0 B9R0.56 C=C(C)CCNC(C)(C)C 2230a_100000715429_100000730704 [0,0,0,0,0,0|3,0,1]=4 1 B9R0.56 C=C(C)CCOC(C)(C)C 34a_100000764851_100000210625 [0,0,0,0,0,0|3,0,1]=4 2 B9R0.56 C=C(C)CCOC(C)(C)C 34a_100015890283_100000730704 [0,0,0,0,0,0|3,0,1]=4 3 B9R0.56 C=C(C)CCOC(C)(C)C 7a_100015890283_100000730704 [0,0,0,0,0,0|3,0,1]=4 4 B9R0.56 C=C(C)CCSC(C)(C)C 62a_100000211941_100000730704 [0,0,0,0,0,0|3,0,1]=4 5 B9R0.56 C=C(C)CCSC(C)(C)C 62a_100000730704_100000211941 [0,0,0,0,0,0|3,0,1]=4 6 B9R0.56 C=C(C)CNCC(C)(C)C 2230a_100000743828_100000748629 [0,0,0,0,0,0|3,0,1]=4 7 B9R0.56 C=C(C)CNCC(C)(C)F 2230a_100020643315_100000748629 [0,0,0,0,0,0|3,0,1]=4 8 B9R0.56 C=C(C)CNCC(C)(C)O 2230a_100000751335_100000748629 [0,0,0,0,0,0|2,0,1]=3 9 B9R0.56 C=C(C)COCC(C)(C)C 34a_100000210245_100011219605 [0,0,0,0,0,0|3,0,1]=4 10 B9R0.56 C=C(C)COCC(C)(C)F 34a_100000210245_100011997219 [0,0,0,0,0,0|3,0,1]=4 11 B9R0.56 C=C(C)COCC(C)(C)F 34a_100000716592_100000748629 [0,0,0,0,0,0|3,0,1]=4 12 B9R0.56 C=C(C)COCC(C)(C)O 34a_100000210245_100000764493 [0,0,0,0,0,0|2,0,1]=3 13 B9R0.56 C=C(C)CSCC(C)(C)C 62a_100000748629_100011219605 [0,0,0,0,0,0|3,0,1]=4 14 B9R0.56 C=C(C)CSCC(C)(C)C 62a_100011219605_100000211660 [0,0,0,0,0,0|3,0,1]=4 15 B9R0.56 C=C(C)CSCC(C)(C)F 62a_100000748629_100011997219 [0,0,0,0,0,0|3,0,1]=4 16 B9R0.56 C=C(C)CSCC(C)(C)F 62a_100011997219_100000211660 [0,0,0,0,0,0|3,0,1]=4 17 B9R0.56 C=C(C)CSCC(C)(C)O 62a_100000748629_100000764493 [0,0,0,0,0,0|2,0,1]=3 18 B9R0.56 C=C(C)CSCC(C)(C)O 62a_100000764493_100000211660 [0,0,0,0,0,0|2,0,1]=3 19 B9R0.56 C=C(F)CNCC(C)(C)O 2230a_100000751335_100009893438 [0,0,0,0,0,0|2,0,2]=4 20 B9R0.56 C=C(F)COCC(C)(C)O 34a_200010262243_100000764493 [0,0,0,0,0,0|2,0,2]=4 21 B9R0.56 C=C(F)CSCC(C)(C)O 62a_100000042424_100000764493 [0,0,0,0,0,0|2,0,2]=4 22 B9R0.56 C=C(F)CSCC(C)(C)O 62a_100000764493_100000042424 [0,0,0,0,0,0|2,0,2]=4 23 B9R0.56 CC(=O)CCC[N+](C)(C)C 1458a_100000070787_100016990835 [0,0,0,0,0,0|3,0,1]=4 24 B9R0.56 CC(=O)CCC[N+](C)(C)C 1458a_100000085584_200000210301 [0,0,0,0,0,0|3,0,1]=4 25 B9R0.56 CC(=O)CCC[Si](C)(C)C 1458a_100000070787_100011219597 [0,0,0,0,0,0|2,1,1]=4 26 B9R0.56 CC(=O)CCOC(C)(C)C 34a_100000759926_100000210625 [0,0,0,0,0,0|3,0,1]=4 27 B9R0.56 CC(=O)CCOC(C)(C)C 7a_100015890283_100000053229 [0,0,0,0,0,0|3,0,1]=4 28 B9R0.56 CC(=O)CCSC(C)(C)C 62a_100000053229_100000211941 [0,0,0,0,0,0|3,0,1]=4 29 B9R0.56 CC(=O)CCSC(C)(C)C 62a_100000211941_100000053229 [0,0,0,0,0,0|3,0,1]=4 30 B9R0.56 CC(=O)COCC(C)(C)C 34a_100000211253_100011219605 [0,0,0,0,0,0|3,0,1]=4 31 B9R0.56 CC(=O)COCC(C)(C)F 34a_100000211253_100011997219 [0,0,0,0,0,0|3,0,1]=4 32 B9R0.56 CC(=O)COCC(C)(C)O 34a_100000211253_100000764493 [0,0,0,0,0,0|2,0,1]=3 33 B9R0.56 CC(=O)NCCC(C)(C)C 11a_100000738805_100015343762 [0,0,0,0,0,0|3,0,1]=4 34 B9R0.56 CC(=O)NCCC(C)(C)C 1626a_100000738805_100015343762 [0,0,0,0,0,0|3,0,1]=4 35 B9R0.56 CC(=O)NCCC(C)(C)C 240690a_100000738805_100015343762 [0,0,0,0,0,0|3,0,1]=4 36 B9R0.56 CC(=O)NCCC(C)(C)C 527a_100000738805_100103153847 [0,0,0,0,0,0|3,0,1]=4 37 B9R0.56 CC(=O)NCCC(C)(C)F 11a_100016253952_100015343762 [0,0,0,0,0,0|3,0,1]=4 38 B9R0.56 CC(=O)NCCC(C)(C)F 1626a_100016253952_100015343762 [0,0,0,0,0,0|3,0,1]=4 39 B9R0.56 CC(=O)NCCC(C)(C)F 240690a_100016253952_100015343762 [0,0,0,0,0,0|3,0,1]=4 40 B9R0.56 CC(=O)NCCC(C)(C)F 527a_100016253952_100103153847 [0,0,0,0,0,0|3,0,1]=4 41 B9R0.56 CC(=O)NCCC(C)(C)O 1626a_100000707701_100015343762 [0,0,0,0,0,0|2,0,1]=3 42 B9R0.56 CC(=O)NCCC(C)(C)O 527a_100000707701_100103153847 [0,0,0,0,0,0|2,0,1]=3 43 B9R0.56 CC(Br)CCOC(C)(C)C 34a_100009893172_100000210625 [0,0,0,0,0,0|3,0,0]=3 44 B9R0.56 CC(Br)COCC(C)(C)C 34a_100012180447_100011219605 [0,0,0,0,0,0|3,0,0]=3 45 B9R0.56 CC(Br)COCC(C)(C)F 34a_100012180447_100011997219 [0,0,0,0,0,0|3,0,0]=3 46 B9R0.56 CC(Br)COCC(C)(C)O 34a_100012180447_100000764493 [0,0,0,0,0,0|2,0,0]=2 47 B9R0.56 CC(C)(C)CNCC(=O)N 2230a_100000743828_100000747473 [0,0,0,0,0,0|3,0,1]=4 48 B9R0.56 CC(C)(C)CNCC(F)F 2230a_100000743828_100011934356 [0,0,0,0,0,0|4,0,0]=4 49 B9R0.56 CC(C)(C)CNCC(F)F 270004a_100000765723_100011204126 [0,0,0,0,0,0|4,0,0]=4 50 B9R0.56 CC(C)(C)CNCC(F)F 34a_100000765723_100011219605 [0,0,0,0,0,0|4,0,0]=4 51 B9R0.56 CC(C)(C)COCC(F)F 34a_100000743014_100011219605 [0,0,0,0,0,0|4,0,0]=4 52 B9R0.56 CC(C)(C)CSCC(=O)N 62a_100000747473_100011219605 [0,0,0,0,0,0|3,0,1]=4 53 B9R0.56 CC(C)(C)CSCC(=O)N 62a_100011219605_100000747473 [0,0,0,0,0,0|3,0,1]=4 54 B9R0.56 CC(C)(C)CSCC(F)F 62a_100011219605_100011934356 [0,0,0,0,0,0|4,0,0]=4 55 B9R0.56 CC(C)(C)CSCC(F)F 62a_100011934356_100011219605 [0,0,0,0,0,0|4,0,0]=4 56 B9R0.56 CC(C)(C)NCCC(=O)N 2230a_100000715429_100000744528 [0,0,0,0,0,0|3,0,1]=4 57 B9R0.56 CC(C)(C)OCCC(=O)N 34a_100000757172_100000210625 [0,0,0,0,0,0|3,0,1]=4 58 B9R0.56 CC(C)(C)OCCC(=O)N 34a_100015890283_100000731001 [0,0,0,0,0,0|3,0,1]=4 59 B9R0.56 CC(C)(C)OCCC(=O)N 7a_100015890283_100000744528 [0,0,0,0,0,0|3,0,1]=4 60 B9R0.56 CC(C)(C)OCCC(F)F 34a_100103093639_100000210625 [0,0,0,0,0,0|4,0,0]=4 61 B9R0.56 CC(C)(C)SCCC(=O)N 62a_100000211941_100000744528 [0,0,0,0,0,0|3,0,1]=4 62 B9R0.56 CC(C)(C)SCCC(=O)N 62a_100000744528_100000211941 [0,0,0,0,0,0|3,0,1]=4 63 B9R0.56 CC(C)(F)CNCC(=O)N 2230a_100020643315_100000747473 [0,0,0,0,0,0|3,0,1]=4 64 B9R0.56 CC(C)(F)CNCC(F)F 2230a_100020643315_100011934356 [0,0,0,0,0,0|4,0,0]=4 65 B9R0.56 CC(C)(F)CNCC(F)F 34a_100000765723_100011997219 [0,0,0,0,0,0|4,0,0]=4 66 B9R0.56 CC(C)(F)COCC(=O)N 34a_100000716592_100000187820 [0,0,0,0,0,0|3,0,1]=4 67 B9R0.56 CC(C)(F)COCC(F)F 34a_100000716592_100011934356 [0,0,0,0,0,0|4,0,0]=4 68 B9R0.56 CC(C)(F)COCC(F)F 34a_100000743014_100011997219 [0,0,0,0,0,0|4,0,0]=4 69 B9R0.56 CC(C)(F)CSCC(=O)N 62a_100000747473_100011997219 [0,0,0,0,0,0|3,0,1]=4 70 B9R0.56 CC(C)(F)CSCC(=O)N 62a_100011997219_100000747473 [0,0,0,0,0,0|3,0,1]=4 71 B9R0.56 CC(C)(F)CSCC(F)F 62a_100011934356_100011997219 [0,0,0,0,0,0|4,0,0]=4 72 B9R0.56 CC(C)(F)CSCC(F)F 62a_100011997219_100011934356 [0,0,0,0,0,0|4,0,0]=4 73 B9R0.56 CC(C)(O)CNCC(=O)N 2230a_100000751335_100000747473 [0,0,0,0,0,0|2,0,1]=3 74 B9R0.56 CC(C)(O)CNCC(=O)O 269956a_100016091260_100000764493 [0,0,0,0,0,0|3,0,1]=4 75 B9R0.56 CC(C)(O)CNCC(F)F 2230a_100000751335_100011934356 [0,0,0,0,0,0|3,0,0]=3 76 B9R0.56 CC(C)(O)CNCC(F)F 34a_100000765723_100000764493 [0,0,0,0,0,0|3,0,0]=3 77 B9R0.56 CC(C)(O)COCC(F)F 34a_100000743014_100000764493 [0,0,0,0,0,0|3,0,0]=3 78 B9R0.56 CC(C)(O)CSCC(=O)N 62a_100000747473_100000764493 [0,0,0,0,0,0|2,0,1]=3 79 B9R0.56 CC(C)(O)CSCC(=O)N 62a_100000764493_100000747473 [0,0,0,0,0,0|2,0,1]=3 80 B9R0.56 CC(C)(O)CSCC(=O)[O-] 62a_100000764493_100020667443 [0,0,0,0,0,0|3,0,1]=4 81 B9R0.56 CC(C)(O)CSCC(=O)[O-] 62a_100020667443_100000764493 [0,0,0,0,0,0|3,0,1]=4 82 B9R0.56 CC(C)(O)CSCC(F)F 62a_100000764493_100011934356 [0,0,0,0,0,0|3,0,0]=3 83 B9R0.56 CC(C)(O)CSCC(F)F 62a_100011934356_100000764493 [0,0,0,0,0,0|3,0,0]=3 84 B9R0.56 CC(C)(O)CSC[N+](=O)[O-] 62a_100000764493_100000761209 [0,0,0,0,0,0|4,0,0]=4 85 B9R0.56 CC(C)CCNC(C)(C)C 2230a_100000715429_100000210312 [0,0,0,0,0,0|3,0,0]=3 86 B9R0.56 CC(C)CCOC(C)(C)C 34a_100000210254_100000210625 [0,0,0,0,0,0|3,0,0]=3 87 B9R0.56 CC(C)CCOC(C)(C)C 34a_100015890283_100000210312 [0,0,0,0,0,0|3,0,0]=3 88 B9R0.56 CC(C)CCOC(C)(C)C 7a_100015890283_100000210626 [0,0,0,0,0,0|3,0,0]=3 89 B9R0.56 CC(C)CCSC(C)(C)C 62a_100000210312_100000211941 [0,0,0,0,0,0|3,0,0]=3 90 B9R0.56 CC(C)CCSC(C)(C)C 62a_100000211941_100000210312 [0,0,0,0,0,0|3,0,0]=3 91 B9R0.56 CC(C)CNCC(C)(C)C 2230a_100000743828_100000210760 [0,0,0,0,0,0|3,0,0]=3 92 B9R0.56 CC(C)CNCC(C)(C)C 270004a_100000210953_100011204126 [0,0,0,0,0,0|3,0,0]=3 93 B9R0.56 CC(C)CNCC(C)(C)C 270004a_100000743828_100000210432 [0,0,0,0,0,0|3,0,0]=3 94 B9R0.56 CC(C)CNCC(C)(C)C 34a_100000210953_100011219605 [0,0,0,0,0,0|3,0,0]=3 95 B9R0.56 CC(C)CNCC(C)(C)F 2230a_100020643315_100000210760 [0,0,0,0,0,0|3,0,0]=3 96 B9R0.56 CC(C)CNCC(C)(C)F 270004a_100020643315_100000210432 [0,0,0,0,0,0|3,0,0]=3 97 B9R0.56 CC(C)CNCC(C)(C)F 34a_100000210953_100011997219 [0,0,0,0,0,0|3,0,0]=3 98 B9R0.56 CC(C)CNCC(C)(C)O 2230a_100000751335_100000210760 [0,0,0,0,0,0|2,0,0]=2 99 B9R0.56 CC(C)CNCC(C)(C)O 270004a_100000751335_100000210432 [0,0,0,0,0,0|2,0,0]=2 100 B9R0.56 CC(C)CNCC(C)(C)O 34a_100000210953_100000764493 [0,0,0,0,0,0|2,0,0]=2 101 B9R0.56 CC(C)CNCC(C)(F)F 270004a_100000731000_100000210432 [0,0,0,0,0,0|4,0,0]=4 102 B9R0.56 CC(C)CNC[Si](C)(C)C 2230a_100000210953_100000037933 [0,0,0,0,0,0|3,1,0]=4 103 B9R0.56 CC(C)COCC(C)(C)C 34a_100000210257_100011219605 [0,0,0,0,0,0|3,0,0]=3 104 B9R0.56 CC(C)COCC(C)(C)F 34a_100000210257_100011997219 [0,0,0,0,0,0|3,0,0]=3 105 B9R0.56 CC(C)COCC(C)(C)F 34a_100000716592_100000210624 [0,0,0,0,0,0|3,0,0]=3 106 B9R0.56 CC(C)COCC(C)(C)O 34a_100000210257_100000764493 [0,0,0,0,0,0|2,0,0]=2 107 B9R0.56 CC(C)COCC(C)(F)F 34a_100000068830_100000210624 [0,0,0,0,0,0|4,0,0]=4 108 B9R0.56 CC(C)CSCC(C)(C)C 62a_100000210624_100011219605 [0,0,0,0,0,0|3,0,0]=3 109 B9R0.56 CC(C)CSCC(C)(C)C 62a_100011219605_100000210760 [0,0,0,0,0,0|3,0,0]=3 110 B9R0.56 CC(C)CSCC(C)(C)F 62a_100000210624_100011997219 [0,0,0,0,0,0|3,0,0]=3 111 B9R0.56 CC(C)CSCC(C)(C)F 62a_100011997219_100000210760 [0,0,0,0,0,0|3,0,0]=3 112 B9R0.56 CC(C)CSCC(C)(C)O 62a_100000210624_100000764493 [0,0,0,0,0,0|2,0,0]=2 113 B9R0.56 CC(C)CSCC(C)(C)O 62a_100000764493_100000210760 [0,0,0,0,0,0|2,0,0]=2 114 B9R0.56 CC(C)CSC[N+](C)(C)C 62a_100000210624_200000036245 [0,0,0,0,0,0|4,0,0]=4 115 B9R0.56 CC(C)CSC[N+](C)(C)C 62a_200000036245_100000210760 [0,0,0,0,0,0|4,0,0]=4 116 B9R0.56 CC(C)CSC[Si](C)(C)C 62a_100000037933_100000210760 [0,0,0,0,0,0|3,1,0]=4 117 B9R0.56 CC(C)CSC[Si](C)(C)C 62a_100000210624_100000037933 [0,0,0,0,0,0|3,1,0]=4 118 B9R0.56 CC(C)NCCC(C)(C)C 2230a_100000738805_100000210206 [0,0,0,0,0,0|3,0,0]=3 119 B9R0.56 CC(C)NCCC(C)(C)C 2230a_100138425928_100000755188 [0,0,0,0,0,0|3,0,0]=3 120 B9R0.56 CC(C)NCCC(C)(C)C 34a_100138425928_100000755188 [0,0,0,0,0,0|3,0,0]=3 121 B9R0.56 CC(C)NCCC(C)(C)F 2230a_100016253952_100000210206 [0,0,0,0,0,0|3,0,0]=3 122 B9R0.56 CC(C)NCCC(C)(C)O 2230a_100138425928_100000702414 [0,0,0,0,0,0|2,0,0]=2 123 B9R0.56 CC(C)NCCC(C)(C)O 34a_100138425928_100000702414 [0,0,0,0,0,0|2,0,0]=2 124 B9R0.56 CC(C)NCC[N+](C)(C)C 34a_100138425928_100000085578 [0,0,0,0,0,0|4,0,0]=4 125 B9R0.56 CC(C)NCC[Si](C)(C)C 2230a_100138425928_200000733723 [0,0,0,0,0,0|3,1,0]=4 126 B9R0.56 CC(C)NCC[Si](C)(C)C 34a_100138425928_200000733723 [0,0,0,0,0,0|3,1,0]=4 127 B9R0.56 CC(C)OCCC(C)(C)C 34a_100000212225_100000755188 [0,0,0,0,0,0|3,0,0]=3 128 B9R0.56 CC(C)OCCC(C)(C)C 7a_100000765024_100000210206 [0,0,0,0,0,0|3,0,0]=3 129 B9R0.56 CC(C)OCCC(C)(C)O 34a_100000212225_100000702414 [0,0,0,0,0,0|2,0,0]=2 130 B9R0.56 CC(C)OCC[N+](C)(C)C 34a_100000212225_100000085578 [0,0,0,0,0,0|4,0,0]=4 131 B9R0.56 CC(C)OCC[N+](C)(C)C 7a_200020618287_100000210206 [0,0,0,0,0,0|4,0,0]=4 132 B9R0.56 CC(C)OCC[Si](C)(C)C 34a_100000212225_200000733723 [0,0,0,0,0,0|3,1,0]=4 133 B9R0.56 CC(C)OCC[Si](C)(C)C 7a_100000039746_100000210206 [0,0,0,0,0,0|3,1,0]=4 134 B9R0.56 CC(C)OCNC(C)(C)C 2230a_100000715429_100000709892 [0,0,0,0,0,0|4,0,0]=4 135 B9R0.56 CC(C)OCOC(C)(C)C 34a_100015890283_100000709892 [0,0,0,0,0,0|4,0,0]=4 136 B9R0.56 CC(C)OCSC(C)(C)C 62a_100000211941_100000709892 [0,0,0,0,0,0|4,0,0]=4 137 B9R0.56 CC(C)OCSC(C)(C)C 62a_100000709892_100000211941 [0,0,0,0,0,0|4,0,0]=4 138 B9R0.56 CC(C)SCCC(C)(C)C 62a_100000210206_100000755188 [0,0,0,0,0,0|3,0,0]=3 139 B9R0.56 CC(C)SCCC(C)(C)C 62a_100000755188_100000210206 [0,0,0,0,0,0|3,0,0]=3 140 B9R0.56 CC(C)SCCC(C)(C)O 62a_100000210206_100000702414 [0,0,0,0,0,0|2,0,0]=2 141 B9R0.56 CC(C)SCCC(C)(C)O 62a_100000702414_100000210206 [0,0,0,0,0,0|2,0,0]=2 142 B9R0.56 CC(C)SCC[N+](C)(C)C 62a_100000085578_100000210206 [0,0,0,0,0,0|4,0,0]=4 143 B9R0.56 CC(C)SCC[N+](C)(C)C 62a_100000210206_100000085578 [0,0,0,0,0,0|4,0,0]=4 144 B9R0.56 CC(C)SCC[Si](C)(C)C 62a_100000210206_200000733723 [0,0,0,0,0,0|3,1,0]=4 145 B9R0.56 CC(C)SCC[Si](C)(C)C 62a_200000733723_100000210206 [0,0,0,0,0,0|3,1,0]=4 146 B9R0.56 CC(F)COCC(C)(C)C 34a_100015925927_100011219605 [0,0,0,0,0,0|3,0,0]=3 147 B9R0.56 CC(F)COCC(C)(C)F 34a_100015925927_100011997219 [0,0,0,0,0,0|3,0,0]=3 148 B9R0.56 CC(F)COCC(C)(C)O 34a_100015925927_100000764493 [0,0,0,0,0,0|2,0,0]=2 149 B9R0.56 CC(O)CCNC(C)(C)C 2230a_100000715429_100012276601 [0,0,0,0,0,0|3,0,0]=3 150 B9R0.56 CC(O)CCOC(C)(C)C 34a_100015890283_100012276601 [0,0,0,0,0,0|3,0,0]=3 151 B9R0.56 CC(O)CCOC(C)(C)C 7a_100015890283_100012276601 [0,0,0,0,0,0|3,0,0]=3 152 B9R0.56 CC(O)CCSC(C)(C)C 62a_100000211941_100012276601 [0,0,0,0,0,0|3,0,0]=3 153 B9R0.56 CC(O)CCSC(C)(C)C 62a_100012276601_100000211941 [0,0,0,0,0,0|3,0,0]=3 154 B9R0.56 CC(O)CNCC(C)(C)C 2230a_100000743828_100011218427 [0,0,0,0,0,0|3,0,0]=3 155 B9R0.56 CC(O)CNCC(C)(C)C 270004a_100000210904_100011204126 [0,0,0,0,0,0|3,0,0]=3 156 B9R0.56 CC(O)CNCC(C)(C)C 34a_100000210904_100011219605 [0,0,0,0,0,0|3,0,0]=3 157 B9R0.56 CC(O)CNCC(C)(C)F 2230a_100020643315_100011218427 [0,0,0,0,0,0|3,0,0]=3 158 B9R0.56 CC(O)CNCC(C)(C)F 34a_100000210904_100011997219 [0,0,0,0,0,0|3,0,0]=3 159 B9R0.56 CC(O)CNCC(C)(C)O 2230a_100000751335_100011218427 [0,0,0,0,0,0|2,0,0]=2 160 B9R0.56 CC(O)CNCC(C)(C)O 34a_100000210904_100000764493 [0,0,0,0,0,0|2,0,0]=2 161 B9R0.56 CC(O)CNC[Si](C)(C)C 2230a_100000210904_100000037933 [0,0,0,0,0,0|3,1,0]=4 162 B9R0.56 CC(O)COCC(C)(C)F 34a_100000716592_100011218427 [0,0,0,0,0,0|3,0,0]=3 163 B9R0.56 CC(O)COCC(C)(F)F 34a_100000068830_100011218427 [0,0,0,0,0,0|4,0,0]=4 164 B9R0.56 CC(O)CSCC(C)(C)C 62a_100011218427_100011219605 [0,0,0,0,0,0|3,0,0]=3 165 B9R0.56 CC(O)CSCC(C)(C)C 62a_100011219605_100011218427 [0,0,0,0,0,0|3,0,0]=3 166 B9R0.56 CC(O)CSCC(C)(C)F 62a_100011218427_100011997219 [0,0,0,0,0,0|3,0,0]=3 167 B9R0.56 CC(O)CSCC(C)(C)F 62a_100011997219_100011218427 [0,0,0,0,0,0|3,0,0]=3 168 B9R0.56 CC(O)CSCC(C)(C)O 62a_100000764493_100011218427 [0,0,0,0,0,0|2,0,0]=2 169 B9R0.56 CC(O)CSCC(C)(C)O 62a_100011218427_100000764493 [0,0,0,0,0,0|2,0,0]=2 170 B9R0.56 CC(O)CSC[N+](C)(C)C 62a_100011218427_200000036245 [0,0,0,0,0,0|4,0,0]=4 171 B9R0.56 CC(O)CSC[N+](C)(C)C 62a_200000036245_100011218427 [0,0,0,0,0,0|4,0,0]=4 172 B9R0.56 CC(O)CSC[Si](C)(C)C 62a_100000037933_100011218427 [0,0,0,0,0,0|3,1,0]=4 173 B9R0.56 CC(O)CSC[Si](C)(C)C 62a_100011218427_100000037933 [0,0,0,0,0,0|3,1,0]=4 174 B9R0.56 CN(C)CCCC(C)(C)O 2230a_100102631434_100009888830 [0,0,0,0,0,0|2,0,0]=2 175 B9R0.56 CN(C)CCCC(C)(C)O 269982a_100102631434_100009888830 [0,0,0,0,0,0|2,0,0]=2 176 B9R0.56 CN(C)CCC[N+](C)(C)C 2230a_100102631434_100016990835 [0,0,0,0,0,0|4,0,0]=4 177 B9R0.56 CN(C)CCC[N+](C)(C)C 269982a_100102631434_100016990835 [0,0,0,0,0,0|4,0,0]=4 178 B9R0.56 CN(C)CCC[Si](C)(C)C 