,0,0,0,0,2|2,0,0]=4 1862 B11R0.31 CC(C)(C)OCCOCC(=O)N 7a_100015890283_100000076697 [0,0,0,0,0,2|2,0,0]=4 1863 B11R0.31 CC(C)(C)OCCOCC(=O)[O-] 34a_100000693234_100020667443 [0,0,0,0,0,2|1,0,1]=4 1864 B11R0.31 CC(C)(C)SCCNCC(=O)N 2230a_100000689375_100000747473 [0,0,0,0,0,2|2,0,0]=4 1865 B11R0.31 CC(C)(C)SCCOCC(=O)N 62a_100000076697_100000211941 [0,0,0,0,0,2|2,0,0]=4 1866 B11R0.31 CC(C)(C)SCCOCC(=O)N 62a_100000211941_100000076697 [0,0,0,0,0,2|2,0,0]=4 1867 B11R0.31 CC(C)(O)CCCNCC(=O)O 269956a_100016091260_100009888830 [0,0,0,0,0,2|2,0,0]=4 1868 B11R0.31 CC(C)(O)CCNOCC(=O)O 269956a_100000106656_100000702414 [0,0,0,0,0,2|2,0,0]=4 1869 B11R0.31 CC(O)CCCSC[N+](C)(C)C 62a_200000036245_200000718107 [0,0,0,0,0,2|1,0,1]=4 1870 B11R0.31 CC(O)CCCSC[N+](C)(C)C 62a_200000718107_200000036245 [0,0,0,0,0,2|1,0,1]=4 1871 B11R0.31 CC(O)CCOCC[N+](C)(C)C 7a_200020618287_100012276601 [0,0,0,0,0,2|1,0,1]=4 1872 B11R0.31 CC(O)CCSCC[N+](C)(C)C 62a_100000085578_100012276601 [0,0,0,0,0,2|1,0,1]=4 1873 B11R0.31 CC(O)CCSCC[N+](C)(C)C 62a_100012276601_100000085578 [0,0,0,0,0,2|1,0,1]=4 1874 B11R0.31 CC(O)CNCCC[N+](C)(C)C 2230a_100000210904_100016990835 [0,0,0,0,0,2|1,0,1]=4 1875 B11R0.31 CC(O)CNCCC[N+](C)(C)C 34a_100000210904_100016990835 [0,0,0,0,0,2|1,0,1]=4 1876 B11R0.31 CC(O)CSCCC[N+](C)(C)C 62a_100011218427_100016990835 [0,0,0,0,0,2|1,0,1]=4 1877 B11R0.31 CC(O)CSCCC[N+](C)(C)C 62a_100016990835_100011218427 [0,0,0,0,0,2|1,0,1]=4 1878 B11R0.31 C[C@@H](O)CSCCC[N+](C)(C)C 62a_100009817552_100016990835 [0,0,0,0,0,2|1,0,1]=4 1879 B11R0.31 C[C@@H](O)CSCCC[N+](C)(C)C 62a_100016990835_100009817552 [0,0,0,0,0,2|1,0,1]=4 1880 B11R0.31 C[N+](C)(C)CCCNCC(=O)N 2230a_100000711301_100016990835 [0,0,0,0,0,2|1,0,0]=3 1881 B11R0.31 C[N+](C)(C)CCCNCC(=O)O 269956a_100016091260_100016990835 [0,0,0,0,0,2|0,0,0]=2 1882 B11R0.31 C[N+](C)(C)CCCSCC(=O)N 62a_100000747473_100016990835 [0,0,0,0,0,2|1,0,0]=3 1883 B11R0.31 C[N+](C)(C)CCCSCC(=O)N 62a_100016990835_100000747473 [0,0,0,0,0,2|1,0,0]=3 1884 B11R0.31 C[N+](C)(C)CCCSCC(=O)[O-] 62a_100016990835_100020667443 [0,0,0,0,0,2|0,0,1]=3 1885 B11R0.31 C[N+](C)(C)CCCSCC(=O)[O-] 62a_100020667443_100016990835 [0,0,0,0,0,2|0,0,1]=3 1886 B11R0.31 C[N+](C)(C)CCCSC[N+](=O)[O-] 62a_100016990835_100000761209 [0,0,0,0,0,2|1,0,1]=4 1887 B11R0.31 C[N+](C)(C)CCNOCC(=O)O 269956a_100000106656_100000085578 [0,0,0,0,0,2|0,0,0]=2 1888 B11R0.31 C[N+](C)(C)CCOCCC(=O)N 34a_100000757172_100000085578 [0,0,0,0,0,2|1,0,0]=3 1889 B11R0.31 C[N+](C)(C)CCOCCC(=O)N 7a_100000757172_100000085578 [0,0,0,0,0,2|1,0,0]=3 1890 B11R0.31 C[N+](C)(C)CCOCCC(=O)N 7a_200020618287_100000744528 [0,0,0,0,0,2|1,0,0]=3 1891 B11R0.31 C[N+](C)(C)CCSCCC(=O)N 62a_100000085578_100000744528 [0,0,0,0,0,2|1,0,0]=3 1892 B11R0.31 C[N+](C)(C)CCSCCC(=O)N 62a_100000744528_100000085578 [0,0,0,0,0,2|1,0,0]=3 1893 B11R0.31 C[N+](C)(C)CSCCC=C(F)F 62a_200000036245_200009816681 [0,0,0,0,0,2|2,0,0]=4 1894 B11R0.31 C[N+](C)(C)CSCCC=C(F)F 62a_200009816681_200000036245 [0,0,0,0,0,2|2,0,0]=4 