2230a_100102631434_100011219597 [0,0,0,0,0,0|3,1,0]=4 179 B9R0.56 CN(C)CCC[Si](C)(C)C 269982a_100102631434_100011219597 [0,0,0,0,0,0|3,1,0]=4 180 B9R0.56 CN(C)CCOC(C)(C)C 2230a_100000690421_200000210301 [0,0,0,0,0,0|4,0,0]=4 181 B9R0.56 CN(C)CCOC(C)(C)C 269982a_100000690421_200000210301 [0,0,0,0,0,0|4,0,0]=4 182 B9R0.56 CN(C)CCOC(C)(C)C 7a_100015890283_100000755713 [0,0,0,0,0,0|4,0,0]=4 183 B9R0.56 CN(C)CCSC(C)(C)C 62a_100000211941_100000755713 [0,0,0,0,0,0|4,0,0]=4 184 B9R0.56 CN([13CH3])CCOC(C)(C)C 2230a_100000690421_200025704644 [0,0,0,0,0,0|4,0,0]=4 185 B9R0.56 CN([13CH3])CCOC(C)(C)C 269982a_100000690421_200025704644 [0,0,0,0,0,0|4,0,0]=4 186 B9R0.56 C[C@@H](Cl)COCC(C)(C)C 34a_100016084084_100011219605 [0,0,0,0,0,0|3,0,0]=3 187 B9R0.56 C[C@@H](Cl)COCC(C)(C)F 34a_100016084084_100011997219 [0,0,0,0,0,0|3,0,0]=3 188 B9R0.56 C[C@@H](Cl)COCC(C)(C)O 34a_100016084084_100000764493 [0,0,0,0,0,0|2,0,0]=2 189 B9R0.56 C[C@@H](N)CCOC(C)(C)C 34a_100000706166_100000210625 [0,0,0,0,0,0|2,0,0]=2 190 B9R0.56 C[C@@H](N)CCOC(F)(F)F 34a_100000706166_200103152311 [0,0,0,0,0,0|4,0,0]=4 191 B9R0.56 C[C@@H](N)COCC(C)(C)C 34a_100000737577_100011219605 [0,0,0,0,0,0|2,0,0]=2 192 B9R0.56 C[C@@H](N)COCC(C)(C)F 34a_100000737577_100011997219 [0,0,0,0,0,0|2,0,0]=2 193 B9R0.56 C[C@@H](N)COCC(C)(C)O 34a_100000737577_100000764493 [0,0,0,0,0,0|1,0,0]=1 194 B9R0.56 C[C@@H](O)CNCC(C)(C)C 2230a_100000743828_100009817552 [0,0,0,0,0,0|3,0,0]=3 195 B9R0.56 C[C@@H](O)CNCC(C)(C)F 2230a_100020643315_100009817552 [0,0,0,0,0,0|3,0,0]=3 196 B9R0.56 C[C@@H](O)CNCC(C)(C)O 2230a_100000751335_100009817552 [0,0,0,0,0,0|2,0,0]=2 197 B9R0.56 C[C@@H](O)COCC(C)(C)F 34a_100000716592_100009817552 [0,0,0,0,0,0|3,0,0]=3 198 B9R0.56 C[C@@H](O)COCC(C)(F)F 34a_100000068830_100009817552 [0,0,0,0,0,0|4,0,0]=4 199 B9R0.56 C[C@@H](O)CSCC(C)(C)C 62a_100009817552_100011219605 [0,0,0,0,0,0|3,0,0]=3 200 B9R0.56 C[C@@H](O)CSCC(C)(C)C 62a_100011219605_100009817552 [0,0,0,0,0,0|3,0,0]=3 201 B9R0.56 C[C@@H](O)CSCC(C)(C)F 62a_100009817552_100011997219 [0,0,0,0,0,0|3,0,0]=3 202 B9R0.56 C[C@@H](O)CSCC(C)(C)F 62a_100011997219_100009817552 [0,0,0,0,0,0|3,0,0]=3 203 B9R0.56 C[C@@H](O)CSCC(C)(C)O 62a_100000764493_100009817552 [0,0,0,0,0,0|2,0,0]=2 204 B9R0.56 C[C@@H](O)CSCC(C)(C)O 62a_100009817552_100000764493 [0,0,0,0,0,0|2,0,0]=2 205 B9R0.56 C[C@@H](O)CSC[N+](C)(C)C 62a_100009817552_200000036245 [0,0,0,0,0,0|4,0,0]=4 206 B9R0.56 C[C@@H](O)CSC[N+](C)(C)C 62a_200000036245_100009817552 [0,0,0,0,0,0|4,0,0]=4 207 B9R0.56 C[C@@H](O)CSC[Si](C)(C)C 62a_100000037933_100009817552 [0,0,0,0,0,0|3,1,0]=4 208 B9R0.56 C[C@@H](O)CSC[Si](C)(C)C 62a_100009817552_100000037933 [0,0,0,0,0,0|3,1,0]=4 209 B9R0.56 C[N+](C)(C)CCCC(=O)[13CH3] 1458a_100000085584_200025704644 [0,0,0,0,0,0|3,0,1]=4 210 B8R0.21 C#CCNCC(C)(C)O 2230a_100000751335_100000038162 [1,0,0,0,0,0|1,0,2]=4 211 B8R0.21 C#CCNCC(C)(C)O 34a_100000212058_100000764493 [1,0,0,0,0,0|1,0,2]=4 212 B8R0.21 C#CCOCC(C)(C)O 34a_100000210247_100000764493 [1,0,0,0,0,0|1,0,2]=4 213 B8R0.21 C#CCSCC(C)(C)O 62a_100000038162_100000764493 [1,0,0,0,0,0|1,0,2]=4 214 B8R0.21 C=CCNCC(C)(C)O 2230a_100000751335_100000210623 [1,0,0,0,0,0|1,0,2]=4 215 B8R0.21 C=CCOCC(C)(C)O 34a_200000210373_100000764493 [1,0,0,0,0,0|1,0,2]=4 216 B8R0.21 C=CCSCC(C)(C)O 62a_100000210623_100000764493 [1,0,0,0,0,0|1,0,2]=4 217 B8R0.21 C=CCSCC(C)(C)O 62a_100000764493_100000210623 [1,0,0,0,0,0|1,0,2]=4 218 B8R0.21 CC(C)(C)CCOCF 7a_100000765024_100015361967 [1,0,0,0,0,0|3,0,0]=4 219 B8R0.21 CC(C)(C)CCSCF 62a_100000755188_100015361967 [1,0,0,0,0,0|3,0,0]=4 220 B8R0.21 CC(C)(C)CCSCF 62a_100015361967_100000755188 [1,0,0,0,0,0|3,0,0]=4 221 B8R0.21 CC(C)(C)CNCCF 2230a_100000743828_100011217306 [1,0,0,0,0,0|3,0,0]=4 222 B8R0.21 CC(C)(C)CNCCF 34a_100000724931_100011219605 [1,0,0,0,0,0|3,0,0]=4 223 B8R0.21 CC(C)(C)CNCCO 2230a_100000743828_100000211926 [1,0,0,0,0,0|3,0,0]=4 224 B8R0.21 CC(C)(C)CNCCO 270004a_100000210304_100011204126 [1,0,0,0,0,0|3,0,0]=4 225 B8R0.21 CC(C)(C)CNCCO 34a_100016990907_100011219605 [1,0,0,0,0,0|3,0,0]=4 226 B8R0.21 CC(C)(C)COCCBr 34a_100000211926_100011219605 [1,0,0,0,0,0|3,0,0]=4 227 B8R0.21 CC(C)(C)COCCN 34a_100000210304_100011219605 [1,0,0,0,0,0|2,0,0]=3 228 B8R0.21 CC(C)(C)CSCCF 62a_100011217306_100011219605 [1,0,0,0,0,0|3,0,0]=4 229 B8R0.21 CC(C)(C)CSCCF 62a_100011219605_100011217306 [1,0,0,0,0,0|3,0,0]=4 230 B8R0.21 CC(C)(C)CSCCO 62a_100000211926_100011219605 [1,0,0,0,0,0|3,0,0]=4 231 B8R0.21 CC(C)(C)CSCCO 62a_100011219605_100000211926 [1,0,0,0,0,0|3,0,0]=4 232 B8R0.21 CC(C)(C)NCCCF 2230a_100000715429_100011934791 [1,0,0,0,0,0|3,0,0]=4 233 B8R0.21 CC(C)(C)NCCCF 34a_100015189416_100000210625 [1,0,0,0,0,0|3,0,0]=4 234 B8R0.21 CC(C)(C)NCCCO 2230a_100000715429_100000230001 [1,0,0,0,0,0|3,0,0]=4 235 B8R0.21 CC(C)(C)OCCCBr 34a_100011217188_100000210625 [1,0,0,0,0,0|3,0,0]=4 236 B8R0.21 CC(C)(C)OCCCCl 34a_100000230001_100000210625 [1,0,0,0,0,0|3,0,0]=4 237 B8R0.21 CC(C)(C)OCCCF 34a_100000759539_100000210625 [1,0,0,0,0,0|3,0,0]=4 238 B8R0.21 CC(C)(C)OCCCF 34a_100015890283_100011934791 [1,0,0,0,0,0|3,0,0]=4 239 B8R0.21 CC(C)(C)OCCCF 7a_100015890283_100011934791 [1,0,0,0,0,0|3,0,0]=4 240 B8R0.21 CC(C)(C)OCCCN 34a_100000182051_100000210625 [1,0,0,0,0,0|2,0,0]=3 241 B8R0.21 CC(C)(C)OCCCO 34a_100015890283_100000230001 [1,0,0,0,0,0|3,0,0]=4 242 B8R0.21 CC(C)(C)OCCCO 7a_100015890283_100011215043 [1,0,0,0,0,0|3,0,0]=4 243 B8R0.21 CC(C)(C)OCCN[13CH3] 2230a_100000747557_200025704644 [1,0,0,0,0,0|3,0,0]=4 244 B8R0.21 CC(C)(C)OCCON 34a_100000700252_100000210625 [1,0,0,0,0,0|3,0,0]=4 245 B8R0.21 CC(C)(C)OCCO[13CH3] 34a_100000693234_200025704644 [1,0,0,0,0,0|3,0,0]=4 246 B8R0.21 CC(C)(C)OCCO[13CH3] 7a_100000693234_200025704644 [1,0,0,0,0,0|3,0,0]=4 247 B8R0.21 CC(C)(C)SCCCF 62a_100000211941_100011934791 [1,0,0,0,0,0|3,0,0]=4 248 B8R0.21 CC(C)(C)SCCCF 62a_100011934791_100000211941 [1,0,0,0,0,0|3,0,0]=4 249 B8R0.21 CC(C)(C)SCCCO 62a_100000211941_100011215043 [1,0,0,0,0,0|3,0,0]=4 250 B8R0.21 CC(C)(C)SCCCO 62a_100011215043_100000211941 [1,0,0,0,0,0|3,0,0]=4 251 B8R0.21 CC(C)(C)SCCN[13CH3] 2230a_100000689375_200025704644 [1,0,0,0,0,0|3,0,0]=4 252 B8R0.21 CC(C)(F)CNCCF 2230a_100020643315_100011217306 [1,0,0,0,0,0|3,0,0]=4 253 B8R0.21 CC(C)(F)CNCCF 34a_100000724931_100011997219 [1,0,0,0,0,0|3,0,0]=4 254 B8R0.21 CC(C)(F)CNCCO 2230a_100020643315_100000211926 [1,0,0,0,0,0|3,0,0]=4 255 B8R0.21 CC(C)(F)CNCCO 34a_100016990907_100011997219 [1,0,0,0,0,0|3,0,0]=4 256 B8R0.21 CC(C)(F)COCCBr 34a_100000211926_100011997219 [1,0,0,0,0,0|3,0,0]=4 257 B8R0.21 CC(C)(F)COCCF 34a_100000716592_100011217306 [1,0,0,0,0,0|3,0,0]=4 258 B8R0.21 CC(C)(F)COCCN 34a_100000210304_100011997219 [1,0,0,0,0,0|2,0,0]=3 259 B8R0.21 CC(C)(F)COCCO 34a_100000716592_100000211926 [1,0,0,0,0,0|3,0,0]=4 260 B8R0.21 CC(C)(F)CSCCF 62a_100011217306_100011997219 [1,0,0,0,0,0|3,0,0]=4 261 B8R0.21 CC(C)(F)CSCCF 62a_100011997219_100011217306 [1,0,0,0,0,0|3,0,0]=4 262 B8R0.21 CC(C)(F)CSCCO 62a_100000211926_100011997219 [1,0,0,0,0,0|3,0,0]=4 263 B8R0.21 CC(C)(F)CSCCO 62a_100011997219_100000211926 [1,0,0,0,0,0|3,0,0]=4 264 B8R0.21 CC(C)(O)CCCS[13CH3] 62a_100009888830_200025704644 [1,0,0,0,0,0|1,0,0]=2 265 B8R0.21 CC(C)(O)CCCS[13CH3] 62a_200025704644_100009888830 [1,0,0,0,0,0|1,0,0]=2 266 B8R0.21 CC(C)(O)CCSCF 62a_100000702414_100015361967 [1,0,0,0,0,0|2,0,0]=3 267 B8R0.21 CC(C)(O)CCSCF 62a_100015361967_100000702414 [1,0,0,0,0,0|2,0,0]=3 268 B8R0.21 CC(C)(O)CNCC#N 2230a_100000751335_100011215382 [1,0,0,0,0,0|1,0,2]=4 269 B8R0.21 CC(C)(O)CNCC=O 2230a_100000751335_200015260668 [1,0,0,0,0,0|2,0,1]=4 270 B8R0.21 CC(C)(O)CNCCF 2230a_100000751335_100011217306 [1,0,0,0,0,0|2,0,0]=3 271 B8R0.21 CC(C)(O)CNCCF 34a_100000724931_100000764493 [1,0,0,0,0,0|2,0,0]=3 272 B8R0.21 CC(C)(O)CNCCO 2230a_100000751335_100000211926 [1,0,0,0,0,0|2,0,0]=3 273 B8R0.21 CC(C)(O)CNCCO 34a_100016990907_100000764493 [1,0,0,0,0,0|2,0,0]=3 274 B8R0.21 CC(C)(O)COCCBr 34a_100000211926_100000764493 [1,0,0,0,0,0|2,0,0]=3 275 B8R0.21 CC(C)(O)COCCN 34a_100000210304_100000764493 [1,0,0,0,0,0|1,0,0]=2 276 B8R0.21 CC(C)(O)CSCC#N 62a_100000764493_100011215382 [1,0,0,0,0,0|1,0,2]=4 277 B8R0.21 CC(C)(O)CSCC#N 62a_100011215382_100000764493 [1,0,0,0,0,0|1,0,2]=4 278 B8R0.21 CC(C)(O)CSCC=O 62a_100000764493_200015260668 [1,0,0,0,0,0|2,0,1]=4 279 B8R0.21 CC(C)(O)CSCC=O 62a_200015260668_100000764493 [1,0,0,0,0,0|2,0,1]=4 280 B8R0.21 CC(C)(O)CSCCF 62a_100000764493_100011217306 [1,0,0,0,0,0|2,0,0]=3 281 B8R0.21 CC(C)(O)CSCCF 62a_100011217306_100000764493 [1,0,0,0,0,0|2,0,0]=3 282 B8R0.21 CC(C)(O)CSCCO 62a_100000211926_100000764493 [1,0,0,0,0,0|2,0,0]=3 283 B8R0.21 CC(C)(O)CSCCO 62a_100000764493_100000211926 [1,0,0,0,0,0|2,0,0]=3 284 B8R0.21 CCCCNC(C)(C)C 2230a_100000715429_100000210211 [1,0,0,0,0,0|2,0,0]=3 285 B8R0.21 CCCCOC(C)(C)C 34a_100000210227_100000210625 [1,0,0,0,0,0|2,0,0]=3 286 B8R0.21 CCCCOC(C)(C)C 34a_100015890283_100000210210 [1,0,0,0,0,0|2,0,0]=3 287 B8R0.21 CCCCOC(C)(C)C 7a_100015890283_100000210211 [1,0,0,0,0,0|2,0,0]=3 288 B8R0.21 CCCCSC(C)(C)C 62a_100000210211_100000211941 [1,0,0,0,0,0|2,0,0]=3 289 B8R0.21 CCCCSC(C)(C)C 62a_100000211941_100000210210 [1,0,0,0,0,0|2,0,0]=3 290 B8R0.21 CCCNCC(C)(C)C 2230a_100000743828_100000210303 [1,0,0,0,0,0|2,0,0]=3 291 B8R0.21 CCCNCC(C)(C)C 270004a_100020643023_100011204126 [1,0,0,0,0,0|2,0,0]=3 292 B8R0.21 CCCNCC(C)(C)F 2230a_100020643315_100000210303 [1,0,0,0,0,0|2,0,0]=3 293 B8R0.21 CCCNCC(C)(C)O 2230a_100000751335_100000210303 [1,0,0,0,0,0|1,0,0]=2 294 B8R0.21 CCCOCC(C)(C)C 34a_100000210258_100011219605 [1,0,0,0,0,0|2,0,0]=3 295 B8R0.21 CCCOCC(C)(C)F 34a_100000210258_100011997219 [1,0,0,0,0,0|2,0,0]=3 296 B8R0.21 CCCOCC(C)(C)F 34a_100000716592_100000210303 [1,0,0,0,0,0|2,0,0]=3 297 B8R0.21 CCCOCC(C)(C)O 34a_100000210258_100000764493 [1,0,0,0,0,0|1,0,0]=2 298 B8R0.21 CCCOCC(C)(F)F 34a_100000068830_100000210303 [1,0,0,0,0,0|3,0,0]=4 299 B8R0.21 CCCSCC(C)(C)C 62a_100000210303_100011219605 [1,0,0,0,0,0|2,0,0]=3 300 B8R0.21 CCCSCC(C)(C)C 62a_100011219605_100000210303 [1,0,0,0,0,0|2,0,0]=3 301 B8R0.21 CCCSCC(C)(C)F 62a_100000210303_100011997219 [1,0,0,0,0,0|2,0,0]=3 302 B8R0.21 CCCSCC(C)(C)F 62a_100011997219_100000210303 [1,0,0,0,0,0|2,0,0]=3 303 B8R0.21 CCCSCC(C)(C)O 62a_100000210303_100000764493 [1,0,0,0,0,0|1,0,0]=2 304 B8R0.21 CCCSCC(C)(C)O 62a_100000764493_100000210303 [1,0,0,0,0,0|1,0,0]=2 305 B8R0.21 CCCSC[N+](C)(C)C 62a_100000210303_200000036245 [1,0,0,0,0,0|3,0,0]=4 306 B8R0.21 CCCSC[N+](C)(C)C 62a_200000036245_100000210303 [1,0,0,0,0,0|3,0,0]=4 307 B8R0.21 CCCSC[Si](C)(C)C 62a_100000037933_100000210303 [1,0,0,0,0,0|2,1,0]=4 308 B8R0.21 CCCSC[Si](C)(C)C 62a_100000210303_100000037933 [1,0,0,0,0,0|2,1,0]=4 309 B8R0.21 CCNCCC(C)(C)C 2230a_100000738805_100000210202 [1,0,0,0,0,0|2,0,0]=3 310 B8R0.21 CCNCCC(C)(C)C 2230a_100015525214_100000755188 [1,0,0,0,0,0|2,0,0]=3 311 B8R0.21 CCNCCC(C)(C)F 2230a_100016253952_100000210202 [1,0,0,0,0,0|2,0,0]=3 312 B8R0.21 CCNCCC(C)(C)O 2230a_100015525214_100000702414 [1,0,0,0,0,0|1,0,0]=2 313 B8R0.21 CCNCC[Si](C)(C)C 2230a_100015525214_200000733723 [1,0,0,0,0,0|2,1,0]=4 314 B8R0.21 CCOCCC(C)(C)C 34a_100121572206_100000755188 [1,0,0,0,0,0|2,0,0]=3 315 B8R0.21 CCOCCC(C)(C)C 7a_100000765024_100000210202 [1,0,0,0,0,0|2,0,0]=3 316 B8R0.21 CCOCCC(C)(C)O 34a_100121572206_100000702414 [1,0,0,0,0,0|1,0,0]=2 317 B8R0.21 CCOCC[N+](C)(C)C 34a_100121572206_100000085578 [1,0,0,0,0,0|3,0,0]=4 318 B8R0.21 CCOCC[N+](C)(C)C 7a_200020618287_100000210202 [1,0,0,0,0,0|3,0,0]=4 319 B8R0.21 CCOCC[Si](C)(C)C 34a_100121572206_200000733723 [1,0,0,0,0,0|2,1,0]=4 320 B8R0.21 CCOCC[Si](C)(C)C 7a_100000039746_100000210202 [1,0,0,0,0,0|2,1,0]=4 321 B8R0.21 CCOCSC(C)(C)C 62a_100000211941_100000739092 [1,0,0,0,0,0|3,0,0]=4 322 B8R0.21 CCOCSC(C)(C)C 62a_100000739092_100000211941 [1,0,0,0,0,0|3,0,0]=4 323 B8R0.21 CCSCCC(C)(C)C 62a_100000210202_100000755188 [1,0,0,0,0,0|2,0,0]=3 324 B8R0.21 CCSCCC(C)(C)C 62a_100000755188_100000210202 [1,0,0,0,0,0|2,0,0]=3 325 B8R0.21 CCSCCC(C)(C)O 62a_100000210202_100000702414 [1,0,0,0,0,0|1,0,0]=2 326 B8R0.21 CCSCCC(C)(C)O 62a_100000702414_100000210202 [1,0,0,0,0,0|1,0,0]=2 327 B8R0.21 CCSCC[N+](C)(C)C 62a_100000085578_100000210202 [1,0,0,0,0,0|3,0,0]=4 328 B8R0.21 CCSCC[N+](C)(C)C 62a_100000210202_100000085578 [1,0,0,0,0,0|3,0,0]=4 329 B8R0.21 CCSCC[Si](C)(C)C 62a_100000210202_200000733723 [1,0,0,0,0,0|2,1,0]=4 330 B8R0.21 CCSCC[Si](C)(C)C 62a_200000733723_100000210202 [1,0,0,0,0,0|2,1,0]=4 331 B8R0.21 CNCCCC(C)(C)O 2230a_106832991635_100009888830 [1,0,0,0,0,0|1,0,0]=2 332 B8R0.21 CNCCCC(C)(C)O 34a_100102657272_100009888830 [1,0,0,0,0,0|1,0,0]=2 333 B8R0.21 CNCCCC(C)(C)O 7a_106832991635_100009888830 [1,0,0,0,0,0|1,0,0]=2 334 B8R0.21 CNCCC[N+](C)(C)C 2230a_106832991635_100016990835 [1,0,0,0,0,0|3,0,0]=4 335 B8R0.21 CNCCC[N+](C)(C)C 34a_100102657272_100016990835 [1,0,0,0,0,0|3,0,0]=4 336 B8R0.21 CNCCC[N+](C)(C)C 7a_106832991635_100016990835 [1,0,0,0,0,0|3,0,0]=4 337 B8R0.21 CNCCC[Si](C)(C)C 2230a_106832991635_100011219597 [1,0,0,0,0,0|2,1,0]=4 338 B8R0.21 CNCCC[Si](C)(C)C 34a_100102657272_100011219597 [1,0,0,0,0,0|2,1,0]=4 339 B8R0.21 CNCCC[Si](C)(C)C 7a_106832991635_100011219597 [1,0,0,0,0,0|2,1,0]=4 340 B8R0.21 CNCCOC(C)(C)C 2230a_100000747557_200000210301 [1,0,0,0,0,0|3,0,0]=4 341 B8R0.21 CNCCSC(C)(C)C 2230a_100000689375_200000210301 [1,0,0,0,0,0|3,0,0]=4 342 B8R0.21 COCCCC(C)(C)O 34a_100138415774_100009888830 [1,0,0,0,0,0|1,0,0]=2 343 B8R0.21 COCCC[N+](C)(C)C 34a_100138415774_100016990835 [1,0,0,0,0,0|3,0,0]=4 344 B8R0.21 COCCC[Si](C)(C)C 34a_100138415774_100011219597 [1,0,0,0,0,0|2,1,0]=4 345 B8R0.21 COCCC[Si](C)(C)C 7a_200011215415_200000210301 [1,0,0,0,0,0|2,1,0]=4 346 B8R0.21 COCCNC(C)(C)C 2230a_100000715429_100011201679 [1,0,0,0,0,0|3,0,0]=4 347 B8R0.21 COCCOC(C)(C)C 34a_100000210237_100000210625 [1,0,0,0,0,0|3,0,0]=4 348 B8R0.21 COCCOC(C)(C)C 34a_100000693234_200000210301 [1,0,0,0,0,0|3,0,0]=4 349 B8R0.21 COCCOC(C)(C)C 34a_100015890283_100011201679 [1,0,0,0,0,0|3,0,0]=4 350 B8R0.21 COCCOC(C)(C)C 7a_100000693234_200000210301 [1,0,0,0,0,0|3,0,0]=4 351 B8R0.21 COCCOC(C)(C)C 7a_100015890283_100000233755 [1,0,0,0,0,0|3,0,0]=4 352 B8R0.21 COCCSC(C)(C)C 62a_100000211941_100000233755 [1,0,0,0,0,0|3,0,0]=4 353 B8R0.21 COCCSC(C)(C)C 62a_100000233755_100000211941 [1,0,0,0,0,0|3,0,0]=4 354 B8R0.21 COCNCC(C)(C)C 2230a_100000743828_100000766300 [1,0,0,0,0,0|3,0,0]=4 355 B8R0.21 COCNCC(C)(C)F 2230a_100020643315_100000766300 [1,0,0,0,0,0|3,0,0]=4 356 B8R0.21 COCNCC(C)(C)O 2230a_100000751335_100000766300 [1,0,0,0,0,0|2,0,0]=3 357 B8R0.21 COCSCC(C)(C)C 62a_100000766300_100011219605 [1,0,0,0,0,0|3,0,0]=4 358 B8R0.21 COCSCC(C)(C)C 62a_100011219605_100000766300 [1,0,0,0,0,0|3,0,0]=4 359 B8R0.21 COCSCC(C)(C)F 62a_100000766300_100011997219 [1,0,0,0,0,0|3,0,0]=4 