1895 B11R0.31 C[N+](C)(C)CSCCCC(=O)N 62a_100102525003_200000036245 [0,0,0,0,0,2|1,0,0]=3 1896 B11R0.31 C[N+](C)(C)CSCCCC(=O)N 62a_200000036245_100102525003 [0,0,0,0,0,2|1,0,0]=3 1897 B11R0.31 C[N+](C)(C)CSCCNC(=O)N 62a_200000034859_200000036245 [0,0,0,0,0,2|1,0,0]=3 1898 B11R0.31 C[N+](C)(C)CSCCNC(=O)N 62a_200000036245_200000034859 [0,0,0,0,0,2|1,0,0]=3 1899 B11R0.31 C[N+](C)(C)CSCCOC(=O)N 62a_200000036245_200011214921 [0,0,0,0,0,2|1,0,0]=3 1900 B11R0.31 C[N+](C)(C)CSCCOC(=O)N 62a_200011214921_200000036245 [0,0,0,0,0,2|1,0,0]=3 1901 B11R0.31 C[Si](C)(C)C#CCNCC(=O)O 269956a_100016091260_100000764098 [0,0,0,0,0,2|1,0,1]=4 1902 B11R0.31 C[Si](C)(C)CCCNCC(=O)N 2230a_100000711301_100011219597 [0,0,0,0,0,2|2,0,0]=4 1903 B11R0.31 C[Si](C)(C)CCCNCC(=O)O 269956a_100016091260_100011219597 [0,0,0,0,0,2|1,0,0]=3 1904 B11R0.31 C[Si](C)(C)CCCOCC(=O)N 7a_200011215415_100000187820 [0,0,0,0,0,2|2,0,0]=4 1905 B11R0.31 C[Si](C)(C)CCCSCC(=O)N 62a_100000747473_100011219597 [0,0,0,0,0,2|2,0,0]=4 1906 B11R0.31 C[Si](C)(C)CCCSCC(=O)N 62a_100011219597_100000747473 [0,0,0,0,0,2|2,0,0]=4 1907 B11R0.31 C[Si](C)(C)CCCSCC(=O)[O-] 62a_100011219597_100020667443 [0,0,0,0,0,2|1,0,1]=4 1908 B11R0.31 C[Si](C)(C)CCCSCC(=O)[O-] 62a_100020667443_100011219597 [0,0,0,0,0,2|1,0,1]=4 1909 B11R0.31 C[Si](C)(C)CCNOCC(=O)O 269956a_100000106656_200000733723 [0,0,0,0,0,2|1,0,0]=3 1910 B11R0.31 C[Si](C)(C)CCOCCC(=O)N 34a_100000757172_200000733723 [0,0,0,0,0,2|2,0,0]=4 1911 B11R0.31 C[Si](C)(C)CCOCCC(=O)N 7a_100000039746_100000744528 [0,0,0,0,0,2|2,0,0]=4 1912 B11R0.31 C[Si](C)(C)CCOCCC(=O)N 7a_100000757172_200000733723 [0,0,0,0,0,2|2,0,0]=4 1913 B11R0.31 C[Si](C)(C)CCSCCC(=O)N 62a_100000744528_200000733723 [0,0,0,0,0,2|2,0,0]=4 1914 B11R0.31 C[Si](C)(C)CCSCCC(=O)N 62a_200000733723_100000744528 [0,0,0,0,0,2|2,0,0]=4 1915 B11R0.31 C[Si](C)(C)COCCOC(=O)N 7a_100000766696_100000233785 [0,0,0,0,0,2|2,0,0]=4 1916 B11R0.31 C[Si](C)(C)CSCCCC(=O)N 62a_100000037933_100102525003 [0,0,0,0,0,2|2,0,0]=4 1917 B11R0.31 C[Si](C)(C)CSCCCC(=O)N 62a_100102525003_100000037933 [0,0,0,0,0,2|2,0,0]=4 1918 B11R0.31 C[Si](C)(C)CSCCNC(=O)N 62a_100000037933_200000034859 [0,0,0,0,0,2|2,0,0]=4 1919 B11R0.31 C[Si](C)(C)CSCCNC(=O)N 62a_200000034859_100000037933 [0,0,0,0,0,2|2,0,0]=4 1920 B11R0.31 C[Si](C)(C)CSCCOC(=O)N 62a_100000037933_200011214921 [0,0,0,0,0,2|2,0,0]=4 1921 B11R0.31 C[Si](C)(C)CSCCOC(=O)N 62a_200011214921_100000037933 [0,0,0,0,0,2|2,0,0]=4 1922 B11R0.31 C[Si](C)(C)OCCNCC(=O)N 2230a_100000711301_200000032530 [0,0,0,0,0,2|2,0,0]=4 1923 B11R0.31 C[Si](C)(C)OCCNCC(=O)O 269956a_100016091260_200000032530 [0,0,0,0,0,2|1,0,0]=3 1924 B11R0.31 C[Si](C)(C)OCCSCC(=O)N 62a_100000747473_200000032530 [0,0,0,0,0,2|2,0,0]=4 1925 B11R0.31 C[Si](C)(C)OCCSCC(=O)N 62a_200000032530_100000747473 [0,0,0,0,0,2|2,0,0]=4 1926 B11R0.31 C[Si](C)(C)OCCSCC(=O)[O-] 62a_100020667443_200000032530 [0,0,0,0,0,2|1,0,1]=4 1927 B11R0.31 C[Si](C)(C)OCCSCC(=O)[O-] 62a_200000032530_100020667443 [0,0,0,0,0,2|1,0,1]=4