360 B8R0.21 COCSCC(C)(C)F 62a_100011997219_100000766300 [1,0,0,0,0,0|3,0,0]=4 361 B8R0.21 COCSCC(C)(C)O 62a_100000764493_100000766300 [1,0,0,0,0,0|2,0,0]=3 362 B8R0.21 COCSCC(C)(C)O 62a_100000766300_100000764493 [1,0,0,0,0,0|2,0,0]=3 363 B8R0.21 CSCCCC(C)(C)O 62a_100009888830_200000210301 [1,0,0,0,0,0|1,0,0]=2 364 B8R0.21 CSCCCC(C)(C)O 62a_200000210301_100009888830 [1,0,0,0,0,0|1,0,0]=2 365 B8R0.21 CSCCC[N+](C)(C)C 62a_100016990835_200000210301 [1,0,0,0,0,0|3,0,0]=4 366 B8R0.21 CSCCC[N+](C)(C)C 62a_200000210301_100016990835 [1,0,0,0,0,0|3,0,0]=4 367 B8R0.21 CSCCC[Si](C)(C)C 62a_100011219597_200000210301 [1,0,0,0,0,0|2,1,0]=4 368 B8R0.21 CSCCC[Si](C)(C)C 62a_200000210301_100011219597 [1,0,0,0,0,0|2,1,0]=4 369 B8R0.21 CSCCNC(C)(C)C 2230a_100000715429_100000751147 [1,0,0,0,0,0|3,0,0]=4 370 B8R0.21 CSCCOC(C)(C)C 34a_100000230434_100000210625 [1,0,0,0,0,0|3,0,0]=4 371 B8R0.21 CSCCOC(C)(C)C 34a_100015890283_100000212216 [1,0,0,0,0,0|3,0,0]=4 372 B8R0.21 CSCCOC(C)(C)C 7a_100015890283_100000212216 [1,0,0,0,0,0|3,0,0]=4 373 B8R0.21 CSCCSC(C)(C)C 62a_100000211941_100000751147 [1,0,0,0,0,0|3,0,0]=4 374 B8R0.21 CSCCSC(C)(C)C 62a_100000212216_100000211941 [1,0,0,0,0,0|3,0,0]=4 375 B8R0.21 CSCNCC(C)(C)C 2230a_100000743828_100011218213 [1,0,0,0,0,0|3,0,0]=4 376 B8R0.21 CSCNCC(C)(C)F 2230a_100020643315_100011218213 [1,0,0,0,0,0|3,0,0]=4 377 B8R0.21 CSCNCC(C)(C)O 2230a_100000751335_100011218213 [1,0,0,0,0,0|2,0,0]=3 378 B8R0.21 CSCOCC(C)(C)F 34a_100000716592_100011218213 [1,0,0,0,0,0|3,0,0]=4 379 B8R0.21 CSCSCC(C)(C)C 62a_100011218213_100011219605 [1,0,0,0,0,0|3,0,0]=4 380 B8R0.21 CSCSCC(C)(C)C 62a_100011219605_100011218213 [1,0,0,0,0,0|3,0,0]=4 381 B8R0.21 CSCSCC(C)(C)F 62a_100011218213_100011997219 [1,0,0,0,0,0|3,0,0]=4 382 B8R0.21 CSCSCC(C)(C)F 62a_100011997219_100011218213 [1,0,0,0,0,0|3,0,0]=4 383 B8R0.21 CSCSCC(C)(C)O 62a_100000764493_100011218213 [1,0,0,0,0,0|2,0,0]=3 384 B8R0.21 CSCSCC(C)(C)O 62a_100011218213_100000764493 [1,0,0,0,0,0|2,0,0]=3 385 B8R0.21 C[N+](C)(C)CCCS[13CH3] 62a_100016990835_200025704644 [1,0,0,0,0,0|3,0,0]=4 386 B8R0.21 C[N+](C)(C)CCCS[13CH3] 62a_200025704644_100016990835 [1,0,0,0,0,0|3,0,0]=4 387 B8R0.21 C[Si](C)(C)CCCO[13CH3] 7a_200011215415_200025704644 [1,0,0,0,0,0|2,1,0]=4 388 B8R0.21 C[Si](C)(C)CCCS[13CH3] 62a_100011219597_200025704644 [1,0,0,0,0,0|2,1,0]=4 389 B8R0.21 C[Si](C)(C)CCCS[13CH3] 62a_200025704644_100011219597 [1,0,0,0,0,0|2,1,0]=4 390 B8R0.28 C=C(C)CCNC(C)C 2230a_100138425928_100000730704 [1,0,0,0,0,0|2,0,1]=4 391 B8R0.28 C=C(C)CCNC(C)C 34a_100138425928_100000730704 [1,0,0,0,0,0|2,0,1]=4 392 B8R0.28 C=C(C)CCOC(C)C 34a_100000212225_100000730704 [1,0,0,0,0,0|2,0,1]=4 393 B8R0.28 C=C(C)CCOC(C)C 34a_100000764851_100000210206 [1,0,0,0,0,0|2,0,1]=4 394 B8R0.28 C=C(C)CCSC(C)C 62a_100000210206_100000730704 [1,0,0,0,0,0|2,0,1]=4 395 B8R0.28 C=C(C)CCSC(C)C 62a_100000730704_100000210206 [1,0,0,0,0,0|2,0,1]=4 396 B8R0.28 C=C(C)CNCC(C)C 2230a_100000210953_100000748629 [1,0,0,0,0,0|2,0,1]=4 397 B8R0.28 C=C(C)CNCC(C)C 34a_100000210953_100000748629 [1,0,0,0,0,0|2,0,1]=4 398 B8R0.28 C=C(C)CNCC(C)O 2230a_100000210904_100000748629 [1,0,0,0,0,0|2,0,1]=4 399 B8R0.28 C=C(C)CNCC(C)O 34a_100000210904_100000748629 [1,0,0,0,0,0|2,0,1]=4 400 B8R0.28 C=C(C)COCC(C)C 34a_100000210245_100000210624 [1,0,0,0,0,0|2,0,1]=4 401 B8R0.28 C=C(C)COCC(C)C 34a_100000210257_100000748629 [1,0,0,0,0,0|2,0,1]=4 402 B8R0.28 C=C(C)COCC(C)O 34a_100000210245_100011218427 [1,0,0,0,0,0|2,0,1]=4 403 B8R0.28 C=C(C)COC[C@@H](C)N 34a_100000737577_100000748629 [1,0,0,0,0,0|1,0,2]=4 404 B8R0.28 C=C(C)COC[C@@H](C)O 34a_100000210245_100009817552 [1,0,0,0,0,0|2,0,1]=4 405 B8R0.28 C=C(C)CSCC(C)C 62a_100000210624_100000211660 [1,0,0,0,0,0|2,0,1]=4 406 B8R0.28 C=C(C)CSCC(C)C 62a_100000748629_100000210760 [1,0,0,0,0,0|2,0,1]=4 407 B8R0.28 C=C(C)CSCC(C)O 62a_100000748629_100011218427 [1,0,0,0,0,0|2,0,1]=4 408 B8R0.28 C=C(C)CSCC(C)O 62a_100011218427_100000211660 [1,0,0,0,0,0|2,0,1]=4 409 B8R0.28 C=C(C)CSC[C@@H](C)O 62a_100000748629_100009817552 [1,0,0,0,0,0|2,0,1]=4 410 B8R0.28 C=C(C)CSC[C@@H](C)O 62a_100009817552_100000211660 [1,0,0,0,0,0|2,0,1]=4 411 B8R0.28 CC(=O)CCCC(C)C 1458a_100000070787_100011214892 [1,0,0,0,0,0|1,0,1]=3 412 B8R0.28 CC(=O)CCCC(C)C 1458a_100011216857_200000210301 [1,0,0,0,0,0|1,0,1]=3 413 B8R0.28 CC(=O)CCCC(C)O 1458a_100000070787_200000718107 [1,0,0,0,0,0|1,0,1]=3 414 B8R0.28 CC(=O)CCCN(C)C 1458a_100000070787_100000695564 [1,0,0,0,0,0|2,0,1]=4 415 B8R0.28 CC(=O)CCCN(C)C 269982a_100102631434_100011215641 [1,0,0,0,0,0|2,0,1]=4 416 B8R0.28 CC(=O)CCOC(C)C 1458a_100000070787_100000211751 [1,0,0,0,0,0|2,0,1]=4 417 B8R0.28 CC(=O)CCOC(C)C 34a_100000759926_100000210206 [1,0,0,0,0,0|2,0,1]=4 418 B8R0.28 CC(=O)CCOC(C)C 7a_100000759926_100000210206 [1,0,0,0,0,0|2,0,1]=4 419 B8R0.28 CC(=O)CCSC(C)C 1458a_100000070787_100000730970 [1,0,0,0,0,0|2,0,1]=4 420 B8R0.28 CC(=O)CCSC(C)C 62a_100000053229_100000210206 [1,0,0,0,0,0|2,0,1]=4 421 B8R0.28 CC(=O)CCSC(C)C 62a_100000210206_100000053229 [1,0,0,0,0,0|2,0,1]=4 422 B8R0.28 CC(=O)COCC(C)C 1458a_100011223364_200000210301 [1,0,0,0,0,0|2,0,1]=4 423 B8R0.28 CC(=O)COCC(C)C 34a_100000211253_100000210624 [1,0,0,0,0,0|2,0,1]=4 424 B8R0.28 CC(=O)COCC(C)O 34a_100000211253_100011218427 [1,0,0,0,0,0|2,0,1]=4 425 B8R0.28 CC(=O)COC[C@@H](C)O 34a_100000211253_100009817552 [1,0,0,0,0,0|2,0,1]=4 426 B8R0.28 CC(=O)NCCC(C)C 11a_100000210545_100015343762 [1,0,0,0,0,0|2,0,1]=4 427 B8R0.28 CC(=O)NCCC(C)C 1626a_100000210545_100015343762 [1,0,0,0,0,0|2,0,1]=4 428 B8R0.28 CC(=O)NCCC(C)C 240690a_100000210545_100015343762 [1,0,0,0,0,0|2,0,1]=4 429 B8R0.28 CC(=O)NCCC(C)C 527a_100000210545_100103153847 [1,0,0,0,0,0|2,0,1]=4 430 B8R0.28 CC(=O)NCCC(C)O 240690a_200000755665_100015343762 [1,0,0,0,0,0|2,0,1]=4 431 B8R0.28 CC(=O)NCCC(C)O 527a_200000755665_100103153847 [1,0,0,0,0,0|2,0,1]=4 432 B8R0.28 CC(Br)CCOC(C)C 34a_100009893172_100000210206 [1,0,0,0,0,0|2,0,0]=3 433 B8R0.28 CC(Br)COC[C@@H](C)O 34a_100012180447_100009817552 [1,0,0,0,0,0|2,0,0]=3 434 B8R0.28 CC(C)CCCC(=O)[13CH3] 1458a_100011216857_200025704644 [1,0,0,0,0,0|1,0,1]=3 435 B8R0.28 CC(C)CCCN(C)C 2230a_100102631434_100011214892 [1,0,0,0,0,0|2,0,0]=3 436 B8R0.28 CC(C)CCCN(C)C 269982a_100102631434_100011214892 [1,0,0,0,0,0|2,0,0]=3 437 B8R0.28 CC(C)CCNC(C)C 2230a_100138425928_100000210312 [1,0,0,0,0,0|2,0,0]=3 438 B8R0.28 CC(C)CCNC(C)C 34a_100138425928_100000210312 [1,0,0,0,0,0|2,0,0]=3 439 B8R0.28 CC(C)CCOC(C)C 34a_100000210254_100000210206 [1,0,0,0,0,0|2,0,0]=3 440 B8R0.28 CC(C)CCOC(C)C 34a_100000212225_100000210312 [1,0,0,0,0,0|2,0,0]=3 441 B8R0.28 CC(C)CCOC(C)C 7a_100000210254_100000210206 [1,0,0,0,0,0|2,0,0]=3 442 B8R0.28 CC(C)CCSC(C)C 62a_100000210206_100000210312 [1,0,0,0,0,0|2,0,0]=3 443 B8R0.28 CC(C)CCSC(C)C 62a_100000210312_100000210206 [1,0,0,0,0,0|2,0,0]=3 444 B8R0.28 CC(C)CNCC(=O)N 2230a_100000210953_100000747473 [1,0,0,0,0,0|2,0,1]=4 445 B8R0.28 CC(C)CNCC(=O)N 2230a_100000711301_100000210760 [1,0,0,0,0,0|2,0,1]=4 446 B8R0.28 CC(C)CNCC(=O)N 34a_100000210953_100000187820 [1,0,0,0,0,0|2,0,1]=4 447 B8R0.28 CC(C)CNCC(C)C 2230a_100000210953_100000210760 [1,0,0,0,0,0|2,0,0]=3 448 B8R0.28 CC(C)CNCC(C)C 270004a_100000210953_100000210432 [1,0,0,0,0,0|2,0,0]=3 449 B8R0.28 CC(C)CNCC(C)C 34a_100000210953_100000210624 [1,0,0,0,0,0|2,0,0]=3 450 B8R0.28 CC(C)CNCC(C)O 2230a_100000210904_100000210760 [1,0,0,0,0,0|2,0,0]=3 451 B8R0.28 CC(C)CNCC(C)O 2230a_100000210953_100011218427 [1,0,0,0,0,0|2,0,0]=3 452 B8R0.28 CC(C)CNCC(C)O 270004a_100000210904_100000210432 [1,0,0,0,0,0|2,0,0]=3 453 B8R0.28 CC(C)CNCC(C)O 34a_100000210904_100000210624 [1,0,0,0,0,0|2,0,0]=3 454 B8R0.28 CC(C)CNCC(C)O 34a_100000210953_100011218427 [1,0,0,0,0,0|2,0,0]=3 455 B8R0.28 CC(C)CNCC(F)F 2230a_100000210953_100011934356 [1,0,0,0,0,0|3,0,0]=4 456 B8R0.28 CC(C)CNCC(F)F 270004a_100000765723_100000210432 [1,0,0,0,0,0|3,0,0]=4 457 B8R0.28 CC(C)CNCC(F)F 34a_100000210953_100011934356 [1,0,0,0,0,0|3,0,0]=4 458 B8R0.28 CC(C)CNCC(F)F 34a_100000765723_100000210624 [1,0,0,0,0,0|3,0,0]=4 459 B8R0.28 CC(C)CNC[C@@H](C)O 2230a_100000210953_100009817552 [1,0,0,0,0,0|2,0,0]=3 460 B8R0.28 CC(C)CNC[C@@H](C)O 34a_100000210953_100009817552 [1,0,0,0,0,0|2,0,0]=3 461 B8R0.28 CC(C)COCC(=O)N 34a_100000210257_100000187820 [1,0,0,0,0,0|2,0,1]=4 462 B8R0.28 CC(C)COCC(=O)[13CH3] 1458a_100011223364_200025704644 [1,0,0,0,0,0|2,0,1]=4 463 B8R0.28 CC(C)COCC(C)Br 34a_100012180447_100000210624 [1,0,0,0,0,0|2,0,0]=3 464 B8R0.28 CC(C)COCC(C)C 34a_100000210257_100000210624 [1,0,0,0,0,0|2,0,0]=3 465 B8R0.28 CC(C)COCC(C)F 34a_100015925927_100000210624 [1,0,0,0,0,0|2,0,0]=3 466 B8R0.28 CC(C)COCC(C)O 34a_100000210257_100011218427 [1,0,0,0,0,0|2,0,0]=3 467 B8R0.28 CC(C)COCC(F)F 34a_100000210257_100011934356 [1,0,0,0,0,0|3,0,0]=4 468 B8R0.28 CC(C)COCC(F)F 34a_100000743014_100000210624 [1,0,0,0,0,0|3,0,0]=4 469 B8R0.28 CC(C)COC[C@@H](C)Cl 34a_100016084084_100000210624 [1,0,0,0,0,0|2,0,0]=3 470 B8R0.28 CC(C)COC[C@@H](C)N 34a_100000737577_100000210624 [1,0,0,0,0,0|1,0,0]=2 471 B8R0.28 CC(C)COC[C@@H](C)O 34a_100000210257_100009817552 [1,0,0,0,0,0|2,0,0]=3 472 B8R0.28 CC(C)CSCC(=O)N 62a_100000210624_100000747473 [1,0,0,0,0,0|2,0,1]=4 473 B8R0.28 CC(C)CSCC(=O)N 62a_100000747473_100000210760 [1,0,0,0,0,0|2,0,1]=4 474 B8R0.28 CC(C)CSCC(C)C 62a_100000210624_100000210760 [1,0,0,0,0,0|2,0,0]=3 475 B8R0.28 CC(C)CSCC(C)O 62a_100000210624_100011218427 [1,0,0,0,0,0|2,0,0]=3 476 B8R0.28 CC(C)CSCC(C)O 62a_100011218427_100000210760 [1,0,0,0,0,0|2,0,0]=3 477 B8R0.28 CC(C)CSCC(F)F 62a_100000210624_100011934356 [1,0,0,0,0,0|3,0,0]=4 478 B8R0.28 CC(C)CSCC(F)F 62a_100011934356_100000210760 [1,0,0,0,0,0|3,0,0]=4 479 B8R0.28 CC(C)CSC[C@@H](C)O 62a_100000210624_100009817552 [1,0,0,0,0,0|2,0,0]=3 480 B8R0.28 CC(C)CSC[C@@H](C)O 62a_100009817552_100000210760 [1,0,0,0,0,0|2,0,0]=3 481 B8R0.28 CC(C)NCCC(=O)N 2230a_100138425928_100000744528 [1,0,0,0,0,0|2,0,1]=4 482 B8R0.28 CC(C)NCCC(=O)N 34a_100138425928_100000731001 [1,0,0,0,0,0|2,0,1]=4 483 B8R0.28 CC(C)NCOC(C)C 2230a_100138425928_100000709892 [1,0,0,0,0,0|3,0,0]=4 484 B8R0.28 CC(C)NCOC(C)C 34a_100138425928_100000709892 [1,0,0,0,0,0|3,0,0]=4 485 B8R0.28 CC(C)OCCC(=O)N 34a_100000212225_100000731001 [1,0,0,0,0,0|2,0,1]=4 486 B8R0.28 CC(C)OCCC(=O)N 34a_100000757172_100000210206 [1,0,0,0,0,0|2,0,1]=4 487 B8R0.28 CC(C)OCCC(=O)N 7a_100000757172_100000210206 [1,0,0,0,0,0|2,0,1]=4 488 B8R0.28 CC(C)OCCC(F)F 34a_100103093639_100000210206 [1,0,0,0,0,0|3,0,0]=4 489 B8R0.28 CC(C)OCCN(C)C 2230a_100102631434_100000211751 [1,0,0,0,0,0|3,0,0]=4 490 B8R0.28 CC(C)OCCN(C)C 269982a_100102631434_100000211751 [1,0,0,0,0,0|3,0,0]=4 491 B8R0.28 CC(C)OCC[C@@H](C)N 34a_100000706166_100000210206 [1,0,0,0,0,0|1,0,0]=2 492 B8R0.28 CC(C)OCOC(C)C 34a_100000212225_100000709892 [1,0,0,0,0,0|3,0,0]=4 493 B8R0.28 CC(C)OCSC(C)C 62a_100000210206_100000709892 [1,0,0,0,0,0|3,0,0]=4 494 B8R0.28 CC(C)OCSC(C)C 62a_100000709892_100000210206 [1,0,0,0,0,0|3,0,0]=4 495 B8R0.28 CC(C)SCCC(=O)N 62a_100000210206_100000744528 [1,0,0,0,0,0|2,0,1]=4 496 B8R0.28 CC(C)SCCC(=O)N 62a_100000744528_100000210206 [1,0,0,0,0,0|2,0,1]=4 497 B8R0.28 CC(C)SCCN(C)C 2230a_100102631434_100000730970 [1,0,0,0,0,0|3,0,0]=4 498 B8R0.28 CC(C)SCCN(C)C 269982a_100102631434_100000730970 [1,0,0,0,0,0|3,0,0]=4 499 B8R0.28 CC(C)SCCN(C)C 62a_100000210206_100000755713 [1,0,0,0,0,0|3,0,0]=4 500 B8R0.28 CC(F)COC[C@@H](C)O 34a_100015925927_100009817552 [1,0,0,0,0,0|2,0,0]=3 501 B8R0.28 CC(O)CCCN(C)C 2230a_100102631434_200000718107 [1,0,0,0,0,0|2,0,0]=3 502 B8R0.28 CC(O)CCCN(C)C 269982a_100102631434_200000718107 [1,0,0,0,0,0|2,0,0]=3 503 B8R0.28 CC(O)CCNC(C)C 2230a_100138425928_100012276601 [1,0,0,0,0,0|2,0,0]=3 504 B8R0.28 CC(O)CCNC(C)C 2230a_200000755665_100000210206 [1,0,0,0,0,0|2,0,0]=3 505 B8R0.28 CC(O)CCNC(C)C 34a_100138425928_100012276601 [1,0,0,0,0,0|2,0,0]=3 506 B8R0.28 CC(O)CCOC(C)C 34a_100000212225_100012276601 [1,0,0,0,0,0|2,0,0]=3 507 B8R0.28 CC(O)CCSC(C)C 62a_100000210206_100012276601 [1,0,0,0,0,0|2,0,0]=3 508 B8R0.28 CC(O)CCSC(C)C 62a_100012276601_100000210206 [1,0,0,0,0,0|2,0,0]=3 509 B8R0.28 CC(O)CNCC(=O)N 2230a_100000210904_100000747473 [1,0,0,0,0,0|2,0,1]=4 510 B8R0.28 CC(O)CNCC(=O)N 2230a_100000711301_100011218427 [1,0,0,0,0,0|2,0,1]=4 511 B8R0.28 CC(O)CNCC(=O)N 34a_100000210904_100000187820 [1,0,0,0,0,0|2,0,1]=4 512 B8R0.28 CC(O)CNCC(C)O 2230a_100000210904_100011218427 [1,0,0,0,0,0|2,0,0]=3 513 B8R0.28 CC(O)CNCC(C)O 34a_100000210904_100011218427 [1,0,0,0,0,0|2,0,0]=3 514 B8R0.28 CC(O)CNCC(F)F 2230a_100000210904_100011934356 [1,0,0,0,0,0|3,0,0]=4 515 B8R0.28 CC(O)CNCC(F)F 34a_100000210904_100011934356 [1,0,0,0,0,0|3,0,0]=4 516 B8R0.28 CC(O)CNCC(F)F 34a_100000765723_100011218427 [1,0,0,0,0,0|3,0,0]=4 517 B8R0.28 CC(O)CNC[C@@H](C)O 2230a_100000210904_100009817552 [1,0,0,0,0,0|2,0,0]=3 518 B8R0.28 CC(O)CNC[C@@H](C)O 34a_100000210904_100009817552 [1,0,0,0,0,0|2,0,0]=3 519 B8R0.28 CC(O)COCC(C)Br 34a_100012180447_100011218427 [1,0,0,0,0,0|2,0,0]=3 520 B8R0.28 CC(O)COCC(C)F 34a_100015925927_100011218427 [1,0,0,0,0,0|2,0,0]=3 521 B8R0.28 CC(O)COCC(F)F 34a_100000743014_100011218427 [1,0,0,0,0,0|3,0,0]=4 522 B8R0.28 CC(O)COC[C@@H](C)Cl 34a_100016084084_100011218427 [1,0,0,0,0,0|2,0,0]=3 523 B8R0.28 CC(O)COC[C@@H](C)N 34a_100000737577_100011218427 [1,0,0,0,0,0|1,0,0]=2 524 B8R0.28 CC(O)CSCC(=O)N 62a_100000747473_100011218427 [1,0,0,0,0,0|2,0,1]=4 525 B8R0.28 CC(O)CSCC(=O)N 62a_100011218427_100000747473 [1,0,0,0,0,0|2,0,1]=4 526 B8R0.28 CC(O)CSCC(C)O 62a_100011218427_100011218427 [1,0,0,0,0,0|2,0,0]=3 527 B8R0.28 CC(O)CSCC(F)F 62a_100011218427_100011934356 [1,0,0,0,0,0|3,0,0]=4 528 B8R0.28 CC(O)CSCC(F)F 62a_100011934356_100011218427 [1,0,0,0,0,0|3,0,0]=4 529 B8R0.28 CC(O)CSC[C@@H](C)O 62a_100009817552_100011218427 [1,0,0,0,0,0|2,0,0]=3 530 B8R0.28 CC(O)CSC[C@@H](C)O 62a_100011218427_100009817552 [1,0,0,0,0,0|2,0,0]=3 531 B8R0.28 CN(C)CCCC(=O)N 269982a_100102631434_100102525003 [1,0,0,0,0,0|2,0,1]=4 532 B8R0.28 CN(C)CCCN(C)C 269982a_100000225831_200000210301 [1,0,0,0,0,0|3,0,0]=4 533 B8R0.28 CN(C)CCCN(C)C 269982a_100102631434_100000757444 [1,0,0,0,0,0|3,0,0]=4 534 B8R0.28 CN(C)CCCN(C)[13CH3] 269982a_100000225831_200025704644 [1,0,0,0,0,0|3,0,0]=4 535 B8R0.28 C[C@@H](N)COCC(F)F 34a_100000737577_100011934356 [1,0,0,0,0,0|3,0,0]=4 536 B8R0.28 C[C@@H](N)COC[C@@H](C)O 34a_100000737577_100009817552 [1,0,0,0,0,0|1,0,0]=2 537 B8R0.28 C[C@@H](O)CNCC(=O)N 2230a_100000711301_100009817552 [1,0,0,0,0,0|2,0,1]=4 538 B8R0.28 C[C@@H](O)CNCC(F)F 34a_100000765723_100009817552 [1,0,0,0,0,0|3,0,0]=4 539 B8R0.28 C[C@@H](O)COCC(F)F 34a_100000743014_100009817552 [1,0,0,0,0,0|3,0,0]=4 540 B8R0.28 C[C@@H](O)COC[C@@H](C)Cl 34a_100016084084_100009817552 [1,0,0,0,0,0|2,0,0]=3 541 B8R0.28 C[C@@H](O)CSCC(=O)N 62a_100000747473_100009817552 [1,0,0,0,0,0|2,0,1]=4 542 B8R0.28 C[C@@H](O)CSCC(=O)N 62a_100009817552_100000747473 [1,0,0,0,0,0|2,0,1]=4 543 B8R0.28 C[C@@H](O)CSCC(F)F 62a_100009817552_100011934356 [1,0,0,0,0,0|3,0,0]=4 544 B8R0.28 C[C@@H](O)CSCC(F)F 62a_100011934356_100009817552 [1,0,0,0,0,0|3,0,0]=4 545 B8R0.28 C[C@@H](O)CSC[C@@H](C)O 62a_100009817552_100009817552 [1,0,0,0,0,0|2,0,0]=3 546 B10R0.12 C=C(C)CCC(=O)C(C)(C)O 1458a_100000242741_100000730704 [0,1,0,0,0,0|1,0,2]=4 547 B10R0.12 C=C(C)CN[C@@H](C)C(C)(C)O 2230a_100025708725_100000748629 [0,1,0,0,0,0|2,0,1]=4 548 B10R0.12 CC(=O)NC[C@@H](F)C(C)(C)O 1626a_100015379105_100015343762 [0,1,0,0,0,0|2,0,1]=4 549 B10R0.12 CC(=O)NC[C@@H](F)C(C)(C)O 527a_100015379105_100103153847 [0,1,0,0,0,0|2,0,1]=4 550 B10R0.12 CC(C)CCC(=O)C(C)(C)C 1458a_106744555173_100000210312 [0,1,0,0,0,0|2,0,1]=4 551 B10R0.12 CC(C)CCC(=O)C(C)(C)F 1458a_100000765255_100000210312 [0,1,0,0,0,0|2,0,1]=4 552 B10R0.12 CC(C)CCC(=O)C(C)(C)O 1458a_100000242741_100000210312 [0,1,0,0,0,0|1,0,1]=3 553 B10R0.12 CC(C)CCN(C)C(C)(C)C 269982a_100000742789_100000210625 [0,1,0,0,0,0|3,0,0]=4 554 B10R0.12 CC(C)CCN(C)C(C)(C)C 269982a_100011215553_100000210312 [0,1,0,0,0,0|3,0,0]=4 555 B10R0.12 CC(C)CNC(=O)C(C)(C)O 240690a_100000210953_100000242741 [0,1,0,0,0,0|2,0,1]=4 556 B10R0.12 CC(C)CNC(C)C(C)(C)O 269862a_100000210953_100000747739 [0,1,0,0,0,0|2,0,0]=3 557 B10R0.12 CC(C)CN[C@@H](C)C(C)(C)O 2230a_100025708725_100000210760 [0,1,0,0,0,0|2,0,0]=3 558 B10R0.12 CC(C)CN[C@H](C)C(C)(C)C 2230a_100025703359_100000210760 [0,1,0,0,0,0|3,0,0]=4 559 B10R0.12 CC(C)CN[C@H](C)C(C)(C)C 270004a_100025703359_100000210432 [0,1,0,0,0,0|3,0,0]=4 560 B10R0.12 CC(O)CCC(=O)C(C)(C)C 1458a_106744555173_100012276601 [0,1,0,0,0,0|2,0,1]=4 561 B10R0.12 CC(O)CCC(=O)C(C)(C)F 1458a_100000765255_100012276601 [0,1,0,0,0,0|2,0,1]=4 562 B10R0.12 CC(O)CCC(=O)C(C)(C)O 1458a_100000242741_100012276601 [0,1,0,0,0,0|1,0,1]=3 563 B10R0.12 CC(O)CCN(C)C(C)(C)C 269982a_100011215553_100012276601 [0,1,0,0,0,0|3,0,0]=4 564 B10R0.12 CC(O)CNC(=O)C(C)(C)O 240690a_100000210904_100000242741 [0,1,0,0,0,0|2,0,1]=4 565 B10R0.12 CC(O)CNC(C)C(C)(C)O 269862a_100000210904_100000747739 [0,1,0,0,0,0|2,0,0]=3 566 B10R0.12 CC(O)CN[C@@H](C)C(C)(C)O 2230a_100025708725_100011218427 [0,1,0,0,0,0|2,0,0]=3 567 B10R0.12 CC(O)CN[C@H](C)C(C)(C)C 2230a_100025703359_100011218427 [0,1,0,0,0,0|3,0,0]=4 568 B10R0.12 C[C@@H](O)CN[C@H](C)C(C)(C)C 2230a_100025703359_100009817552 [0,1,0,0,0,0|3,0,0]=4 569 B10R0.12 C[C@H](NCC(=O)N)C(C)(C)O 2230a_100025708725_100000747473 [0,1,0,0,0,0|2,0,1]=4 570 B10R0.12 C[C@H](NCC(F)F)C(C)(C)O 2230a_100025708725_100011934356 [0,1,0,0,0,0|3,0,0]=4 571 B10R0.12 C[C@H](NC[C@@H](C)O)C(C)(C)O 2230a_100025708725_100009817552 [0,1,0,0,0,0|2,0,0]=3 572 B10R0.31 C=C(C)CC(=O)CC(C)(C)O 1458a_100000693243_100000748629 [0,1,0,0,0,0|1,0,2]=4 573 B10R0.31 C=C(C)CN(C)CC(C)(C)O 2230a_100000755907_100000748629 [0,1,0,0,0,0|2,0,1]=4 574 B10R0.31 C=C(C)CN(C)CC(C)(C)O 269982a_100000755907_100000748629 [0,1,0,0,0,0|2,0,1]=4 575 B10R0.31 CC(=O)CC(C)CC(C)(C)C 1458a_100000239893_200000210301 [0,1,0,0,0,0|2,0,1]=4 576 B10R0.31 CC(C)(O)CC(=O)CC(=O)N 1458a_100000693243_100000187820 [0,1,0,0,0,0|1,0,2]=4 577 B10R0.31 CC(C)(O)CC(=O)CC(F)F 1458a_100000693243_100011934356 [0,1,0,0,0,0|2,0,1]=4 578 B10R0.31 CC(C)CC(=O)CC(C)(C)C 1458a_100000211214_100000210624 [0,1,0,0,0,0|2,0,1]=4 579 B10R0.31 CC(C)CC(=O)CC(C)(C)O 1458a_100000693243_100000210624 [0,1,0,0,0,0|1,0,1]=3 580 B10R0.31 CC(C)CC(C)NC(C)(C)C 2230a_100000715429_100000731052 [0,1,0,0,0,0|3,0,0]=4 581 B10R0.31 CC(C)CC(C)OC(C)(C)C 34a_100000211805_100000210625 [0,1,0,0,0,0|3,0,0]=4 582 B10R0.31 CC(C)CC(C)OC(C)(C)C 34a_100015890283_100000731052 [0,1,0,0,0,0|3,0,0]=4 583 B10R0.31 CC(C)CC(C)OC(C)(C)C 7a_100015890283_100000731052 [0,1,0,0,0,0|3,0,0]=4 584 B10R0.31 CC(C)CC(C)SC(C)(C)C 62a_100000211941_100000731052 [0,1,0,0,0,0|3,0,0]=4 585 B10R0.31 CC(C)CC(C)SC(C)(C)C 62a_100000731052_100000211941 [0,1,0,0,0,0|3,0,0]=4 586 B10R0.31 CC(C)CN(C)CC(C)(C)C 2230a_100000742839_100000210760 [0,1,0,0,0,0|3,0,0]=4 587 B10R0.31 CC(C)CN(C)CC(C)(C)C 269982a_100000742839_100000210624 [0,1,0,0,0,0|3,0,0]=4 588 B10R0.31 CC(C)CN(C)CC(C)(C)C 270004a_100000742839_100000210432 [0,1,0,0,0,0|3,0,0]=4 589 B10R0.31 CC(C)CN(C)CC(C)(C)C 270004a_100000747067_100011204126 [0,1,0,0,0,0|3,0,0]=4 590 B10R0.31 CC(C)CN(C)CC(C)(C)O 2230a_100000755907_100000210760 [0,1,0,0,0,0|2,0,0]=3 591 B10R0.31 CC(C)CN(C)CC(C)(C)O 269982a_100000755907_100000210624 [0,1,0,0,0,0|2,0,0]=3 592 B10R0.31 CC(C)CN(C)CC(C)(C)O 270004a_100000755907_100000210432 [0,1,0,0,0,0|2,0,0]=3 593 B10R0.31 CC(C)NC(=O)CC(C)(C)O 527a_100138425928_100000693243 [0,1,0,0,0,0|2,0,1]=4 594 B10R0.31 CC(C)N[C@@H](C)CC(C)(C)C 2230a_106358413534_100000210206 [0,1,0,0,0,0|3,0,0]=4 595 B10R0.31 CC(C)OC(C)CC(C)(C)C 7a_200011218616_100000210206 [0,1,0,0,0,0|3,0,0]=4 596 B10R0.31 CC(CC(=O)[13CH3])CC(C)(C)C 1458a_100000239893_200025704644 [0,1,0,0,0,0|2,0,1]=4 597 B10R0.31 CC(O)CC(=O)CC(C)(C)C 1458a_100000211214_100011218427 [0,1,0,0,0,0|2,0,1]=4 598 B10R0.31 CC(O)CC(=O)CC(C)(C)O 1458a_100000693243_100011218427 [0,1,0,0,0,0|1,0,1]=3 599 B10R0.31 CC(O)CN(C)CC(C)(C)C 2230a_100000742839_100011218427 [0,1,0,0,0,0|3,0,0]=4 600 B10R0.31 CC(O)CN(C)CC(C)(C)C 269982a_100000742839_100011218427 [0,1,0,0,0,0|3,0,0]=4 601 B10R0.31 CC(O)CN(C)CC(C)(C)C 270004a_100000227577_100011204126 [0,1,0,0,0,0|3,0,0]=4 602 B10R0.31 CC(O)CN(C)CC(C)(C)O 2230a_100000755907_100011218427 [0,1,0,0,0,0|2,0,0]=3 603 B10R0.31 CC(O)CN(C)CC(C)(C)O 269982a_100000755907_100011218427 [0,1,0,0,0,0|2,0,0]=3 604 B10R0.31 CN(CC(=O)N)CC(C)(C)O 2230a_100000755907_100000747473 [0,1,0,0,0,0|2,0,1]=4 605 B10R0.31 CN(CC(=O)N)CC(C)(C)O 269982a_100000755907_100000187820 [0,1,0,0,0,0|2,0,1]=4 606 B10R0.31 CN(CC(F)F)CC(C)(C)O 2230a_100000755907_100011934356 [0,1,0,0,0,0|3,0,0]=4 607 B10R0.31 CN(CC(F)F)CC(C)(C)O 269982a_100000755907_100011934356 [0,1,0,0,0,0|3,0,0]=4 608 B10R0.31 C[C@@H](O)CN(C)CC(C)(C)C 2230a_100000742839_100009817552 [0,1,0,0,0,0|3,0,0]=4 609 B10R0.31 C[C@@H](O)CN(C)CC(C)(C)C 269982a_100000742839_100009817552 [0,1,0,0,0,0|3,0,0]=4 610 B10R0.31 C[C@@H](O)CN(C)CC(C)(C)O 2230a_100000755907_100009817552 [0,1,0,0,0,0|2,0,0]=3 611 B10R0.31 C[C@@H](O)CN(C)CC(C)(C)O 269982a_100000755907_100009817552 [0,1,0,0,0,0|2,0,0]=3 612 B10R0.60 C#CC(C)NCCC(C)(C)C 2230a_100000707721_100000755188 [0,1,0,0,0,0|3,0,0]=4 613 B10R0.60 C#CC(C)NCCC(C)(C)C 34a_100000707721_100000755188 [0,1,0,0,0,0|3,0,0]=4 614 B10R0.60 C#CC(C)NCCC(C)(C)O 2230a_100000707721_100000702414 [0,1,0,0,0,0|2,0,0]=3 615 B10R0.60 C#CC(C)NCCC(C)(C)O 34a_100000707721_100000702414 [0,1,0,0,0,0|2,0,0]=3 616 B10R0.60 C#CC(C)SCCC(C)(C)C 62a_200000035995_100000755188 [0,1,0,0,0,0|3,0,0]=4 617 B10R0.60 C#CC(C)SCCC(C)(C)O 62a_200000035995_100000702414 [0,1,0,0,0,0|2,0,0]=3 618 B10R0.60 C#C[C@@H](C)OCCC(C)(C)C 34a_100009815206_100000755188 [0,1,0,0,0,0|3,0,0]=4 619 B10R0.60 C#C[C@@H](C)OCCC(C)(C)C 7a_100009815206_100000755188 [0,1,0,0,0,0|3,0,0]=4 620 B10R0.60 C#C[C@@H](C)OCCC(C)(C)O 34a_100009815206_100000702414 [0,1,0,0,0,0|2,0,0]=3 621 B10R0.60 C#C[C@@H](C)OCCC(C)(C)O 7a_100009815206_100000702414 [0,1,0,0,0,0|2,0,0]=3 622 B10R0.60 C=CC(C)COCC(C)(C)C 34a_100011215527_100011219605 [0,1,0,0,0,0|3,0,0]=4 623 B10R0.60 C=CC(C)COCC(C)(C)F 34a_100011215527_100011997219 [0,1,0,0,0,0|3,0,0]=4 624 B10R0.60 C=CC(C)COCC(C)(C)O 34a_100011215527_100000764493 [0,1,0,0,0,0|2,0,0]=3 625 B10R0.60 C=CC(C)COCC(C)(C)O 7a_100011215527_100000764493 [0,1,0,0,0,0|2,0,0]=3 626 B10R0.60 C=CC(C)OCCC(C)(C)C 34a_100000695699_100000755188 [0,1,0,0,0,0|3,0,0]=4 627 B10R0.60 C=CC(C)OCCC(C)(C)O 34a_100000695699_100000702414 [0,1,0,0,0,0|2,0,0]=3 628 B10R0.60 C=CC(C)SCCC(C)(C)C 62a_100011215867_100000755188 [0,1,0,0,0,0|3,0,0]=4 629 B10R0.60 C=CC(C)SCCC(C)(C)O 62a_100011215867_100000702414 [0,1,0,0,0,0|2,0,0]=3 630 B10R0.60 C=CC(O)CNCC(C)(C)O 2230a_100000751335_100000730141 [0,1,0,0,0,0|2,0,1]=4 631 B10R0.60 C=CC(O)CSCC(C)(C)O 62a_100000730141_100000764493 [0,1,0,0,0,0|2,0,1]=4 632 B10R0.60 C=CC(O)CSCC(C)(C)O 62a_100000764493_100000730141 [0,1,0,0,0,0|2,0,1]=4 633 B10R0.60 C=C[C@H](N)COCC(C)(C)C 34a_100016989147_100011219605 [0,1,0,0,0,0|2,0,1]=4 634 B10R0.60 C=C[C@H](N)COCC(C)(C)F 34a_100016989147_100011997219 [0,1,0,0,0,0|2,0,1]=4 635 B10R0.60 C=C[C@H](N)COCC(C)(C)O 34a_100016989147_100000764493 [0,1,0,0,0,0|1,0,1]=3 636 B10R0.60 CC(C#N)NCCC(C)(C)C 2230a_100000737613_100000755188 [0,1,0,0,0,0|2,0,1]=4 637 B10R0.60 CC(C#N)NCCC(C)(C)C 2230a_100000738805_100000184139 [0,1,0,0,0,0|2,0,1]=4 638 B10R0.60 CC(C#N)NCCC(C)(C)F 2230a_100016253952_100000184139 [0,1,0,0,0,0|2,0,1]=4 639 B10R0.60 CC(C#N)NCCC(C)(C)O 2230a_100000737613_100000702414 [0,1,0,0,0,0|1,0,1]=3 640 B10R0.60 CC(C#N)OCCC(C)(C)C 34a_100011218135_100000755188 [0,1,0,0,0,0|2,0,1]=4 641 B10R0.60 CC(C#N)OCCC(C)(C)C 7a_100000765024_100000703298 [0,1,0,0,0,0|2,0,1]=4 642 B10R0.60 CC(C#N)OCCC(C)(C)O 34a_100011218135_100000702414 [0,1,0,0,0,0|1,0,1]=3 643 B10R0.60 CC(C#N)SCCC(C)(C)C 62a_100000703298_100000755188 [0,1,0,0,0,0|2,0,1]=4 644 B10R0.60 CC(C#N)SCCC(C)(C)C 62a_100000755188_100000703298 [0,1,0,0,0,0|2,0,1]=4 645 B10R0.60 CC(C#N)SCCC(C)(C)O 62a_100000702414_100000703298 [0,1,0,0,0,0|1,0,1]=3 646 B10R0.60 CC(C#N)SCCC(C)(C)O 62a_100000703298_100000702414 [0,1,0,0,0,0|1,0,1]=3 647 B10R0.60 CC(C)(C)CNCC(O)CO 2230a_100000743828_100011219619 [0,1,0,0,0,0|3,0,0]=4 648 B10R0.60 CC(C)(C)CNC[C@@H](F)CO 270004a_100015665980_100011204126 [0,1,0,0,0,0|3,0,0]=4 649 B10R0.60 CC(C)(C)CNC[C@@H](F)CO 34a_100015665980_100011219605 [0,1,0,0,0,0|3,0,0]=4 650 B10R0.60 CC(C)(C)CNC[C@@H](O)CF 2230a_100000743828_100015614560 [0,1,0,0,0,0|3,0,0]=4 651 B10R0.60 CC(C)(C)CNC[C@@H](O)CO 2230a_100000743828_100009815848 [0,1,0,0,0,0|3,0,0]=4 652 B10R0.60 CC(C)(C)COCC(Cl)CCl 34a_100000033668_100011219605 [0,1,0,0,0,0|3,0,0]=4 653 B10R0.60 CC(C)(C)COC[C@H](F)CN 34a_100015665980_100011219605 [0,1,0,0,0,0|3,0,0]=4 654 B10R0.60 CC(C)(C)CSCC(O)CO 62a_100011219605_100011219619 [0,1,0,0,0,0|3,0,0]=4 655 B10R0.60 CC(C)(C)CSCC(O)CO 62a_100011219619_100011219605 [0,1,0,0,0,0|3,0,0]=4 656 B10R0.60 CC(C)(C)CSC[C@@H](O)CF 62a_100011219605_100015614560 [0,1,0,0,0,0|3,0,0]=4 657 B10R0.60 CC(C)(C)CSC[C@@H](O)CF 62a_100015614560_100011219605 [0,1,0,0,0,0|3,0,0]=4 658 B10R0.60 CC(C)(C)CSC[C@@H](O)CO 62a_100009815848_100011219605 [0,1,0,0,0,0|3,0,0]=4 659 B10R0.60 CC(C)(C)CSC[C@@H](O)CO 62a_100011219605_100009815848 [0,1,0,0,0,0|3,0,0]=4 660 B10R0.60 CC(C)(F)CNCC(O)CO 2230a_100020643315_100011219619 [0,1,0,0,0,0|3,0,0]=4 661 B10R0.60 CC(C)(F)CNC[C@@H](F)CO 34a_100015665980_100011997219 [0,1,0,0,0,0|3,0,0]=4 662 B10R0.60 CC(C)(F)CNC[C@@H](O)CF 2230a_100020643315_100015614560 [0,1,0,0,0,0|3,0,0]=4 663 B10R0.60 CC(C)(F)CNC[C@@H](O)CO 2230a_100020643315_100009815848 [0,1,0,0,0,0|3,0,0]=4 664 B10R0.60 CC(C)(F)COCC(Cl)CCl 34a_100000033668_100011997219 [0,1,0,0,0,0|3,0,0]=4 665 B10R0.60 CC(C)(F)COCC(O)CO 34a_100000716592_100011219619 [0,1,0,0,0,0|3,0,0]=4 666 B10R0.60 CC(C)(F)COC[C@@H](O)CF 34a_100000716592_100015614560 [0,1,0,0,0,0|3,0,0]=4 667 B10R0.60 CC(C)(F)COC[C@@H](O)CO 34a_100000716592_100009815848 [0,1,0,0,0,0|3,0,0]=4 668 B10R0.60 CC(C)(F)COC[C@H](F)CN 34a_100015665980_100011997219 [0,1,0,0,0,0|3,0,0]=4 669 B10R0.60 CC(C)(F)CSCC(O)CO 62a_100011219619_100011997219 [0,1,0,0,0,0|3,0,0]=4 670 B10R0.60 CC(C)(F)CSCC(O)CO 62a_100011997219_100011219619 [0,1,0,0,0,0|3,0,0]=4 671 B10R0.60 CC(C)(F)CSC[C@@H](O)CF 62a_100011997219_100015614560 [0,1,0,0,0,0|3,0,0]=4 672 B10R0.60 CC(C)(F)CSC[C@@H](O)CF 62a_100015614560_100011997219 [0,1,0,0,0,0|3,0,0]=4 673 B10R0.60 CC(C)(F)CSC[C@@H](O)CO 62a_100009815848_100011997219 [0,1,0,0,0,0|3,0,0]=4 674 B10R0.60 CC(C)(F)CSC[C@@H](O)CO 62a_100011997219_100009815848 [0,1,0,0,0,0|3,0,0]=4 675 B10R0.60 CC(C)(O)CCNC(=O)CO 527a_100000707701_100000210174 [0,1,0,0,0,0|2,0,1]=4 676 B10R0.60 CC(C)(O)CCSC(F)C#N 62a_100000702414_200000117898 [0,1,0,0,0,0|2,0,1]=4 677 B10R0.60 CC(C)(O)CCSC(F)C#N 62a_200000117898_100000702414 [0,1,0,0,0,0|2,0,1]=4 678 B10R0.60 CC(C)(O)CNCC(O)CO 2230a_100000751335_100011219619 [0,1,0,0,0,0|2,0,0]=3 679 B10R0.60 CC(C)(O)CNC[C@@H](F)CO 34a_100015665980_100000764493 [0,1,0,0,0,0|2,0,0]=3 680 B10R0.60 CC(C)(O)CNC[C@@H](O)CF 2230a_100000751335_100015614560 [0,1,0,0,0,0|2,0,0]=3 681 B10R0.60 CC(C)(O)CNC[C@@H](O)CO 2230a_100000751335_100009815848 [0,1,0,0,0,0|2,0,0]=3 682 B10R0.60 CC(C)(O)COCC(Cl)CCl 34a_100000033668_100000764493 [0,1,0,0,0,0|2,0,0]=3 683 B10R0.60 CC(C)(O)COC[C@H](F)CN 34a_100015665980_100000764493 [0,1,0,0,0,0|2,0,0]=3 684 B10R0.60 CC(C)(O)CSCC(O)CO 62a_100000764493_100011219619 [0,1,0,0,0,0|2,0,0]=3 685 B10R0.60 CC(C)(O)CSCC(O)CO 62a_100011219619_100000764493 [0,1,0,0,0,0|2,0,0]=3 686 B10R0.60 CC(C)(O)CSC[C@@H](O)CF 62a_100000764493_100015614560 [0,1,0,0,0,0|2,0,0]=3 687 B10R0.60 CC(C)(O)CSC[C@@H](O)CF 62a_100015614560_100000764493 [0,1,0,0,0,0|2,0,0]=3 688 B10R0.60 CC(C)(O)CSC[C@@H](O)CO 62a_100000764493_100009815848 [0,1,0,0,0,0|2,0,0]=3 689 B10R0.60 CC(C)(O)CSC[C@@H](O)CO 62a_100009815848_100000764493 [0,1,0,0,0,0|2,0,0]=3 690 B10R0.60 CC(CF)OCCC(C)(C)C 34a_100016041109_100000755188 [0,1,0,0,0,0|3,0,0]=4 691 B10R0.60 CC(CF)OCCC(C)(C)C 7a_100016041109_100000755188 [0,1,0,0,0,0|3,0,0]=4 692 B10R0.60 CC(CF)OCCC(C)(C)O 34a_100016041109_100000702414 [0,1,0,0,0,0|2,0,0]=3 693 B10R0.60 CC(CF)OCCC(C)(C)O 7a_100016041109_100000702414 [0,1,0,0,0,0|2,0,0]=3 694 B10R0.60 CC(CN)COCC(C)(C)C 34a_100000744482_100011219605 [0,1,0,0,0,0|2,0,0]=3 695 B10R0.60 CC(CN)COCC(C)(C)F 34a_100000744482_100011997219 [0,1,0,0,0,0|2,0,0]=3 696 B10R0.60 CC(CN)COCC(C)(C)O 34a_100000744482_100000764493 [0,1,0,0,0,0|1,0,0]=2 697 B10R0.60 CC(CN)OCCC(C)(C)C 34a_100000210904_100000755188 [0,1,0,0,0,0|2,0,0]=3 698 B10R0.60 CC(CN)OCCC(C)(C)O 34a_100000210904_100000702414 [0,1,0,0,0,0|1,0,0]=2 699 B10R0.60 CC(CN)OCC[N+](C)(C)C 34a_100000210904_100000085578 [0,1,0,0,0,0|3,0,0]=4 700 B10R0.60 CC(CN)OCC[Si](C)(C)C 34a_100000210904_200000733723 [0,1,0,0,0,0|2,1,0]=4 701 B10R0.60 CC(CO)CCNC(C)(C)C 34a_106354213184_100000210625 [0,1,0,0,0,0|3,0,0]=4 702 B10R0.60 CC(CO)CNCC(C)(C)C 34a_100000744482_100011219605 [0,1,0,0,0,0|3,0,0]=4 703 B10R0.60 CC(CO)CNCC(C)(C)F 34a_100000744482_100011997219 [0,1,0,0,0,0|3,0,0]=4 704 B10R0.60 CC(CO)CNCC(C)(C)O 34a_100000744482_100000764493 [0,1,0,0,0,0|2,0,0]=3 705 B10R0.60 CC(CO)NCCC(C)(C)C 2230a_100000738805_100012180447 [0,1,0,0,0,0|3,0,0]=4 706 B10R0.60 CC(CO)NCCC(C)(C)F 2230a_100016253952_100012180447 [0,1,0,0,0,0|3,0,0]=4 707 B10R0.60 CC(CO)OCCC(C)(C)C 7a_100000765024_100012180447 [0,1,0,0,0,0|3,0,0]=4 708 B10R0.60 CC(CO)SCCC(C)(C)C 62a_100012180447_100000755188 [0,1,0,0,0,0|3,0,0]=4 709 B10R0.60 CC(CO)SCCC(C)(C)O 62a_100012180447_100000702414 [0,1,0,0,0,0|2,0,0]=3 710 B10R0.60 CCC(=O)COCC(C)(C)O 34a_100000725409_100000764493 [0,1,0,0,0,0|2,0,1]=4 711 B10R0.60 CCC(=O)CSCC(C)(C)O 62a_100000747405_100000764493 [0,1,0,0,0,0|2,0,1]=4 712 B10R0.60 CCC(=O)CSCC(C)(C)O 62a_100000764493_100000747405 [0,1,0,0,0,0|2,0,1]=4 713 B10R0.60 CCC(=O)NCCC(C)(C)O 1626a_100000707701_100000210414 [0,1,0,0,0,0|2,0,1]=4 714 B10R0.60 CCC(=O)NCCC(C)(C)O 527a_100000707701_100000210414 [0,1,0,0,0,0|2,0,1]=4 715 B10R0.60 CCC(C)CNCC(C)(C)C 2230a_100000743828_100000748023 [0,1,0,0,0,0|3,0,0]=4 716 B10R0.60 CCC(C)CNCC(C)(C)C 270004a_100000743828_100000243153 [0,1,0,0,0,0|3,0,0]=4 717 B10R0.60 CCC(C)CNCC(C)(C)C 270004a_100020588543_100011204126 [0,1,0,0,0,0|3,0,0]=4 718 B10R0.60 CCC(C)CNCC(C)(C)F 2230a_100020643315_100000748023 [0,1,0,0,0,0|3,0,0]=4 719 B10R0.60 CCC(C)CNCC(C)(C)F 270004a_100020643315_100000243153 [0,1,0,0,0,0|3,0,0]=4 720 B10R0.60 CCC(C)CNCC(C)(C)O 2230a_100000751335_100000748023 [0,1,0,0,0,0|2,0,0]=3 721 B10R0.60 CCC(C)CNCC(C)(C)O 270004a_100000751335_100000243153 [0,1,0,0,0,0|2,0,0]=3 722 B10R0.60 CCC(C)COCC(C)(C)F 34a_100000716592_100000748023 [0,1,0,0,0,0|3,0,0]=4 723 B10R0.60 CCC(C)CSCC(C)(C)C 62a_100000748023_100011219605 [0,1,0,0,0,0|3,0,0]=4 724 B10R0.60 CCC(C)CSCC(C)(C)C 62a_100011219605_100000748023 [0,1,0,0,0,0|3,0,0]=4 725 B10R0.60 CCC(C)CSCC(C)(C)F 62a_100000748023_100011997219 [0,1,0,0,0,0|3,0,0]=4 726 B10R0.60 CCC(C)CSCC(C)(C)F 62a_100011997219_100000748023 [0,1,0,0,0,0|3,0,0]=4 727 B10R0.60 CCC(C)CSCC(C)(C)O 62a_100000748023_100000764493 [0,1,0,0,0,0|2,0,0]=3 728 B10R0.60 CCC(C)CSCC(C)(C)O 62a_100000764493_100000748023 [0,1,0,0,0,0|2,0,0]=3 729 B10R0.60 CCC(C)NCCC(C)(C)C 2230a_100000209981_100000755188 [0,1,0,0,0,0|3,0,0]=4 730 B10R0.60 CCC(C)NCCC(C)(C)C 2230a_100000738805_100000758301 [0,1,0,0,0,0|3,0,0]=4 731 B10R0.60 CCC(C)NCCC(C)(C)F 2230a_100016253952_100000758301 [0,1,0,0,0,0|3,0,0]=4 732 B10R0.60 CCC(C)NCCC(C)(C)O 2230a_100000209981_100000702414 [0,1,0,0,0,0|2,0,0]=3 733 B10R0.60 CCC(C)OCCC(C)(C)C 7a_100000210228_100000755188 [0,1,0,0,0,0|3,0,0]=4 734 B10R0.60 CCC(C)OCCC(C)(C)C 7a_100000765024_100000758301 [0,1,0,0,0,0|3,0,0]=4 735 B10R0.60 CCC(C)OCCC(C)(C)O 7a_100000210228_100000702414 [0,1,0,0,0,0|2,0,0]=3 736 B10R0.60 CCC(C)SCCC(C)(C)C 62a_100000755188_100000758301 [0,1,0,0,0,0|3,0,0]=4 737 B10R0.60 CCC(C)SCCC(C)(C)C 62a_100000758301_100000755188 [0,1,0,0,0,0|3,0,0]=4 738 B10R0.60 CCC(C)SCCC(C)(C)O 62a_100000702414_100000758301 [0,1,0,0,0,0|2,0,0]=3 739 B10R0.60 CCC(C)SCCC(C)(C)O 62a_100000758301_100000702414 [0,1,0,0,0,0|2,0,0]=3 740 B10R0.60 CCC(O)CNCC(C)(C)C 2230a_100000743828_100011218378 [0,1,0,0,0,0|3,0,0]=4 741 B10R0.60 CCC(O)CNCC(C)(C)C 270004a_100011218483_100011204126 [0,1,0,0,0,0|3,0,0]=4 742 B10R0.60 CCC(O)CNCC(C)(C)F 2230a_100020643315_100011218378 [0,1,0,0,0,0|3,0,0]=4 743 B10R0.60 CCC(O)CNCC(C)(C)O 2230a_100000751335_100011218378 [0,1,0,0,0,0|2,0,0]=3 744 B10R0.60 CCC(O)COCC(C)(C)F 34a_100000716592_100011218378 [0,1,0,0,0,0|3,0,0]=4 745 B10R0.60 CCC(O)CSCC(C)(C)C 62a_100011218378_100011219605 [0,1,0,0,0,0|3,0,0]=4 746 B10R0.60 CCC(O)CSCC(C)(C)C 62a_100011219605_100011218378 [0,1,0,0,0,0|3,0,0]=4 747 B10R0.60 CCC(O)CSCC(C)(C)F 62a_100011218378_100011997219 [0,1,0,0,0,0|3,0,0]=4 748 B10R0.60 CCC(O)CSCC(C)(C)F 62a_100011997219_100011218378 [0,1,0,0,0,0|3,0,0]=4 749 B10R0.60 CCC(O)CSCC(C)(C)O 62a_100000764493_100011218378 [0,1,0,0,0,0|2,0,0]=3 750 B10R0.60 CCC(O)CSCC(C)(C)O 62a_100011218378_100000764493 [0,1,0,0,0,0|2,0,0]=3 751 B10R0.60 CCN(C)CCCC(C)(C)O 2230a_100000225621_100009888830 [0,1,0,0,0,0|2,0,0]=3 752 B10R0.60 CCN(C)CCCC(C)(C)O 269982a_100000225621_100009888830 [0,1,0,0,0,0|2,0,0]=3 753 B10R0.60 CC[C@H](C)CNCC(C)(C)C 2230a_100000743828_100009816398 [0,1,0,0,0,0|3,0,0]=4 754 B10R0.60 CC[C@H](C)CNCC(C)(C)F 2230a_100020643315_100009816398 [0,1,0,0,0,0|3,0,0]=4 755 B10R0.60 CC[C@H](C)CNCC(C)(C)O 2230a_100000751335_100009816398 [0,1,0,0,0,0|2,0,0]=3 756 B10R0.60 CC[C@H](C)COCC(C)(C)F 34a_100000716592_100009816398 [0,1,0,0,0,0|3,0,0]=4 757 B10R0.60 CC[C@H](C)COCC(C)(C)O 7a_100009816381_100000764493 [0,1,0,0,0,0|2,0,0]=3 758 B10R0.60 CC[C@H](C)CSCC(C)(C)C 62a_100009816398_100011219605 [0,1,0,0,0,0|3,0,0]=4 759 B10R0.60 CC[C@H](C)CSCC(C)(C)C 62a_100011219605_100009816398 [0,1,0,0,0,0|3,0,0]=4 760 B10R0.60 CC[C@H](C)CSCC(C)(C)F 62a_100009816398_100011997219 [0,1,0,0,0,0|3,0,0]=4 761 B10R0.60 CC[C@H](C)CSCC(C)(C)F 62a_100011997219_100009816398 [0,1,0,0,0,0|3,0,0]=4 762 B10R0.60 CC[C@H](C)CSCC(C)(C)O 62a_100000764493_100009816398 [0,1,0,0,0,0|2,0,0]=3 763 B10R0.60 CC[C@H](C)CSCC(C)(C)O 62a_100009816398_100000764493 [0,1,0,0,0,0|2,0,0]=3 764 B10R0.60 CNC(=O)CNCC(C)(C)O 2230a_100000751335_100000183359 [0,1,0,0,0,0|2,0,1]=4 765 B10R0.60 CNC(=O)COCC(C)(C)O 34a_100000750040_100000764493 [0,1,0,0,0,0|2,0,1]=4 766 B10R0.60 CNC(=O)CSCC(C)(C)O 62a_100000183359_100000764493 [0,1,0,0,0,0|2,0,1]=4 767 B10R0.60 CNC(=O)CSCC(C)(C)O 62a_100000764493_100000183359 [0,1,0,0,0,0|2,0,1]=4 768 B10R0.60 CNC(=O)NCCC(C)(C)O 2708a_100000707701_106832991635 [0,1,0,0,0,0|2,0,1]=4 769 B10R0.60 CNC(=O)NCCC(C)(C)O 2708a_100102657272_100000707701 [0,1,0,0,0,0|2,0,1]=4 770 B10R0.60 CNC(=O)NCCC(C)(C)O 273464a_100000707701_100102657272 [0,1,0,0,0,0|2,0,1]=4 771 B10R0.60 CNC(=O)NCCC(C)(C)O 273464a_100102657272_100000707701 [0,1,0,0,0,0|2,0,1]=4 772 B10R0.60 CNC(=O)NCCC(C)(C)O 512a_100000707701_100102657272 [0,1,0,0,0,0|2,0,1]=4 773 B10R0.60 CNC(=O)NCCC(C)(C)O 512a_106832991638_100000707701 [0,1,0,0,0,0|2,0,1]=4 774 B10R0.60 COC(=O)CNCC(C)(C)O 2230a_100000751335_100000747449 [0,1,0,0,0,0|2,0,1]=4 775 B10R0.60 COC(=O)CSCC(C)(C)O 62a_100000747449_100000764493 [0,1,0,0,0,0|2,0,1]=4 776 B10R0.60 COC(=O)CSCC(C)(C)O 62a_100000764493_100000747449 [0,1,0,0,0,0|2,0,1]=4 777 B10R0.60 COC(C)COCC(C)(C)C 34a_100000690652_100011219605 [0,1,0,0,0,0|3,0,0]=4 778 B10R0.60 COC(C)COCC(C)(C)F 34a_100000690652_100011997219 [0,1,0,0,0,0|3,0,0]=4 779 B10R0.60 COC(C)COCC(C)(C)O 34a_100000690652_100000764493 [0,1,0,0,0,0|2,0,0]=3 780 B10R0.60 COC(C)SCCC(C)(C)C 62a_100000755188_100009879195 [0,1,0,0,0,0|3,0,0]=4 781 B10R0.60 COC(C)SCCC(C)(C)C 62a_100009879195_100000755188 [0,1,0,0,0,0|3,0,0]=4 782 B10R0.60 COC(C)SCCC(C)(C)O 62a_100000702414_100009879195 [0,1,0,0,0,0|2,0,0]=3 783 B10R0.60 COC(C)SCCC(C)(C)O 62a_100009879195_100000702414 [0,1,0,0,0,0|2,0,0]=3 784 B10R0.60 CO[C@H](C)CNCC(C)(C)C 270004a_100020591295_100011204126 [0,1,0,0,0,0|3,0,0]=4 785 B10R0.60 C[C@@H](CO)CNCC(C)(C)C 2230a_100000743828_100000059175 [0,1,0,0,0,0|3,0,0]=4 786 B10R0.60 C[C@@H](CO)CNCC(C)(C)F 2230a_100020643315_100000059175 [0,1,0,0,0,0|3,0,0]=4 787 B10R0.60 C[C@@H](CO)CNCC(C)(C)O 2230a_100000751335_100000059175 [0,1,0,0,0,0|2,0,0]=3 788 B10R0.60 C[C@@H](CO)COCC(C)(C)F 34a_100000716592_100000059175 [0,1,0,0,0,0|3,0,0]=4 789 B10R0.60 C[C@@H](CO)CSCC(C)(C)C 62a_100000059175_100011219605 [0,1,0,0,0,0|3,0,0]=4 790 B10R0.60 C[C@@H](CO)CSCC(C)(C)C 62a_100011219605_100000059175 [0,1,0,0,0,0|3,0,0]=4 791 B10R0.60 C[C@@H](CO)CSCC(C)(C)F 62a_100000059175_100011997219 [0,1,0,0,0,0|3,0,0]=4 792 B10R0.60 C[C@@H](CO)CSCC(C)(C)F 62a_100011997219_100000059175 [0,1,0,0,0,0|3,0,0]=4 793 B10R0.60 C[C@@H](CO)CSCC(C)(C)O 62a_100000059175_100000764493 [0,1,0,0,0,0|2,0,0]=3 794 B10R0.60 C[C@@H](CO)CSCC(C)(C)O 62a_100000764493_100000059175 [0,1,0,0,0,0|2,0,0]=3 795 B10R0.60 C[C@H](CO)NCCC(C)(C)C 2230a_100000737577_100000755188 [0,1,0,0,0,0|3,0,0]=4 796 B10R0.60 C[C@H](CO)NCCC(C)(C)O 2230a_100000737577_100000702414 [0,1,0,0,0,0|2,0,0]=3 797 B10R0.60 C[C@H](CO)SCCC(C)(C)C 62a_100000755188_100016084084 [0,1,0,0,0,0|3,0,0]=4 798 B10R0.60 C[C@H](CO)SCCC(C)(C)C 62a_100016084084_100000755188 [0,1,0,0,0,0|3,0,0]=4 799 B10R0.60 C[C@H](CO)SCCC(C)(C)O 62a_100000702414_100016084084 [0,1,0,0,0,0|2,0,0]=3 800 B10R0.60 C[C@H](CO)SCCC(C)(C)O 62a_100016084084_100000702414 [0,1,0,0,0,0|2,0,0]=3 801 B10R0.65 C#CC(C)(C)NCCC(C)C 34a_100000054563_100000210312 [0,1,0,0,0,0|3,0,0]=4 802 B10R0.65 C#CC(C)(C)NCCC(C)O 34a_100000054563_100012276601 [0,1,0,0,0,0|3,0,0]=4 803 B10R0.65 C#CC(C)(C)OCCC(C)Br 34a_100009893172_100000038118 [0,1,0,0,0,0|3,0,0]=4 804 B10R0.65 C#CC(C)(C)OCCC(C)C 34a_100000189450_100000210312 [0,1,0,0,0,0|3,0,0]=4 805 B10R0.65 C#CC(C)(C)OCCC(C)C 34a_100000210254_100000038118 [0,1,0,0,0,0|3,0,0]=4 806 B10R0.65 C#CC(C)(C)OCCC(C)C 7a_100000189450_100000210626 [0,1,0,0,0,0|3,0,0]=4 807 B10R0.65 C#CC(C)(C)OCCC(C)O 34a_100000189450_100012276601 [0,1,0,0,0,0|3,0,0]=4 808 B10R0.65 C#CC(C)(C)OCCC(C)O 7a_100000189450_100012276601 [0,1,0,0,0,0|3,0,0]=4 809 B10R0.65 C#CC(C)(C)OCC[C@@H](C)N 34a_100000706166_100000038118 [0,1,0,0,0,0|2,0,0]=3 810 B10R0.65 C#CC(C)(C)SCCC(C)C 62a_100000038118_100000210312 [0,1,0,0,0,0|3,0,0]=4 811 B10R0.65 C#CC(C)(C)SCCC(C)C 62a_100000210312_100000038118 [0,1,0,0,0,0|3,0,0]=4 812 B10R0.65 C#CC(C)(C)SCCC(C)O 62a_100000038118_100012276601 [0,1,0,0,0,0|3,0,0]=4 813 B10R0.65 C#CC(C)(C)SCCC(C)O 62a_100012276601_100000038118 [0,1,0,0,0,0|3,0,0]=4 814 B10R0.65 C=C(C)CCNC(C)(C)CO 2230a_100000210608_100000730704 [0,1,0,0,0,0|2,0,1]=4 815 B10R0.65 C=C(C)CNCC(C)(C)CO 2230a_100020635058_100000748629 [0,1,0,0,0,0|2,0,1]=4 816 B10R0.65 C=C(C)CNCC(C)(C)OC 2230a_100000763424_100000748629 [0,1,0,0,0,0|2,0,1]=4 817 B10R0.65 C=C(C)COCC(C)(C)CO 34a_100000210245_100009813988 [0,1,0,0,0,0|2,0,1]=4 818 B10R0.65 C=C(C)COCC(C)(C)OC 34a_100000210245_100000701081 [0,1,0,0,0,0|2,0,1]=4 819 B10R0.65 C=C(C)CSCC(C)(C)CO 62a_100000748629_100009813988 [0,1,0,0,0,0|2,0,1]=4 820 B10R0.65 C=C(C)CSCC(C)(C)CO 62a_100009813988_100000211660 [0,1,0,0,0,0|2,0,1]=4 821 B10R0.65 C=C(C)CSCC(C)(C)OC 62a_100000701081_100000211660 [0,1,0,0,0,0|2,0,1]=4 822 B10R0.65 C=C(C)CSCC(C)(C)OC 62a_100000748629_100000701081 [0,1,0,0,0,0|2,0,1]=4 823 B10R0.65 C=CC(C)(C)OCCC(C)C 34a_100011215311_100000210312 [0,1,0,0,0,0|3,0,0]=4 824 B10R0.65 C=CC(C)(C)OCCC(C)C 7a_100011215311_100000210626 [0,1,0,0,0,0|3,0,0]=4 825 B10R0.65 C=CC(C)(C)OCCC(C)O 34a_100011215311_100012276601 [0,1,0,0,0,0|3,0,0]=4 826 B10R0.65 C=CC(C)(C)OCCC(C)O 7a_100011215311_100012276601 [0,1,0,0,0,0|3,0,0]=4 827 B10R0.65 CC(=O)CCCC(C)(C)C#N 1458a_100000070787_100000759902 [0,1,0,0,0,0|2,0,1]=4 828 B10R0.65 CC(=O)COCC(C)(C)CO 34a_100000211253_100009813988 [0,1,0,0,0,0|2,0,1]=4 829 B10R0.65 CC(Br)CCOC(C)(C)C#N 34a_100009893172_100011162410 [0,1,0,0,0,0|3,0,0]=4 830 B10R0.65 CC(Br)COCC(C)(C)CO 34a_100012180447_100009813988 [0,1,0,0,0,0|2,0,0]=3 831 B10R0.65 CC(C)(CO)CNCC(=O)N 2230a_100020635058_100000747473 [0,1,0,0,0,0|2,0,1]=4 832 B10R0.65 CC(C)(CO)CNCC(F)F 2230a_100020635058_100011934356 [0,1,0,0,0,0|3,0,0]=4 833 B10R0.65 CC(C)(CO)CNCC(F)F 34a_100000765723_100009813988 [0,1,0,0,0,0|3,0,0]=4 834 B10R0.65 CC(C)(CO)COCC(F)F 34a_100000743014_100009813988 [0,1,0,0,0,0|3,0,0]=4 835 B10R0.65 CC(C)(CO)CSCC(=O)N 62a_100000747473_100009813988 [0,1,0,0,0,0|2,0,1]=4 836 B10R0.65 CC(C)(CO)CSCC(=O)N 62a_100009813988_100000747473 [0,1,0,0,0,0|2,0,1]=4 837 B10R0.65 CC(C)(CO)CSCC(F)F 62a_100009813988_100011934356 [0,1,0,0,0,0|3,0,0]=4 838 B10R0.65 CC(C)(CO)CSCC(F)F 62a_100011934356_100009813988 [0,1,0,0,0,0|3,0,0]=4 839 B10R0.65 CC(C)(CO)NCCC(=O)N 2230a_100000210608_100000744528 [0,1,0,0,0,0|2,0,1]=4 840 B10R0.65 CC(C)CCCC(C)(C)O[13CH3] 7a_100011215742_200025704644 [0,1,0,0,0,0|1,0,0]=2 841 B10R0.65 CC(C)CCNC(C)(C)CO 2230a_100000210608_100000210312 [0,1,0,0,0,0|2,0,0]=3 842 B10R0.65 CC(C)CCOC(C)(C)C#N 34a_100000210254_100011162410 [0,1,0,0,0,0|3,0,0]=4 843 B10R0.65 CC(C)CCOC(C)(C)C#N 34a_200015195151_100000210312 [0,1,0,0,0,0|3,0,0]=4 844 B10R0.65 CC(C)CCOC(C)(C)C#N 7a_100000210254_100011162410 [0,1,0,0,0,0|3,0,0]=4 845 B10R0.65 CC(C)CCOC(C)(C)CCl 7a_100000764493_100000210626 [0,1,0,0,0,0|3,0,0]=4 846 B10R0.65 CC(C)CCSC(C)(C)C#N 62a_100000210312_100011162410 [0,1,0,0,0,0|3,0,0]=4 847 B10R0.65 CC(C)CCSC(C)(C)C#N 62a_100011162410_100000210312 [0,1,0,0,0,0|3,0,0]=4 848 B10R0.65 CC(C)CNCC(C)(C)CO 2230a_100020635058_100000210760 [0,1,0,0,0,0|2,0,0]=3 849 B10R0.65 CC(C)CNCC(C)(C)CO 270004a_100020635058_100000210432 [0,1,0,0,0,0|2,0,0]=3 850 B10R0.65 CC(C)CNCC(C)(C)CO 34a_100000210953_100009813988 [0,1,0,0,0,0|2,0,0]=3 851 B10R0.65 CC(C)COCC(C)(C)CCl 7a_100011217199_100000210760 [0,1,0,0,0,0|3,0,0]=4 852 B10R0.65 CC(C)COCC(C)(C)CO 34a_100000210257_100009813988 [0,1,0,0,0,0|2,0,0]=3 853 B10R0.65 CC(C)CSCC(C)(C)CO 62a_100000210624_100009813988 [0,1,0,0,0,0|2,0,0]=3 854 B10R0.65 CC(C)CSCC(C)(C)CO 62a_100009813988_100000210760 [0,1,0,0,0,0|2,0,0]=3 855 B10R0.65 CC(C)OCNC(C)(C)CO 2230a_100000210608_100000709892 [0,1,0,0,0,0|3,0,0]=4 856 B10R0.65 CC(F)COCC(C)(C)CO 34a_100015925927_100009813988 [0,1,0,0,0,0|2,0,0]=3 857 B10R0.65 CC(O)CCNC(C)(C)CO 2230a_100000210608_100012276601 [0,1,0,0,0,0|2,0,0]=3 858 B10R0.65 CC(O)CCOC(C)(C)C#N 34a_200015195151_100012276601 [0,1,0,0,0,0|3,0,0]=4 859 B10R0.65 CC(O)CCOC(C)(C)CCl 7a_100000764493_100012276601 [0,1,0,0,0,0|3,0,0]=4 860 B10R0.65 CC(O)CCSC(C)(C)C#N 62a_100011162410_100012276601 [0,1,0,0,0,0|3,0,0]=4 861 B10R0.65 CC(O)CCSC(C)(C)C#N 62a_100012276601_100011162410 [0,1,0,0,0,0|3,0,0]=4 862 B10R0.65 CC(O)CNCC(C)(C)CO 2230a_100020635058_100011218427 [0,1,0,0,0,0|2,0,0]=3 863 B10R0.65 CC(O)CNCC(C)(C)CO 34a_100000210904_100009813988 [0,1,0,0,0,0|2,0,0]=3 864 B10R0.65 CC(O)COCC(C)(C)CCl 7a_100011217199_100011218427 [0,1,0,0,0,0|3,0,0]=4 865 B10R0.65 CC(O)CSCC(C)(C)CO 62a_100009813988_100011218427 [0,1,0,0,0,0|2,0,0]=3 866 B10R0.65 CC(O)CSCC(C)(C)CO 62a_100011218427_100009813988 [0,1,0,0,0,0|2,0,0]=3 867 B10R0.65 CCC(C)(C)COCC(C)C 7a_100000765029_100000210760 [0,1,0,0,0,0|3,0,0]=4 868 B10R0.65 CCC(C)(C)COCC(C)O 7a_100000765029_100011218427 [0,1,0,0,0,0|3,0,0]=4 869 B10R0.65 CCC(C)(C)COC[C@@H](C)O 7a_100000765029_100009817552 [0,1,0,0,0,0|3,0,0]=4 870 B10R0.65 CCC(C)(C)NCCC(C)C 2230a_100000211385_100000210312 [0,1,0,0,0,0|3,0,0]=4 871 B10R0.65 CCC(C)(C)NCCC(C)O 2230a_100000211385_100012276601 [0,1,0,0,0,0|3,0,0]=4 872 B10R0.65 CCC(C)(C)OCCC(C)C 7a_100000210230_100000210626 [0,1,0,0,0,0|3,0,0]=4 873 B10R0.65 CCC(C)(C)OCCC(C)C 7a_100000210254_100000210677 [0,1,0,0,0,0|3,0,0]=4 874 B10R0.65 CCC(C)(C)OCCC(C)O 7a_100000210230_100012276601 [0,1,0,0,0,0|3,0,0]=4 875 B10R0.65 CCC(C)(C)SCCC(C)C 62a_100000032637_100000210312 [0,1,0,0,0,0|3,0,0]=4 876 B10R0.65 CCC(C)(C)SCCC(C)C 62a_100000210312_100000032637 [0,1,0,0,0,0|3,0,0]=4 877 B10R0.65 CCC(C)(C)SCCC(C)O 62a_100000032637_100012276601 [0,1,0,0,0,0|3,0,0]=4 878 B10R0.65 CCC(C)(C)SCCC(C)O 62a_100012276601_100000032637 [0,1,0,0,0,0|3,0,0]=4 879 B10R0.65 CN(C)CCCC(C)(C)C#N 2230a_100102631434_100000759902 [0,1,0,0,0,0|3,0,0]=4 880 B10R0.65 CN(C)CCCC(C)(C)C#N 269982a_100102631434_100000759902 [0,1,0,0,0,0|3,0,0]=4 881 B10R0.65 COC(C)(C)CCCC(C)C 7a_100011215742_200000210301 [0,1,0,0,0,0|1,0,0]=2 882 B10R0.65 COC(C)(C)CCOC(C)C 7a_100000699976_100000210206 [0,1,0,0,0,0|2,0,0]=3 883 B10R0.65 COC(C)(C)CNCC(=O)N 2230a_100000763424_100000747473 [0,1,0,0,0,0|2,0,1]=4 884 B10R0.65 COC(C)(C)CNCC(C)C 2230a_100000763424_100000210760 [0,1,0,0,0,0|2,0,0]=3 885 B10R0.65 COC(C)(C)CNCC(C)C 270004a_100000763424_100000210432 [0,1,0,0,0,0|2,0,0]=3 886 B10R0.65 COC(C)(C)CNCC(C)C 34a_100000210953_100000701081 [0,1,0,0,0,0|2,0,0]=3 887 B10R0.65 COC(C)(C)CNCC(C)O 2230a_100000763424_100011218427 [0,1,0,0,0,0|2,0,0]=3 888 B10R0.65 COC(C)(C)CNCC(C)O 34a_100000210904_100000701081 [0,1,0,0,0,0|2,0,0]=3 889 B10R0.65 COC(C)(C)CNCC(F)F 2230a_100000763424_100011934356 [0,1,0,0,0,0|3,0,0]=4 890 B10R0.65 COC(C)(C)CNCC(F)F 34a_100000765723_100000701081 [0,1,0,0,0,0|3,0,0]=4 891 B10R0.65 COC(C)(C)CNC[C@@H](C)O 2230a_100000763424_100009817552 [0,1,0,0,0,0|2,0,0]=3 892 B10R0.65 COC(C)(C)COCC(=O)C 34a_100000211253_100000701081 [0,1,0,0,0,0|2,0,1]=4 893 B10R0.65 COC(C)(C)COCC(C)Br 34a_100012180447_100000701081 [0,1,0,0,0,0|2,0,0]=3 894 B10R0.65 COC(C)(C)COCC(C)C 34a_100000210257_100000701081 [0,1,0,0,0,0|2,0,0]=3 895 B10R0.65 COC(C)(C)COCC(C)F 34a_100015925927_100000701081 [0,1,0,0,0,0|2,0,0]=3 896 B10R0.65 COC(C)(C)COCC(F)F 34a_100000743014_100000701081 [0,1,0,0,0,0|3,0,0]=4 897 B10R0.65 COC(C)(C)COC[C@@H](C)Cl 34a_100016084084_100000701081 [0,1,0,0,0,0|2,0,0]=3 898 B10R0.65 COC(C)(C)COC[C@@H](C)N 34a_100000737577_100000701081 [0,1,0,0,0,0|1,0,0]=2 899 B10R0.65 COC(C)(C)CSCC(=O)N 62a_100000701081_100000747473 [0,1,0,0,0,0|2,0,1]=4 900 B10R0.65 COC(C)(C)CSCC(=O)N 62a_100000747473_100000701081 [0,1,0,0,0,0|2,0,1]=4 901 B10R0.65 COC(C)(C)CSCC(C)C 62a_100000210624_100000701081 [0,1,0,0,0,0|2,0,0]=3 902 B10R0.65 COC(C)(C)CSCC(C)C 62a_100000701081_100000210760 [0,1,0,0,0,0|2,0,0]=3 903 B10R0.65 COC(C)(C)CSCC(C)O 62a_100000701081_100011218427 [0,1,0,0,0,0|2,0,0]=3 904 B10R0.65 COC(C)(C)CSCC(C)O 62a_100011218427_100000701081 [0,1,0,0,0,0|2,0,0]=3 905 B10R0.65 COC(C)(C)CSCC(F)F 62a_100000701081_100011934356 [0,1,0,0,0,0|3,0,0]=4 906 B10R0.65 COC(C)(C)CSCC(F)F 62a_100011934356_100000701081 [0,1,0,0,0,0|3,0,0]=4 907 B10R0.65 COC(C)(C)CSC[C@@H](C)O 62a_100000701081_100009817552 [0,1,0,0,0,0|2,0,0]=3 908 B10R0.65 COC(C)(C)CSC[C@@H](C)O 62a_100009817552_100000701081 [0,1,0,0,0,0|2,0,0]=3 909 B10R0.65 CSC(C)(C)CNCC(C)C 270004a_100000210953_100009845794 [0,1,0,0,0,0|2,1,0]=4 910 B10R0.65 CSC(C)(C)CNCC(C)O 270004a_100000210904_100009845794 [0,1,0,0,0,0|2,1,0]=4 911 B10R0.65 C[C@@H](Cl)COCC(C)(C)CO 34a_100016084084_100009813988 [0,1,0,0,0,0|2,0,0]=3 912 B10R0.65 C[C@@H](N)CCOC(C)(C)C#N 34a_100000706166_100011162410 [0,1,0,0,0,0|2,0,0]=3 913 B10R0.65 C[C@@H](N)COCC(C)(C)CO 34a_100000737577_100009813988 [0,1,0,0,0,0|1,0,0]=2 914 B10R0.65 C[C@@H](O)CNCC(C)(C)CO 2230a_100020635058_100009817552 [0,1,0,0,0,0|2,0,0]=3 915 B10R0.65 C[C@@H](O)COCC(C)(C)CCl 7a_100011217199_100009817552 [0,1,0,0,0,0|3,0,0]=4 916 B10R0.65 C[C@@H](O)CSCC(C)(C)CO 62a_100009813988_100009817552 [0,1,0,0,0,0|2,0,0]=3 917 B10R0.65 C[C@@H](O)CSCC(C)(C)CO 62a_100009817552_100009813988 [0,1,0,0,0,0|2,0,0]=3 918 B10R0.92 C=C(C)C(C)NCC(C)(C)O 269862a_100000751335_100011216138 [0,1,0,0,0,0|2,0,1]=4 919 B10R0.92 CC(=O)C(C)NCC(C)(C)O 2230a_100000751335_100009814033 [0,1,0,0,0,0|2,0,1]=4 920 B10R0.92 CC(=O)C(C)OCC(C)(C)O 34a_100000212229_100000764493 [0,1,0,0,0,0|2,0,1]=4 921 B10R0.92 CC(=O)C(C)SCC(C)(C)O 62a_100000764493_100009814033 [0,1,0,0,0,0|2,0,1]=4 922 B10R0.92 CC(=O)C(C)SCC(C)(C)O 62a_100009814033_100000764493 [0,1,0,0,0,0|2,0,1]=4 923 B10R0.92 CC(C)(O)CNC(F)C(=O)N 2230a_100000751335_100009813875 [0,1,0,0,0,0|2,0,1]=4 924 B10R0.92 CC(C)(O)CSC(F)C(=O)N 62a_100000764493_100009813875 [0,1,0,0,0,0|2,0,1]=4 925 B10R0.92 CC(C)(O)CSC(F)C(=O)N 62a_100009813875_100000764493 [0,1,0,0,0,0|2,0,1]=4 926 B10R0.92 CC(C)C(=O)CCC(C)(C)C 1458a_100000210198_100000755188 [0,1,0,0,0,0|2,0,1]=4 927 B10R0.92 CC(C)C(=O)CCC(C)(C)C 1458a_100000757465_100000210206 [0,1,0,0,0,0|2,0,1]=4 928 B10R0.92 CC(C)C(=O)NCC(C)(C)O 1626a_100000751335_100000210198 [0,1,0,0,0,0|2,0,1]=4 929 B10R0.92 CC(C)C(=O)NCC(C)(C)O 240690a_100000751335_100000210198 [0,1,0,0,0,0|2,0,1]=4 930 B10R0.92 CC(C)C(=O)NCC(C)(C)O 527a_100000751335_100000210198 [0,1,0,0,0,0|2,0,1]=4 931 B10R0.92 CC(C)C(C)NCC(C)(C)C 270004a_100000211541_100011204126 [0,1,0,0,0,0|3,0,0]=4 932 B10R0.92 CC(C)C(C)OCC(C)(C)O 7a_100000748068_100000764493 [0,1,0,0,0,0|2,0,0]=3 933 B10R0.92 CC(C)C(O)CNC(C)(C)C 34a_100000759067_100000210625 [0,1,0,0,0,0|3,0,0]=4 934 B10R0.92 CC(C)N(C)CCC(C)(C)C 269982a_200000211004_100000755188 [0,1,0,0,0,0|3,0,0]=4 935 B10R0.92 CC(C)[C@@H](N)COC(C)(C)C 34a_100011830312_100000210625 [0,1,0,0,0,0|3,0,0]=4 936 B10R0.92 CC(F)C(=O)CCC(C)(C)C 1458a_100000062450_100000755188 [0,1,0,0,0,0|2,0,1]=4 937 B10R0.92 CC(F)C(=O)NCC(C)(C)O 1626a_100000751335_100000062450 [0,1,0,0,0,0|2,0,1]=4 938 B10R0.92 CC(F)C(=O)NCC(C)(C)O 240690a_100000751335_100000062450 [0,1,0,0,0,0|2,0,1]=4 939 B10R0.92 CC(F)C(=O)NCC(C)(C)O 527a_100000751335_100000062450 [0,1,0,0,0,0|2,0,1]=4 940 B10R0.92 CC(NCC(C)(C)O)C(=O)N 2230a_100000751335_100000702099 [0,1,0,0,0,0|2,0,1]=4 941 B10R0.92 CC(SCC(C)(C)O)C(=O)N 62a_100000702099_100000764493 [0,1,0,0,0,0|2,0,1]=4 942 B10R0.92 CC(SCC(C)(C)O)C(=O)N 62a_100000764493_100000702099 [0,1,0,0,0,0|2,0,1]=4 943 B10R0.92 C[C@@H](NCC(C)(C)O)C(=O)N 34a_100000119354_100000764493 [0,1,0,0,0,0|2,0,1]=4 944 B10R0.92 C[C@@H](O)C(=O)CCC(C)(C)C 1458a_100000717761_100000755188 [0,1,0,0,0,0|2,0,1]=4 945 B10R0.92 C[C@@H](O)C(=O)NCC(C)(C)O 240690a_100000751335_100000717761 [0,1,0,0,0,0|2,0,1]=4 946 B10R0.92 C[C@@H](OCC(C)(C)O)C(=O)N 34a_100000731257_100000764493 [0,1,0,0,0,0|2,0,1]=4 947 B10R0.92 C[C@@H](OCC(C)(C)O)C(=O)N 7a_100000731257_100000764493 [0,1,0,0,0,0|2,0,1]=4 948 B10R0.92 C[C@H](O)C(=O)CCC(C)(C)C 1458a_217856618621_100000755188 [0,1,0,0,0,0|2,0,1]=4 949 B10R0.92 C[C@H](O)C(=O)NCC(C)(C)O 1626a_100000751335_217856618621 [0,1,0,0,0,0|2,0,1]=4 950 B10R0.92 C[C@H](O)C(=O)NCC(C)(C)O 240690a_100000751335_217856618621 [0,1,0,0,0,0|2,0,1]=4 951 B10R0.113 CC(C)(C)CCNC(C)(C)C 2230a_100000715429_100000755188 [0,1,0,0,0,0|3,0,0]=4 952 B10R0.113 CC(C)(C)CCOC(C)(C)C 34a_100015890283_100000755188 [0,1,0,0,0,0|3,0,0]=4 953 B10R0.113 CC(C)(C)CCOC(C)(C)C 7a_100015890283_100000755188 [0,1,0,0,0,0|3,0,0]=4 954 B10R0.113 CC(C)(C)CCSC(C)(C)C 62a_100000211941_100000755188 [0,1,0,0,0,0|3,0,0]=4 955 B10R0.113 CC(C)(C)CCSC(C)(C)C 62a_100000755188_100000211941 [0,1,0,0,0,0|3,0,0]=4 956 B10R0.113 CC(C)(C)CNCC(C)(C)C 270004a_100000743828_100011204126 [0,1,0,0,0,0|3,0,0]=4 957 B10R0.113 CC(C)(C)CNCC(C)(C)F 270004a_100020643315_100011204126 [0,1,0,0,0,0|3,0,0]=4 958 B10R0.113 CC(C)(C)CNCC(C)(C)O 270004a_100000751335_100011204126 [0,1,0,0,0,0|2,0,0]=3 959 B10R0.113 CC(C)(C)CNCC(C)(F)F 270004a_100000731000_100011204126 [0,1,0,0,0,0|3,0,0]=4 960 B10R0.113 CC(C)(C)COCC(C)(C)F 34a_100000716592_100011219605 [0,1,0,0,0,0|3,0,0]=4 961 B10R0.113 CC(C)(C)COCC(C)(F)F 34a_100000068830_100011219605 [0,1,0,0,0,0|3,0,0]=4 962 B10R0.113 CC(C)(C)CSCC(C)(C)C 62a_100011219605_100011219605 [0,1,0,0,0,0|3,0,0]=4 963 B10R0.113 CC(C)(C)CSCC(C)(C)F 62a_100011219605_100011997219 [0,1,0,0,0,0|3,0,0]=4 964 B10R0.113 CC(C)(C)CSCC(C)(C)F 62a_100011997219_100011219605 [0,1,0,0,0,0|3,0,0]=4 965 B10R0.113 CC(C)(C)CSCC(C)(C)O 62a_100000764493_100011219605 [0,1,0,0,0,0|2,0,0]=3 966 B10R0.113 CC(C)(C)CSCC(C)(C)O 62a_100011219605_100000764493 [0,1,0,0,0,0|2,0,0]=3 967 B10R0.113 CC(C)(F)COCC(C)(C)F 34a_100000716592_100011997219 [0,1,0,0,0,0|3,0,0]=4 968 B10R0.113 CC(C)(F)COCC(C)(F)F 34a_100000068830_100011997219 [0,1,0,0,0,0|3,0,0]=4 969 B10R0.113 CC(C)(F)CSCC(C)(C)F 62a_100011997219_100011997219 [0,1,0,0,0,0|3,0,0]=4 970 B10R0.113 CC(C)(O)CCNC(C)(C)C 2230a_100000715429_100000702414 [0,1,0,0,0,0|2,0,0]=3 971 B10R0.113 CC(C)(O)CCNS(=O)(=O)C 40a_100000707701_100000738038 [0,1,0,0,0,0|3,0,0]=4 972 B10R0.113 CC(C)(O)CCOC(C)(C)C 34a_100015890283_100000702414 [0,1,0,0,0,0|2,0,0]=3 973 B10R0.113 CC(C)(O)CCOC(C)(C)C 7a_100015890283_100000702414 [0,1,0,0,0,0|2,0,0]=3 974 B10R0.113 CC(C)(O)CCSC(C)(C)C 62a_100000211941_100000702414 [0,1,0,0,0,0|2,0,0]=3 975 B10R0.113 CC(C)(O)CCSC(C)(C)C 62a_100000702414_100000211941 [0,1,0,0,0,0|2,0,0]=3 976 B10R0.113 CC(C)(O)CCSC(F)(F)F 62a_100000702414_200103152311 [0,1,0,0,0,0|3,0,0]=4 977 B10R0.113 CC(C)(O)CCSC(F)(F)F 62a_200000243211_100000702414 [0,1,0,0,0,0|3,0,0]=4 978 B10R0.113 CC(C)(O)CNCC(F)(F)F 2230a_100000751335_100000763148 [0,1,0,0,0,0|3,0,0]=4 979 B10R0.113 CC(C)(O)CNCC(F)(F)F 34a_100000717047_100000764493 [0,1,0,0,0,0|3,0,0]=4 980 B10R0.113 CC(C)(O)CNC[Si](C)(C)C 2230a_100000751335_100000037933 [0,1,0,0,0,0|2,1,0]=4 981 B10R0.113 CC(C)(O)COCC(C)(C)F 34a_100000716592_100000764493 [0,1,0,0,0,0|2,0,0]=3 982 B10R0.113 CC(C)(O)COCC(C)(F)F 34a_100000068830_100000764493 [0,1,0,0,0,0|2,0,0]=3 983 B10R0.113 CC(C)(O)COCC(F)(F)Br 34a_100011217949_100000764493 [0,1,0,0,0,0|3,0,0]=4 984 B10R0.113 CC(C)(O)COCC(F)(F)Cl 34a_100000734434_100000764493 [0,1,0,0,0,0|3,0,0]=4 985 B10R0.113 CC(C)(O)COCC(F)(F)F 34a_100000210435_100000764493 [0,1,0,0,0,0|3,0,0]=4 986 B10R0.113 CC(C)(O)CSCC(C)(C)F 62a_100000764493_100011997219 [0,1,0,0,0,0|2,0,0]=3 987 B10R0.113 CC(C)(O)CSCC(C)(C)F 62a_100011997219_100000764493 [0,1,0,0,0,0|2,0,0]=3 988 B10R0.113 CC(C)(O)CSCC(C)(C)O 62a_100000764493_100000764493 [0,1,0,0,0,0|2,0,0]=3 989 B10R0.113 CC(C)(O)CSCC(F)(F)F 62a_100000763148_100000764493 [0,1,0,0,0,0|3,0,0]=4 990 B10R0.113 CC(C)(O)CSCC(F)(F)F 62a_100000764493_100000763148 [0,1,0,0,0,0|3,0,0]=4 991 B10R0.113 CC(C)(O)CSCS(=O)(=O)N 62a_100000741382_100000764493 [0,1,0,0,0,0|3,0,0]=4 992 B10R0.113 CC(C)(O)CSCS(=O)(=O)N 62a_100000764493_100000741382 [0,1,0,0,0,0|3,0,0]=4 993 B10R0.113 CC(C)(O)CSC[N+](C)(C)C 62a_100000764493_200000036245 [0,1,0,0,0,0|3,0,0]=4 994 B10R0.113 CC(C)(O)CSC[N+](C)(C)C 62a_200000036245_100000764493 [0,1,0,0,0,0|3,0,0]=4 995 B10R0.113 CC(C)(O)CSC[Si](C)(C)C 62a_100000037933_100000764493 [0,1,0,0,0,0|2,1,0]=4 996 B10R0.113 CC(C)(O)CSC[Si](C)(C)C 62a_100000764493_100000037933 [0,1,0,0,0,0|2,1,0]=4 997 B10R1.55 CC(C)(C)N1CCC(C1)O 269982a_100011215560_100000210625 [0,0,0,1,0,0|3,0,0]=4 998 B10R1.55 CC(C)(C)N1CC[C@@H](C1)F 269982a_100015203821_100000210625 [0,0,0,1,0,0|3,0,0]=4 999 B10R1.55 CC(C)(C)N1CC[C@@H](C1)F 34a_100015203821_100000210625 [0,0,0,1,0,0|3,0,0]=4 1000 B10R1.55 CC(C)(O)[C@@H]1CCN(C1)[13CH3] 2230a_100132313854_200025704644 [0,0,0,1,0,0|2,0,0]=3 1001 B10R1.55 CC(C)(O)[C@@H]1CCN(C1)[13CH3] 269982a_100132313854_200025704644 [0,0,0,1,0,0|2,0,0]=3 1002 B10R1.55 CC(C)(O)[C@@H]1CCN(C1)[13CH3] 34a_100132313854_200025704644 [0,0,0,1,0,0|2,0,0]=3 1003 B10R1.55 CN1CC[C@H](C1)C(C)(C)O 2230a_100132313854_200000210301 [0,0,0,1,0,0|2,0,0]=3 1004 B10R1.55 CN1CC[C@H](C1)C(C)(C)O 269982a_100132313854_200000210301 [0,0,0,1,0,0|2,0,0]=3 1005 B10R1.55 CN1CC[C@H](C1)C(C)(C)O 34a_100132313854_200000210301 [0,0,0,1,0,0|2,0,0]=3 1006 B10R1.55 C[C@@H]1CCN(C1)C(C)(C)C 269982a_100016987628_100000210625 [0,0,0,1,0,0|3,0,0]=4 1007 B10R1.55 C[C@@H]1CCN(C1)C(C)(C)C 34a_100016987628_100000210625 [0,0,0,1,0,0|3,0,0]=4 1008 B10R1.72 CC(C)(C)CN[C@@H]1C[C@H]1F 34a_100025746932_100011219605 [0,0,0,1,0,0|3,0,0]=4 1009 B10R1.72 CC(C)(F)CN[C@@H]1C[C@H]1F 34a_100025746932_100011997219 [0,0,0,1,0,0|3,0,0]=4 1010 B10R1.72 CC(C)(O)CN[C@@H]1C[C@H]1F 34a_100025746932_100000764493 [0,0,0,1,0,0|2,0,0]=3 1011 B10R1.72 CC1CC1COC(C)(C)C 34a_100000744939_100000210625 [0,0,0,1,0,0|3,0,0]=4 1012 B10R1.112 CC(C)(C)CN1CC(C1)F 270004a_100000690557_100011204126 [0,0,0,1,0,0|3,0,0]=4 1013 B10R1.112 CC(C)(C)CN1CC(C1)F 34a_100000690557_100011219605 [0,0,0,1,0,0|3,0,0]=4 1014 B10R1.112 CC(C)(F)CN1CC(C1)F 34a_100000690557_100011997219 [0,0,0,1,0,0|3,0,0]=4 1015 B10R1.112 CC(C)(O)CN1CC(C1)F 34a_100000690557_100000764493 [0,0,0,1,0,0|2,0,0]=3 1016 B10R1.112 CC1CN(C1)CC(C)(C)C 270004a_100000702820_100011204126 [0,0,0,1,0,0|3,0,0]=4 1017 B10R1.112 CC1CN(C1)CC(C)(C)C 34a_100000702820_100011219605 [0,0,0,1,0,0|3,0,0]=4 1018 B10R1.112 CC1CN(C1)CC(C)(C)F 34a_100000702820_100011997219 [0,0,0,1,0,0|3,0,0]=4 1019 B10R1.112 CC1CN(C1)CC(C)(C)O 34a_100000702820_100000764493 [0,0,0,1,0,0|2,0,0]=3 1020 B10R1.210 CC(C)(C)CCNC1CC1 34a_100000212008_100000755188 [0,0,0,1,0,0|3,0,0]=4 1021 B10R1.210 CC(C)(C)CCSC1CC1 62a_100000755188_100000211595 [0,0,0,1,0,0|3,0,0]=4 1022 B10R1.210 CC(C)(C)CNCC1CC1 2230a_100000743828_100000742324 [0,0,0,1,0,0|3,0,0]=4 1023 B10R1.210 CC(C)(C)CNCC1CC1 269862a_100000743828_100000741477 [0,0,0,1,0,0|3,0,0]=4 1024 B10R1.210 CC(C)(C)CNCC1CC1 270004a_100000735609_100011204126 [0,0,0,1,0,0|3,0,0]=4 1025 B10R1.210 CC(C)(C)CNCC1CC1 34a_100000735609_100011219605 [0,0,0,1,0,0|3,0,0]=4 1026 B10R1.210 CC(C)(C)CNCC1CO1 2230a_100000743828_100011216344 [0,0,0,1,0,0|3,0,0]=4 1027 B10R1.210 CC(C)(C)COCC1CC1 34a_100000211283_100011219605 [0,0,0,1,0,0|3,0,0]=4 1028 B10R1.210 CC(C)(C)COC[C@@H]1CO1 34a_100000757423_100011219605 [0,0,0,1,0,0|3,0,0]=4 1029 B10R1.210 CC(C)(C)CSCC1CC1 62a_100000756562_100011219605 [0,0,0,1,0,0|3,0,0]=4 1030 B10R1.210 CC(C)(C)CSCC1CC1 62a_100011219605_100000742324 [0,0,0,1,0,0|3,0,0]=4 1031 B10R1.210 CC(C)(C)CSCC1CO1 62a_100011219605_102125554688 [0,0,0,1,0,0|3,0,0]=4 1032 B10R1.210 CC(C)(C)CSCC1CO1 62a_102125554688_100011219605 [0,0,0,1,0,0|3,0,0]=4 1033 B10R1.210 CC(C)(C)CSCC1CS1 62a_100000031435_100011219605 [0,0,0,1,0,0|3,0,0]=4 1034 B10R1.210 CC(C)(C)CSCC1CS1 62a_100011219605_100000031435 [0,0,0,1,0,0|3,0,0]=4 1035 B10R1.210 CC(C)(C)CSC[C@@H]1CO1 62a_100000745022_100011219605 [0,0,0,1,0,0|3,0,0]=4 1036 B10R1.210 CC(C)(C)CSC[C@@H]1CO1 62a_100011219605_100000745022 [0,0,0,1,0,0|3,0,0]=4 1037 B10R1.210 CC(C)(C)NCCC1CC1 2230a_100000715429_100000694398 [0,0,0,1,0,0|3,0,0]=4 1038 B10R1.210 CC(C)(C)NCCC1CC1 34a_100000764129_100000210625 [0,0,0,1,0,0|3,0,0]=4 1039 B10R1.210 CC(C)(C)NCCC1CO1 2230a_100000715429_100000732470 [0,0,0,1,0,0|3,0,0]=4 1040 B10R1.210 CC(C)(C)OCCC1CC1 34a_100000754188_100000210625 [0,0,0,1,0,0|3,0,0]=4 1041 B10R1.210 CC(C)(C)OCCC1CC1 34a_100015890283_100000694398 [0,0,0,1,0,0|3,0,0]=4 1042 B10R1.210 CC(C)(C)OCCC1CC1 7a_100015890283_100000764125 [0,0,0,1,0,0|3,0,0]=4 1043 B10R1.210 CC(C)(C)OCCC1CO1 34a_100015890283_100000732470 [0,0,0,1,0,0|3,0,0]=4 1044 B10R1.210 CC(C)(C)OCCC1CO1 7a_100015890283_100000732470 [0,0,0,1,0,0|3,0,0]=4 1045 B10R1.210 CC(C)(C)OCC[C@@H]1CO1 34a_100009820653_100000210625 [0,0,0,1,0,0|3,0,0]=4 1046 B10R1.210 CC(C)(C)SCCC1CC1 62a_100000211941_100000764125 [0,0,0,1,0,0|3,0,0]=4 1047 B10R1.210 CC(C)(C)SCCC1CC1 62a_100000764125_100000211941 [0,0,0,1,0,0|3,0,0]=4 1048 B10R1.210 CC(C)(C)SCCC1CO1 62a_100000211941_100000732470 [0,0,0,1,0,0|3,0,0]=4 1049 B10R1.210 CC(C)(C)SCCC1CO1 62a_100000732470_100000211941 [0,0,0,1,0,0|3,0,0]=4 1050 B10R1.210 CC(C)(F)CNCC1CC1 2230a_100020643315_100000742324 [0,0,0,1,0,0|3,0,0]=4 1051 B10R1.210 CC(C)(F)CNCC1CC1 269862a_100020643315_100000741477 [0,0,0,1,0,0|3,0,0]=4 1052 B10R1.210 CC(C)(F)CNCC1CC1 34a_100000735609_100011997219 [0,0,0,1,0,0|3,0,0]=4 1053 B10R1.210 CC(C)(F)CNCC1CO1 2230a_100020643315_100011216344 [0,0,0,1,0,0|3,0,0]=4 1054 B10R1.210 CC(C)(F)COCC1CC1 34a_100000211283_100011997219 [0,0,0,1,0,0|3,0,0]=4 1055 B10R1.210 CC(C)(F)COCC1CC1 34a_100000716592_100000742324 [0,0,0,1,0,0|3,0,0]=4 1056 B10R1.210 CC(C)(F)COCC1CO1 34a_100000716592_102125554688 [0,0,0,1,0,0|3,0,0]=4 1057 B10R1.210 CC(C)(F)COC[C@@H]1CO1 34a_100000757423_100011997219 [0,0,0,1,0,0|3,0,0]=4 1058 B10R1.210 CC(C)(F)CSCC1CC1 62a_100000756562_100011997219 [0,0,0,1,0,0|3,0,0]=4 1059 B10R1.210 CC(C)(F)CSCC1CC1 62a_100011997219_100000742324 [0,0,0,1,0,0|3,0,0]=4 1060 B10R1.210 CC(C)(F)CSCC1CO1 62a_100011997219_102125554688 [0,0,0,1,0,0|3,0,0]=4 1061 B10R1.210 CC(C)(F)CSCC1CO1 62a_102125554688_100011997219 [0,0,0,1,0,0|3,0,0]=4 1062 B10R1.210 CC(C)(F)CSCC1CS1 62a_100000031435_100011997219 [0,0,0,1,0,0|3,0,0]=4 1063 B10R1.210 CC(C)(F)CSCC1CS1 62a_100011997219_100000031435 [0,0,0,1,0,0|3,0,0]=4 1064 B10R1.210 CC(C)(F)CSC[C@@H]1CO1 62a_100000745022_100011997219 [0,0,0,1,0,0|3,0,0]=4 1065 B10R1.210 CC(C)(F)CSC[C@@H]1CO1 62a_100011997219_100000745022 [0,0,0,1,0,0|3,0,0]=4 1066 B10R1.210 CC(C)(O)CCNC1CC1 34a_100000212008_100000702414 [0,0,0,1,0,0|2,0,0]=3 1067 B10R1.210 CC(C)(O)CCSC1CC1 62a_100000702414_100000211595 [0,0,0,1,0,0|2,0,0]=3 1068 B10R1.210 CC(C)(O)CNCC1CC1 2230a_100000751335_100000742324 [0,0,0,1,0,0|2,0,0]=3 1069 B10R1.210 CC(C)(O)CNCC1CC1 269862a_100000751335_100000741477 [0,0,0,1,0,0|2,0,0]=3 1070 B10R1.210 CC(C)(O)CNCC1CC1 34a_100000735609_100000764493 [0,0,0,1,0,0|2,0,0]=3 1071 B10R1.210 CC(C)(O)CNCC1CO1 2230a_100000751335_100011216344 [0,0,0,1,0,0|2,0,0]=3 1072 B10R1.210 CC(C)(O)COCC1CC1 34a_100000211283_100000764493 [0,0,0,1,0,0|2,0,0]=3 1073 B10R1.210 CC(C)(O)COC[C@@H]1CO1 34a_100000757423_100000764493 [0,0,0,1,0,0|2,0,0]=3 1074 B10R1.210 CC(C)(O)CSCC1CC1 62a_100000756562_100000764493 [0,0,0,1,0,0|2,0,0]=3 1075 B10R1.210 CC(C)(O)CSCC1CC1 62a_100000764493_100000742324 [0,0,0,1,0,0|2,0,0]=3 1076 B10R1.210 CC(C)(O)CSCC1CO1 62a_100000764493_102125554688 [0,0,0,1,0,0|2,0,0]=3 1077 B10R1.210 CC(C)(O)CSCC1CO1 62a_102125554688_100000764493 [0,0,0,1,0,0|2,0,0]=3 1078 B10R1.210 CC(C)(O)CSCC1CS1 62a_100000031435_100000764493 [0,0,0,1,0,0|2,0,0]=3 1079 B10R1.210 CC(C)(O)CSCC1CS1 62a_100000764493_100000031435 [0,0,0,1,0,0|2,0,0]=3 1080 B10R1.210 CC(C)(O)CSC[C@@H]1CO1 62a_100000745022_100000764493 [0,0,0,1,0,0|2,0,0]=3 1081 B10R1.210 CC(C)(O)CSC[C@@H]1CO1 62a_100000764493_100000745022 [0,0,0,1,0,0|2,0,0]=3 1082 B10R1.302 CC1(CCCN(CC1)[13CH3])O 2230a_100000723723_200025704644 [0,0,0,1,0,0|2,0,0]=3 1083 B10R1.302 CC1(CCCN(CC1)[13CH3])O 269982a_100000723723_200025704644 [0,0,0,1,0,0|2,0,0]=3 1084 B10R1.302 CC1(CCCN(CC1)[13CH3])O 34a_100000723723_200025704644 [0,0,0,1,0,0|2,0,0]=3 1085 B10R1.302 CN1CCCC(CC1)(C)O 2230a_100000723723_200000210301 [0,0,0,1,0,0|2,0,0]=3 1086 B10R1.302 CN1CCCC(CC1)(C)O 269982a_100000723723_200000210301 [0,0,0,1,0,0|2,0,0]=3 1087 B10R1.302 CN1CCCC(CC1)(C)O 34a_100000723723_200000210301 [0,0,0,1,0,0|2,0,0]=3 1088 B10R1.350 C=C(C)CNCC1(CC1)O 2230a_100011936951_100000748629 [0,0,0,1,0,0|2,0,1]=4 1089 B10R1.350 C=C(C)COCC1(CO1)C 34a_100000210245_100000760498 [0,0,0,1,0,0|2,0,1]=4 1090 B10R1.350 C=C(C)CSCC1(CO1)C 62a_100000748629_100000760498 [0,0,0,1,0,0|2,0,1]=4 1091 B10R1.350 C=C(C)CSCC1(CO1)C 62a_100000760498_100000211660 [0,0,0,1,0,0|2,0,1]=4 1092 B10R1.350 CC(=O)COCC1(CO1)C 34a_100000211253_100000760498 [0,0,0,1,0,0|2,0,1]=4 1093 B10R1.350 CC(Br)COCC1(CO1)C 34a_100012180447_100000760498 [0,0,0,1,0,0|2,0,0]=3 1094 B10R1.350 CC(C)CCNC1(CC1)C 2230a_100000757604_100000210312 [0,0,0,1,0,0|3,0,0]=4 1095 B10R1.350 CC(C)CCOC1(CC1)C 7a_100011725673_100000210626 [0,0,0,1,0,0|3,0,0]=4 1096 B10R1.350 CC(C)CNCC1(CC1)C 2230a_100000766693_100000210760 [0,0,0,1,0,0|3,0,0]=4 1097 B10R1.350 CC(C)CNCC1(CC1)C 270004a_100000766693_100000210432 [0,0,0,1,0,0|3,0,0]=4 1098 B10R1.350 CC(C)CNCC1(CC1)O 2230a_100011936951_100000210760 [0,0,0,1,0,0|2,0,0]=3 1099 B10R1.350 CC(C)CNCC1(CC1)O 270004a_100011936951_100000210432 [0,0,0,1,0,0|2,0,0]=3 1100 B10R1.350 CC(C)CNCC1(CO1)C 34a_100000210953_100000760498 [0,0,0,1,0,0|2,0,0]=3 1101 B10R1.350 CC(C)COCC1(CC1)C 7a_100000698024_100000210760 [0,0,0,1,0,0|3,0,0]=4 1102 B10R1.350 CC(C)COCC1(CC1)F 34a_200000703853_100000210624 [0,0,0,1,0,0|3,0,0]=4 1103 B10R1.350 CC(C)COCC1(CC1)F 7a_200000703853_100000210760 [0,0,0,1,0,0|3,0,0]=4 1104 B10R1.350 CC(C)COCC1(CO1)C 34a_100000210257_100000760498 [0,0,0,1,0,0|2,0,0]=3 1105 B10R1.350 CC(C)CSCC1(CO1)C 62a_100000210624_100000760498 [0,0,0,1,0,0|2,0,0]=3 1106 B10R1.350 CC(C)CSCC1(CO1)C 62a_100000760498_100000210760 [0,0,0,1,0,0|2,0,0]=3 1107 B10R1.350 CC(F)COCC1(CO1)C 34a_100015925927_100000760498 [0,0,0,1,0,0|2,0,0]=3 1108 B10R1.350 CC(O)CCNC1(CC1)C 2230a_100000757604_100012276601 [0,0,0,1,0,0|3,0,0]=4 1109 B10R1.350 CC(O)CCOC1(CC1)C 7a_100011725673_100012276601 [0,0,0,1,0,0|3,0,0]=4 1110 B10R1.350 CC(O)CNCC1(CC1)C 2230a_100000766693_100011218427 [0,0,0,1,0,0|3,0,0]=4 1111 B10R1.350 CC(O)CNCC1(CC1)O 2230a_100011936951_100011218427 [0,0,0,1,0,0|2,0,0]=3 1112 B10R1.350 CC(O)CNCC1(CO1)C 34a_100000210904_100000760498 [0,0,0,1,0,0|2,0,0]=3 1113 B10R1.350 CC(O)COCC1(CC1)C 7a_100000698024_100011218427 [0,0,0,1,0,0|3,0,0]=4 1114 B10R1.350 CC(O)COCC1(CC1)F 34a_200000703853_100011218427 [0,0,0,1,0,0|3,0,0]=4 1115 B10R1.350 CC(O)COCC1(CC1)F 7a_200000703853_100011218427 [0,0,0,1,0,0|3,0,0]=4 1116 B10R1.350 CC(O)CSCC1(CO1)C 62a_100000760498_100011218427 [0,0,0,1,0,0|2,0,0]=3 1117 B10R1.350 CC(O)CSCC1(CO1)C 62a_100011218427_100000760498 [0,0,0,1,0,0|2,0,0]=3 1118 B10R1.350 CC1(CO1)CNCC(F)F 34a_100000765723_100000760498 [0,0,0,1,0,0|3,0,0]=4 1119 B10R1.350 CC1(CO1)COCC(F)F 34a_100000743014_100000760498 [0,0,0,1,0,0|3,0,0]=4 1120 B10R1.350 CC1(CO1)CSCC(=O)N 62a_100000747473_100000760498 [0,0,0,1,0,0|2,0,1]=4 1121 B10R1.350 CC1(CO1)CSCC(=O)N 62a_100000760498_100000747473 [0,0,0,1,0,0|2,0,1]=4 1122 B10R1.350 CC1(CO1)CSCC(F)F 62a_100000760498_100011934356 [0,0,0,1,0,0|3,0,0]=4 1123 B10R1.350 CC1(CO1)CSCC(F)F 62a_100011934356_100000760498 [0,0,0,1,0,0|3,0,0]=4 1124 B10R1.350 C[C@@H](Cl)COCC1(CO1)C 34a_100016084084_100000760498 [0,0,0,1,0,0|2,0,0]=3 1125 B10R1.350 C[C@@H](N)COCC1(CO1)C 34a_100000737577_100000760498 [0,0,0,1,0,0|1,0,0]=2 1126 B10R1.350 C[C@@H](O)CNCC1(CC1)C 2230a_100000766693_100009817552 [0,0,0,1,0,0|3,0,0]=4 1127 B10R1.350 C[C@@H](O)CNCC1(CC1)O 2230a_100011936951_100009817552 [0,0,0,1,0,0|2,0,0]=3 1128 B10R1.350 C[C@@H](O)COCC1(CC1)C 7a_100000698024_100009817552 [0,0,0,1,0,0|3,0,0]=4 1129 B10R1.350 C[C@@H](O)COCC1(CC1)F 34a_200000703853_100009817552 [0,0,0,1,0,0|3,0,0]=4 1130 B10R1.350 C[C@@H](O)COCC1(CC1)F 7a_200000703853_100009817552 [0,0,0,1,0,0|3,0,0]=4 1131 B10R1.350 C[C@@H](O)CSCC1(CO1)C 62a_100000760498_100009817552 [0,0,0,1,0,0|2,0,0]=3 1132 B10R1.350 C[C@@H](O)CSCC1(CO1)C 62a_100009817552_100000760498 [0,0,0,1,0,0|2,0,0]=3 1133 B10R1.350 NC(=O)CNCC1(CC1)O 2230a_100011936951_100000747473 [0,0,0,1,0,0|2,0,1]=4 1134 B10R1.350 OC1(CC1)CNCC(F)F 2230a_100011936951_100011934356 [0,0,0,1,0,0|3,0,0]=4 1135 B10R1.352 CC(C)OCC1CC1(C)C 34a_100000728257_100000210206 [0,0,0,1,0,0|3,0,0]=4 1136 B10R1.352 CC(C)OCC1CC1(C)C 7a_100000728257_100000210206 [0,0,0,1,0,0|3,0,0]=4 1137 B10R1.352 CC(C)OCC1OC1(C)C 34a_200010283642_100000210206 [0,0,0,1,0,0|2,0,0]=3 1138 B10R1.352 CC(C)OCC1OC1(C)C 7a_200010283642_100000210206 [0,0,0,1,0,0|2,0,0]=3 1139 B10R1.359 CC(=O)C1COC(O1)(C)C 1458a_100015188449_200000210301 [0,0,0,1,0,0|2,0,1]=4 1140 B10R1.359 CC(=O)N1CCC(C1)(C)O 11a_100000718628_100015343762 [0,0,0,1,0,0|2,0,1]=4 1141 B10R1.359 CC(=O)N1CCC(C1)(C)O 240690a_100000718628_100015343762 [0,0,0,1,0,0|2,0,1]=4 1142 B10R1.359 CC(=O)N1CCC(C1)(C)O 527a_100000718628_100103153847 [0,0,0,1,0,0|2,0,1]=4 1143 B10R1.359 CC(C)N1CCC(C1)(C)C 2230a_100000764714_100000210206 [0,0,0,1,0,0|3,0,0]=4 1144 B10R1.359 CC(C)N1CCC(C1)(C)C 269982a_100000764714_100000210206 [0,0,0,1,0,0|3,0,0]=4 1145 B10R1.359 CC(C)N1CCC(C1)(C)O 2230a_100000718628_100000210206 [0,0,0,1,0,0|2,0,0]=3 1146 B10R1.359 CC(C)N1CCC(C1)(C)O 269982a_100000718628_100000210206 [0,0,0,1,0,0|2,0,0]=3 1147 B10R1.359 CC1(OCC(O1)C(=O)[13CH3])C 1458a_100015188449_200025704644 [0,0,0,1,0,0|2,0,1]=4 1148 B10R1.359 CN(C)C1CCC(C1)(C)C 270004a_100102631434_100000759959 [0,0,0,1,0,0|3,0,0]=4 1149 B10R1.371 C=C(C)CN1CC(C1)(C)O 2230a_100000718560_100000748629 [0,0,0,1,0,0|2,0,1]=4 1150 B10R1.371 C=C(C)CN1CC(C1)(C)O 269982a_100000718560_100000748629 [0,0,0,1,0,0|2,0,1]=4 1151 B10R1.371 CC(=O)N[C@H]1C[C@@](C1)(C)O 11a_100121572536_100015343762 [0,0,0,1,0,0|2,0,1]=4 1152 B10R1.371 CC(=O)N[C@H]1C[C@@](C1)(C)O 1626a_100121572536_100015343762 [0,0,0,1,0,0|2,0,1]=4 1153 B10R1.371 CC(=O)N[C@H]1C[C@@](C1)(C)O 240690a_100121572536_100015343762 [0,0,0,1,0,0|2,0,1]=4 1154 B10R1.371 CC(=O)N[C@H]1C[C@@](C1)(C)O 527a_100121572536_100103153847 [0,0,0,1,0,0|2,0,1]=4 1155 B10R1.371 CC(C)CN1CC(C1)(C)C 2230a_100000753659_100000210760 [0,0,0,1,0,0|3,0,0]=4 1156 B10R1.371 CC(C)CN1CC(C1)(C)C 269982a_100000753659_100000210624 [0,0,0,1,0,0|3,0,0]=4 1157 B10R1.371 CC(C)CN1CC(C1)(C)C 270004a_100000753659_100000210432 [0,0,0,1,0,0|3,0,0]=4 1158 B10R1.371 CC(C)CN1CC(C1)(C)F 2230a_100000696199_100000210760 [0,0,0,1,0,0|3,0,0]=4 1159 B10R1.371 CC(C)CN1CC(C1)(C)F 269982a_100000696199_100000210624 [0,0,0,1,0,0|3,0,0]=4 1160 B10R1.371 CC(C)CN1CC(C1)(C)F 270004a_100000696199_100000210432 [0,0,0,1,0,0|3,0,0]=4 1161 B10R1.371 CC(C)CN1CC(C1)(C)O 2230a_100000718560_100000210760 [0,0,0,1,0,0|2,0,0]=3 1162 B10R1.371 CC(C)CN1CC(C1)(C)O 269982a_100000718560_100000210624 [0,0,0,1,0,0|2,0,0]=3 1163 B10R1.371 CC(C)CN1CC(C1)(C)O 270004a_100000718560_100000210432 [0,0,0,1,0,0|2,0,0]=3 1164 B10R1.371 CC(C)N[C@H]1C[C@@](C1)(C)O 2230a_100121572536_100000210206 [0,0,0,1,0,0|2,0,0]=3 1165 B10R1.371 CC(O)CN1CC(C1)(C)C 2230a_100000753659_100011218427 [0,0,0,1,0,0|3,0,0]=4 1166 B10R1.371 CC(O)CN1CC(C1)(C)C 269982a_100000753659_100011218427 [0,0,0,1,0,0|3,0,0]=4 1167 B10R1.371 CC(O)CN1CC(C1)(C)F 2230a_100000696199_100011218427 [0,0,0,1,0,0|3,0,0]=4 1168 B10R1.371 CC(O)CN1CC(C1)(C)F 269982a_100000696199_100011218427 [0,0,0,1,0,0|3,0,0]=4 1169 B10R1.371 CC(O)CN1CC(C1)(C)O 2230a_100000718560_100011218427 [0,0,0,1,0,0|2,0,0]=3 1170 B10R1.371 CC(O)CN1CC(C1)(C)O 269982a_100000718560_100011218427 [0,0,0,1,0,0|2,0,0]=3 1171 B10R1.371 CC1(CN(C1)CC(=O)N)O 2230a_100000718560_100000747473 [0,0,0,1,0,0|2,0,1]=4 1172 B10R1.371 CC1(CN(C1)CC(=O)N)O 269982a_100000718560_100000187820 [0,0,0,1,0,0|2,0,1]=4 1173 B10R1.371 CC1(CN(C1)CC(F)F)O 2230a_100000718560_100011934356 [0,0,0,1,0,0|3,0,0]=4 1174 B10R1.371 CC1(CN(C1)CC(F)F)O 269982a_100000718560_100011934356 [0,0,0,1,0,0|3,0,0]=4 1175 B10R1.371 C[C@@H](O)CN1CC(C1)(C)C 2230a_100000753659_100009817552 [0,0,0,1,0,0|3,0,0]=4 1176 B10R1.371 C[C@@H](O)CN1CC(C1)(C)C 269982a_100000753659_100009817552 [0,0,0,1,0,0|3,0,0]=4 1177 B10R1.371 C[C@@H](O)CN1CC(C1)(C)F 2230a_100000696199_100009817552 [0,0,0,1,0,0|3,0,0]=4 1178 B10R1.371 C[C@@H](O)CN1CC(C1)(C)F 269982a_100000696199_100009817552 [0,0,0,1,0,0|3,0,0]=4 1179 B10R1.371 C[C@@H](O)CN1CC(C1)(C)O 2230a_100000718560_100009817552 [0,0,0,1,0,0|2,0,0]=3 1180 B10R1.371 C[C@@H](O)CN1CC(C1)(C)O 269982a_100000718560_100009817552 [0,0,0,1,0,0|2,0,0]=3 1181 B8R0.29 CC(=O)CCC(C)(C)C 1458a_100000070787_100000755188 [0,0,0,0,1,0|2,0,1]=4 1182 B8R0.29 CC(=O)CCC(C)(C)C 1458a_100000757465_200000210301 [0,0,0,0,1,0|2,0,1]=4 1183 B8R0.29 CC(=O)NCC(C)(C)O 1626a_100000751335_100015343762 [0,0,0,0,1,0|2,0,1]=4 1184 B8R0.29 CC(=O)NCC(C)(C)O 240690a_100000751335_100015343762 [0,0,0,0,1,0|2,0,1]=4 1185 B8R0.29 CC(=O)NCC(C)(C)O 527a_100000751335_100103153847 [0,0,0,0,1,0|2,0,1]=4 1186 B8R0.29 CC(Br)COC(C)(C)C 34a_100012180447_100000210625 [0,0,0,0,1,0|3,0,0]=4 1187 B8R0.29 CC(C)(C)CCC(=O)[13CH3] 1458a_100000757465_200025704644 [0,0,0,0,1,0|2,0,1]=4 1188 B8R0.29 CC(C)CNC(C)(C)C 2230a_100000715429_100000210760 [0,0,0,0,1,0|3,0,0]=4 1189 B8R0.29 CC(C)CNC(C)(C)C 34a_100000210953_100000210625 [0,0,0,0,1,0|3,0,0]=4 1190 B8R0.29 CC(C)COC(C)(C)C 34a_100000210257_100000210625 [0,0,0,0,1,0|3,0,0]=4 1191 B8R0.29 CC(C)COC(C)(C)C 34a_100015890283_100000210624 [0,0,0,0,1,0|3,0,0]=4 1192 B8R0.29 CC(C)COC(C)(C)C 7a_100015890283_100000210760 [0,0,0,0,1,0|3,0,0]=4 1193 B8R0.29 CC(C)CSC(C)(C)C 62a_100000210624_100000211941 [0,0,0,0,1,0|3,0,0]=4 1194 B8R0.29 CC(C)CSC(C)(C)C 62a_100000211941_100000210760 [0,0,0,0,1,0|3,0,0]=4 1195 B8R0.29 CC(C)NCC(C)(C)C 2230a_100000743828_100000210206 [0,0,0,0,1,0|3,0,0]=4 1196 B8R0.29 CC(C)NCC(C)(C)C 34a_100138425928_100011219605 [0,0,0,0,1,0|3,0,0]=4 1197 B8R0.29 CC(C)NCC(C)(C)F 2230a_100020643315_100000210206 [0,0,0,0,1,0|3,0,0]=4 1198 B8R0.29 CC(C)NCC(C)(C)F 34a_100138425928_100011997219 [0,0,0,0,1,0|3,0,0]=4 1199 B8R0.29 CC(C)NCC(C)(C)O 2230a_100000751335_100000210206 [0,0,0,0,1,0|2,0,0]=3 1200 B8R0.29 CC(C)NCC(C)(C)O 34a_100138425928_100000764493 [0,0,0,0,1,0|2,0,0]=3 1201 B8R0.29 CC(C)OCC(C)(C)C 34a_100000212225_100011219605 [0,0,0,0,1,0|3,0,0]=4 1202 B8R0.29 CC(C)OCC(C)(C)F 34a_100000212225_100011997219 [0,0,0,0,1,0|3,0,0]=4 1203 B8R0.29 CC(C)OCC(C)(C)F 34a_100000716592_100000210206 [0,0,0,0,1,0|3,0,0]=4 1204 B8R0.29 CC(C)OCC(C)(C)O 34a_100000212225_100000764493 [0,0,0,0,1,0|2,0,0]=3 1205 B8R0.29 CC(C)SCC(C)(C)C 62a_100000210206_100011219605 [0,0,0,0,1,0|3,0,0]=4 1206 B8R0.29 CC(C)SCC(C)(C)C 62a_100011219605_100000210206 [0,0,0,0,1,0|3,0,0]=4 1207 B8R0.29 CC(C)SCC(C)(C)F 62a_100000210206_100011997219 [0,0,0,0,1,0|3,0,0]=4 1208 B8R0.29 CC(C)SCC(C)(C)F 62a_100011997219_100000210206 [0,0,0,0,1,0|3,0,0]=4 1209 B8R0.29 CC(C)SCC(C)(C)O 62a_100000210206_100000764493 [0,0,0,0,1,0|2,0,0]=3 1210 B8R0.29 CC(C)SCC(C)(C)O 62a_100000764493_100000210206 [0,0,0,0,1,0|2,0,0]=3 1211 B8R0.29 CC(F)COC(C)(C)C 34a_100015925927_100000210625 [0,0,0,0,1,0|3,0,0]=4 1212 B8R0.29 CC(O)CNC(C)(C)C 2230a_100000715429_100011218427 [0,0,0,0,1,0|3,0,0]=4 1213 B8R0.29 CC(O)CNC(C)(C)C 34a_100000210904_100000210625 [0,0,0,0,1,0|3,0,0]=4 1214 B8R0.29 CC(O)COC(C)(C)C 34a_100015890283_100011218427 [0,0,0,0,1,0|3,0,0]=4 1215 B8R0.29 CC(O)COC(C)(C)C 7a_100015890283_100011218427 [0,0,0,0,1,0|3,0,0]=4 1216 B8R0.29 CC(O)CSC(C)(C)C 62a_100000211941_100011218427 [0,0,0,0,1,0|3,0,0]=4 1217 B8R0.29 CC(O)CSC(C)(C)C 62a_100011218427_100000211941 [0,0,0,0,1,0|3,0,0]=4 1218 B8R0.29 CN(C)CCC(C)(C)C 2230a_100102631434_100000755188 [0,0,0,0,1,0|3,0,0]=4 1219 B8R0.29 CN(C)CCC(C)(C)C 269982a_100102631434_100000755188 [0,0,0,0,1,0|3,0,0]=4 1220 B8R0.29 CN(C)CCC(C)(C)O 2230a_100102631434_100000702414 [0,0,0,0,1,0|2,0,0]=3 1221 B8R0.29 C[C@@H](Cl)COC(C)(C)C 34a_100016084084_100000210625 [0,0,0,0,1,0|3,0,0]=4 1222 B8R0.29 C[C@@H](N)COC(C)(C)C 34a_100000737577_100000210625 [0,0,0,0,1,0|2,0,0]=3 1223 B8R0.29 C[C@@H](O)CNC(C)(C)C 2230a_100000715429_100009817552 [0,0,0,0,1,0|3,0,0]=4 1224 B8R0.29 C[C@@H](O)COC(C)(C)C 34a_100015890283_100009817552 [0,0,0,0,1,0|3,0,0]=4 1225 B8R0.29 C[C@@H](O)COC(C)(C)C 7a_100015890283_100009817552 [0,0,0,0,1,0|3,0,0]=4 1226 B8R0.29 C[C@@H](O)CSC(C)(C)C 62a_100000211941_100009817552 [0,0,0,0,1,0|3,0,0]=4 1227 B8R0.29 C[C@@H](O)CSC(C)(C)C 62a_100009817552_100000211941 [0,0,0,0,1,0|3,0,0]=4 1228 B10R0.15 C=C(Br)CCOCC(C)(C)O 34a_100009813270_100000764493 [0,0,0,0,0,1|1,0,2]=4 1229 B10R0.15 C=C(C)CCNCC(C)(C)C 2230a_100000743828_100000730704 [0,0,0,0,0,1|2,0,1]=4 1230 B10R0.15 C=C(C)CCNCC(C)(C)F 2230a_100020643315_100000730704 [0,0,0,0,0,1|2,0,1]=4 1231 B10R0.15 C=C(C)CCNCC(C)(C)O 2230a_100000751335_100000730704 [0,0,0,0,0,1|1,0,1]=3 1232 B10R0.15 C=C(C)CCOCC(C)(C)C 34a_100000764851_100011219605 [0,0,0,0,0,1|2,0,1]=4 1233 B10R0.15 C=C(C)CCOCC(C)(C)F 34a_100000716592_100000730704 [0,0,0,0,0,1|2,0,1]=4 1234 B10R0.15 C=C(C)CCOCC(C)(C)F 34a_100000764851_100011997219 [0,0,0,0,0,1|2,0,1]=4 1235 B10R0.15 C=C(C)CCOCC(C)(C)O 34a_100000764851_100000764493 [0,0,0,0,0,1|1,0,1]=3 1236 B10R0.15 C=C(C)CCSCC(C)(C)C 62a_100000730704_100011219605 [0,0,0,0,0,1|2,0,1]=4 1237 B10R0.15 C=C(C)CCSCC(C)(C)C 62a_100011219605_100000730704 [0,0,0,0,0,1|2,0,1]=4 1238 B10R0.15 C=C(C)CCSCC(C)(C)F 62a_100000730704_100011997219 [0,0,0,0,0,1|2,0,1]=4 1239 B10R0.15 C=C(C)CCSCC(C)(C)F 62a_100011997219_100000730704 [0,0,0,0,0,1|2,0,1]=4 1240 B10R0.15 C=C(C)CCSCC(C)(C)O 62a_100000730704_100000764493 [0,0,0,0,0,1|1,0,1]=3 1241 B10R0.15 C=C(C)CCSCC(C)(C)O 62a_100000764493_100000730704 [0,0,0,0,0,1|1,0,1]=3 1242 B10R0.15 C=C(C)CNCCC(C)(C)C 2230a_100000738805_100000748629 [0,0,0,0,0,1|2,0,1]=4 1243 B10R0.15 C=C(C)CNCCC(C)(C)F 2230a_100016253952_100000748629 [0,0,0,0,0,1|2,0,1]=4 1244 B10R0.15 C=C(C)COCCC(C)(C)C 34a_100000210245_100000755188 [0,0,0,0,0,1|2,0,1]=4 1245 B10R0.15 C=C(C)COCCC(C)(C)C 7a_100000765024_100000748629 [0,0,0,0,0,1|2,0,1]=4 1246 B10R0.15 C=C(C)COCCC(C)(C)O 34a_100000210245_100000702414 [0,0,0,0,0,1|1,0,1]=3 1247 B10R0.15 C=C(C)CSCCC(C)(C)C 62a_100000748629_100000755188 [0,0,0,0,0,1|2,0,1]=4 1248 B10R0.15 C=C(C)CSCCC(C)(C)C 62a_100000755188_100000211660 [0,0,0,0,0,1|2,0,1]=4 1249 B10R0.15 C=C(C)CSCCC(C)(C)O 62a_100000702414_100000211660 [0,0,0,0,0,1|1,0,1]=3 1250 B10R0.15 C=C(C)CSCCC(C)(C)O 62a_100000748629_100000702414 [0,0,0,0,0,1|1,0,1]=3 1251 B10R0.15 C=C(F)COCCC(C)(C)O 34a_200010262243_100000702414 [0,0,0,0,0,1|1,0,2]=4 1252 B10R0.15 C=C(F)CSCCC(C)(C)O 62a_100000042424_100000702414 [0,0,0,0,0,1|1,0,2]=4 1253 B10R0.15 C=C(F)CSCCC(C)(C)O 62a_100000702414_100000042424 [0,0,0,0,0,1|1,0,2]=4 1254 B10R0.15 CC(=CCNCC(C)(C)O)C 2230a_100000751335_100000761012 [0,0,0,0,0,1|1,0,2]=4 1255 B10R0.15 CC(=CCNCC(C)(C)O)C 34a_100000718196_100000764493 [0,0,0,0,0,1|1,0,2]=4 1256 B10R0.15 CC(=CCOCC(C)(C)O)C 34a_100000753907_100000764493 [0,0,0,0,0,1|1,0,2]=4 1257 B10R0.15 CC(=CCSCC(C)(C)O)C 62a_100000761012_100000764493 [0,0,0,0,0,1|1,0,2]=4 1258 B10R0.15 CC(=CCSCC(C)(C)O)C 62a_100000764493_100000761012 [0,0,0,0,0,1|1,0,2]=4 1259 B10R0.15 CC(=O)CCCOC(C)(C)C 34a_100000759063_100000210625 [0,0,0,0,0,1|2,0,1]=4 1260 B10R0.15 CC(=O)CCCOC(C)(C)C 34a_100015890283_100000685027 [0,0,0,0,0,1|2,0,1]=4 1261 B10R0.15 CC(=O)CCCOC(C)(C)C 7a_100015890283_100011215641 [0,0,0,0,0,1|2,0,1]=4 1262 B10R0.15 CC(=O)CCCSC(C)(C)C 62a_100000211941_100011215641 [0,0,0,0,0,1|2,0,1]=4 1263 B10R0.15 CC(=O)CCCSC(C)(C)C 62a_100011215641_100000211941 [0,0,0,0,0,1|2,0,1]=4 1264 B10R0.15 CC(=O)CCOCC(C)(C)C 34a_100000759926_100011219605 [0,0,0,0,0,1|2,0,1]=4 1265 B10R0.15 CC(=O)CCOCC(C)(C)F 34a_100000759926_100011997219 [0,0,0,0,0,1|2,0,1]=4 1266 B10R0.15 CC(=O)CCOCC(C)(C)O 34a_100000759926_100000764493 [0,0,0,0,0,1|1,0,1]=3 1267 B10R0.15 CC(=O)CCOCC(C)(C)O 7a_100000759926_100000764493 [0,0,0,0,0,1|1,0,1]=3 1268 B10R0.15 CC(=O)CCSCC(C)(C)C 62a_100000053229_100011219605 [0,0,0,0,0,1|2,0,1]=4 1269 B10R0.15 CC(=O)CCSCC(C)(C)C 62a_100011219605_100000053229 [0,0,0,0,0,1|2,0,1]=4 1270 B10R0.15 CC(=O)CCSCC(C)(C)F 62a_100000053229_100011997219 [0,0,0,0,0,1|2,0,1]=4 1271 B10R0.15 CC(=O)CCSCC(C)(C)F 62a_100011997219_100000053229 [0,0,0,0,0,1|2,0,1]=4 1272 B10R0.15 CC(=O)CCSCC(C)(C)O 62a_100000053229_100000764493 [0,0,0,0,0,1|1,0,1]=3 1273 B10R0.15 CC(=O)CCSCC(C)(C)O 62a_100000764493_100000053229 [0,0,0,0,0,1|1,0,1]=3 1274 B10R0.15 CC(=O)COCCC(C)(C)C 34a_100000211253_100000755188 [0,0,0,0,0,1|2,0,1]=4 1275 B10R0.15 CC(=O)COCCC(C)(C)O 34a_100000211253_100000702414 [0,0,0,0,0,1|1,0,1]=3 1276 B10R0.15 CC(=O)OCSCC(C)(C)O 62a_100000076356_100000764493 [0,0,0,0,0,1|2,0,1]=4 1277 B10R0.15 CC(=O)OCSCC(C)(C)O 62a_100000764493_100000076356 [0,0,0,0,0,1|2,0,1]=4 1278 B10R0.15 CC(Br)CCOCC(C)(C)C 34a_100009893172_100011219605 [0,0,0,0,0,1|2,0,0]=3 1279 B10R0.15 CC(Br)CCOCC(C)(C)F 34a_100009893172_100011997219 [0,0,0,0,0,1|2,0,0]=3 1280 B10R0.15 CC(Br)CCOCC(C)(C)O 34a_100009893172_100000764493 [0,0,0,0,0,1|1,0,0]=2 1281 B10R0.15 CC(Br)COCCC(C)(C)C 34a_100012180447_100000755188 [0,0,0,0,0,1|2,0,0]=3 1282 B10R0.15 CC(Br)COCCC(C)(C)O 34a_100012180447_100000702414 [0,0,0,0,0,1|1,0,0]=2 1283 B10R0.15 CC(Br)COCC[N+](C)(C)C 34a_100012180447_100000085578 [0,0,0,0,0,1|3,0,0]=4 1284 B10R0.15 CC(Br)COCC[Si](C)(C)C 34a_100012180447_200000733723 [0,0,0,0,0,1|2,1,0]=4 1285 B10R0.15 CC(C)(C)CCNCC(=O)N 2230a_100000711301_100000755188 [0,0,0,0,0,1|2,0,1]=4 1286 B10R0.15 CC(C)(C)CCNCC(=O)N 2230a_100000738805_100000747473 [0,0,0,0,0,1|2,0,1]=4 1287 B10R0.15 CC(C)(C)CCNCC(F)F 2230a_100000738805_100011934356 [0,0,0,0,0,1|3,0,0]=4 1288 B10R0.15 CC(C)(C)CCNCC(F)F 34a_100000765723_100000755188 [0,0,0,0,0,1|3,0,0]=4 1289 B10R0.15 CC(C)(C)CCOCC(=O)N 7a_100000765024_100000187820 [0,0,0,0,0,1|2,0,1]=4 1290 B10R0.15 CC(C)(C)CCOCC(F)F 34a_100000743014_100000755188 [0,0,0,0,0,1|3,0,0]=4 1291 B10R0.15 CC(C)(C)CCOCC(F)F 7a_100000765024_100011934356 [0,0,0,0,0,1|3,0,0]=4 1292 B10R0.15 CC(C)(C)CCSCC(=O)N 62a_100000747473_100000755188 [0,0,0,0,0,1|2,0,1]=4 1293 B10R0.15 CC(C)(C)CCSCC(=O)N 62a_100000755188_100000747473 [0,0,0,0,0,1|2,0,1]=4 1294 B10R0.15 CC(C)(C)CCSCC(F)F 62a_100000755188_100011934356 [0,0,0,0,0,1|3,0,0]=4 1295 B10R0.15 CC(C)(C)CCSCC(F)F 62a_100011934356_100000755188 [0,0,0,0,0,1|3,0,0]=4 1296 B10R0.15 CC(C)(C)CNCCC(=O)N 2230a_100000743828_100000744528 [0,0,0,0,0,1|2,0,1]=4 1297 B10R0.15 CC(C)(C)COCCC(=O)N 34a_100000757172_100011219605 [0,0,0,0,0,1|2,0,1]=4 1298 B10R0.15 CC(C)(C)COCCC(F)F 34a_100103093639_100011219605 [0,0,0,0,0,1|3,0,0]=4 1299 B10R0.15 CC(C)(C)CSCCC(=O)N 62a_100000744528_100011219605 [0,0,0,0,0,1|2,0,1]=4 1300 B10R0.15 CC(C)(C)CSCCC(=O)N 62a_100011219605_100000744528 [0,0,0,0,0,1|2,0,1]=4 1301 B10R0.15 CC(C)(C)NCCCC(=O)N 34a_100000739312_100000210625 [0,0,0,0,0,1|2,0,1]=4 1302 B10R0.15 CC(C)(C)OCCCC(=O)N 34a_100015890283_100102525003 [0,0,0,0,0,1|2,0,1]=4 1303 B10R0.15 CC(C)(C)OCCCC(=O)N 7a_100015890283_100102525003 [0,0,0,0,0,1|2,0,1]=4 1304 B10R0.15 CC(C)(C)SCCCC(=O)N 62a_100000211941_100102525003 [0,0,0,0,0,1|2,0,1]=4 1305 B10R0.15 CC(C)(C)SCCCC(=O)N 62a_100102525003_100000211941 [0,0,0,0,0,1|2,0,1]=4 1306 B10R0.15 CC(C)(F)CCNCC(=O)N 2230a_100016253952_100000747473 [0,0,0,0,0,1|2,0,1]=4 1307 B10R0.15 CC(C)(F)CCNCC(F)F 2230a_100016253952_100011934356 [0,0,0,0,0,1|3,0,0]=4 1308 B10R0.15 CC(C)(F)CNCCC(=O)N 2230a_100020643315_100000744528 [0,0,0,0,0,1|2,0,1]=4 1309 B10R0.15 CC(C)(F)COCCC(=O)N 34a_100000716592_100000731001 [0,0,0,0,0,1|2,0,1]=4 1310 B10R0.15 CC(C)(F)COCCC(=O)N 34a_100000757172_100011997219 [0,0,0,0,0,1|2,0,1]=4 1311 B10R0.15 CC(C)(F)COCCC(F)F 34a_100103093639_100011997219 [0,0,0,0,0,1|3,0,0]=4 1312 B10R0.15 CC(C)(F)CSCCC(=O)N 62a_100000744528_100011997219 [0,0,0,0,0,1|2,0,1]=4 1313 B10R0.15 CC(C)(F)CSCCC(=O)N 62a_100011997219_100000744528 [0,0,0,0,0,1|2,0,1]=4 1314 B10R0.15 CC(C)(O)CCNCC(=O)N 2230a_100000711301_100000702414 [0,0,0,0,0,1|1,0,1]=3 1315 B10R0.15 CC(C)(O)CCNCC(=O)O 269956a_100016091260_100000702414 [0,0,0,0,0,1|2,0,1]=4 1316 B10R0.15 CC(C)(O)CCNCC(F)F 34a_100000765723_100000702414 [0,0,0,0,0,1|2,0,0]=3 1317 B10R0.15 CC(C)(O)CCOCC(F)F 34a_100000743014_100000702414 [0,0,0,0,0,1|2,0,0]=3 1318 B10R0.15 CC(C)(O)CCSCC(=O)N 62a_100000702414_100000747473 [0,0,0,0,0,1|1,0,1]=3 1319 B10R0.15 CC(C)(O)CCSCC(=O)N 62a_100000747473_100000702414 [0,0,0,0,0,1|1,0,1]=3 1320 B10R0.15 CC(C)(O)CCSCC(=O)[O-] 62a_100000702414_100020667443 [0,0,0,0,0,1|2,0,1]=4 1321 B10R0.15 CC(C)(O)CCSCC(=O)[O-] 62a_100020667443_100000702414 [0,0,0,0,0,1|2,0,1]=4 1322 B10R0.15 CC(C)(O)CCSCC(F)F 62a_100000702414_100011934356 [0,0,0,0,0,1|2,0,0]=3 1323 B10R0.15 CC(C)(O)CCSCC(F)F 62a_100011934356_100000702414 [0,0,0,0,0,1|2,0,0]=3 1324 B10R0.15 CC(C)(O)CCSC[N+](=O)[O-] 62a_100000702414_100000761209 [0,0,0,0,0,1|3,0,0]=4 1325 B10R0.15 CC(C)(O)CNCCC(=O)N 2230a_100000751335_100000744528 [0,0,0,0,0,1|1,0,1]=3 1326 B10R0.15 CC(C)(O)COCCC(=O)N 34a_100000757172_100000764493 [0,0,0,0,0,1|1,0,1]=3 1327 B10R0.15 CC(C)(O)COCCC(=O)N 7a_100000757172_100000764493 [0,0,0,0,0,1|1,0,1]=3 1328 B10R0.15 CC(C)(O)COCCC(F)F 34a_100103093639_100000764493 [0,0,0,0,0,1|2,0,0]=3 1329 B10R0.15 CC(C)(O)CSCCC(=O)N 62a_100000744528_100000764493 [0,0,0,0,0,1|1,0,1]=3 1330 B10R0.15 CC(C)(O)CSCCC(=O)N 62a_100000764493_100000744528 [0,0,0,0,0,1|1,0,1]=3 1331 B10R0.15 CC(C)CCCNC(C)(C)C 2230a_100000715429_100011214892 [0,0,0,0,0,1|2,0,0]=3 1332 B10R0.15 CC(C)CCCNC(C)(C)C 34a_200000737386_100000210625 [0,0,0,0,0,1|2,0,0]=3 1333 B10R0.15 CC(C)CCCOC(C)(C)C 34a_100000210774_100000210625 [0,0,0,0,0,1|2,0,0]=3 1334 B10R0.15 CC(C)CCCOC(C)(C)C 34a_100015890283_100011214892 [0,0,0,0,0,1|2,0,0]=3 1335 B10R0.15 CC(C)CCCOC(C)(C)C 7a_100015890283_100011214892 [0,0,0,0,0,1|2,0,0]=3 1336 B10R0.15 CC(C)CCCSC(C)(C)C 62a_100000211941_100011214892 [0,0,0,0,0,1|2,0,0]=3 1337 B10R0.15 CC(C)CCCSC(C)(C)C 62a_100011214892_100000211941 [0,0,0,0,0,1|2,0,0]=3 1338 B10R0.15 CC(C)CCNCC(C)(C)C 2230a_100000743828_100000210312 [0,0,0,0,0,1|2,0,0]=3 1339 B10R0.15 CC(C)CCNCC(C)(C)C 269862a_100000743828_100000185833 [0,0,0,0,0,1|2,0,0]=3 1340 B10R0.15 CC(C)CCNCC(C)(C)C 270004a_100000210545_100011204126 [0,0,0,0,0,1|2,0,0]=3 1341 B10R0.15 CC(C)CCNCC(C)(C)F 2230a_100020643315_100000210312 [0,0,0,0,0,1|2,0,0]=3 1342 B10R0.15 CC(C)CCNCC(C)(C)F 269862a_100020643315_100000185833 [0,0,0,0,0,1|2,0,0]=3 1343 B10R0.15 CC(C)CCNCC(C)(C)O 2230a_100000751335_100000210312 [0,0,0,0,0,1|1,0,0]=2 1344 B10R0.15 CC(C)CCNCC(C)(C)O 269862a_100000751335_100000185833 [0,0,0,0,0,1|1,0,0]=2 1345 B10R0.15 CC(C)CCNCC(C)(F)F 269862a_100000731000_100000185833 [0,0,0,0,0,1|3,0,0]=4 1346 B10R0.15 CC(C)CCOCC(C)(C)C 34a_100000210254_100011219605 [0,0,0,0,0,1|2,0,0]=3 1347 B10R0.15 CC(C)CCOCC(C)(C)F 34a_100000210254_100011997219 [0,0,0,0,0,1|2,0,0]=3 1348 B10R0.15 CC(C)CCOCC(C)(C)F 34a_100000716592_100000210312 [0,0,0,0,0,1|2,0,0]=3 1349 B10R0.15 CC(C)CCOCC(C)(C)O 34a_100000210254_100000764493 [0,0,0,0,0,1|1,0,0]=2 1350 B10R0.15 CC(C)CCOCC(C)(C)O 7a_100000210254_100000764493 [0,0,0,0,0,1|1,0,0]=2 1351 B10R0.15 CC(C)CCOCC(C)(F)F 34a_100000068830_100000210312 [0,0,0,0,0,1|3,0,0]=4 1352 B10R0.15 CC(C)CCOC[Si](C)(C)C 7a_100000210254_100000233785 [0,0,0,0,0,1|2,1,0]=4 1353 B10R0.15 CC(C)CCSCC(C)(C)C 62a_100000210312_100011219605 [0,0,0,0,0,1|2,0,0]=3 1354 B10R0.15 CC(C)CCSCC(C)(C)C 62a_100011219605_100000210312 [0,0,0,0,0,1|2,0,0]=3 1355 B10R0.15 CC(C)CCSCC(C)(C)F 62a_100000210312_100011997219 [0,0,0,0,0,1|2,0,0]=3 1356 B10R0.15 CC(C)CCSCC(C)(C)F 62a_100011997219_100000210312 [0,0,0,0,0,1|2,0,0]=3 1357 B10R0.15 CC(C)CCSCC(C)(C)O 62a_100000210312_100000764493 [0,0,0,0,0,1|1,0,0]=2 1358 B10R0.15 CC(C)CCSCC(C)(C)O 62a_100000764493_100000210312 [0,0,0,0,0,1|1,0,0]=2 1359 B10R0.15 CC(C)CCSC[N+](C)(C)C 62a_100000210312_200000036245 [0,0,0,0,0,1|3,0,0]=4 1360 B10R0.15 CC(C)CCSC[N+](C)(C)C 62a_200000036245_100000210312 [0,0,0,0,0,1|3,0,0]=4 1361 B10R0.15 CC(C)CCSC[Si](C)(C)C 62a_100000037933_100000210312 [0,0,0,0,0,1|2,1,0]=4 1362 B10R0.15 CC(C)CCSC[Si](C)(C)C 62a_100000210312_100000037933 [0,0,0,0,0,1|2,1,0]=4 1363 B10R0.15 CC(C)CNCCC(C)(C)C 2230a_100000210953_100000755188 [0,0,0,0,0,1|2,0,0]=3 1364 B10R0.15 CC(C)CNCCC(C)(C)C 2230a_100000738805_100000210760 [0,0,0,0,0,1|2,0,0]=3 1365 B10R0.15 CC(C)CNCCC(C)(C)C 270004a_100000738805_100000210432 [0,0,0,0,0,1|2,0,0]=3 1366 B10R0.15 CC(C)CNCCC(C)(C)C 34a_100000210953_100000755188 [0,0,0,0,0,1|2,0,0]=3 1367 B10R0.15 CC(C)CNCCC(C)(C)F 2230a_100016253952_100000210760 [0,0,0,0,0,1|2,0,0]=3 1368 B10R0.15 CC(C)CNCCC(C)(C)F 270004a_100016253952_100000210432 [0,0,0,0,0,1|2,0,0]=3 1369 B10R0.15 CC(C)CNCCC(C)(C)O 2230a_100000210953_100000702414 [0,0,0,0,0,1|1,0,0]=2 1370 B10R0.15 CC(C)CNCCC(C)(C)O 270004a_100000707701_100000210432 [0,0,0,0,0,1|1,0,0]=2 1371 B10R0.15 CC(C)CNCCC(C)(C)O 34a_100000210953_100000702414 [0,0,0,0,0,1|1,0,0]=2 1372 B10R0.15 CC(C)CNCC[N+](C)(C)C 270004a_100000106457_100000210432 [0,0,0,0,0,1|3,0,0]=4 1373 B10R0.15 CC(C)CNCC[N+](C)(C)C 34a_100000210953_100000085578 [0,0,0,0,0,1|3,0,0]=4 1374 B10R0.15 CC(C)CNCC[Si](C)(C)C 2230a_100000210953_200000733723 [0,0,0,0,0,1|2,1,0]=4 1375 B10R0.15 CC(C)CNCC[Si](C)(C)C 34a_100000210953_200000733723 [0,0,0,0,0,1|2,1,0]=4 1376 B10R0.15 CC(C)COCCC(C)(C)C 34a_100000210257_100000755188 [0,0,0,0,0,1|2,0,0]=3 1377 B10R0.15 CC(C)COCCC(C)(C)C 7a_100000765024_100000210760 [0,0,0,0,0,1|2,0,0]=3 1378 B10R0.15 CC(C)COCCC(C)(C)O 34a_100000210257_100000702414 [0,0,0,0,0,1|1,0,0]=2 1379 B10R0.15 CC(C)COCC[N+](C)(C)C 34a_100000210257_100000085578 [0,0,0,0,0,1|3,0,0]=4 1380 B10R0.15 CC(C)COCC[N+](C)(C)C 7a_200020618287_100000210760 [0,0,0,0,0,1|3,0,0]=4 1381 B10R0.15 CC(C)COCC[Si](C)(C)C 34a_100000210257_200000733723 [0,0,0,0,0,1|2,1,0]=4 1382 B10R0.15 CC(C)COCC[Si](C)(C)C 7a_100000039746_100000210760 [0,0,0,0,0,1|2,1,0]=4 1383 B10R0.15 CC(C)CSCCC(C)(C)C 62a_100000210624_100000755188 [0,0,0,0,0,1|2,0,0]=3 1384 B10R0.15 CC(C)CSCCC(C)(C)C 62a_100000755188_100000210760 [0,0,0,0,0,1|2,0,0]=3 1385 B10R0.15 CC(C)CSCCC(C)(C)O 62a_100000210624_100000702414 [0,0,0,0,0,1|1,0,0]=2 1386 B10R0.15 CC(C)CSCCC(C)(C)O 62a_100000702414_100000210760 [0,0,0,0,0,1|1,0,0]=2 1387 B10R0.15 CC(C)CSCC[N+](C)(C)C 62a_100000085578_100000210760 [0,0,0,0,0,1|3,0,0]=4 1388 B10R0.15 CC(C)CSCC[N+](C)(C)C 62a_100000210624_100000085578 [0,0,0,0,0,1|3,0,0]=4 1389 B10R0.15 CC(C)CSCC[Si](C)(C)C 62a_100000210624_200000733723 [0,0,0,0,0,1|2,1,0]=4 1390 B10R0.15 CC(C)CSCC[Si](C)(C)C 62a_200000733723_100000210760 [0,0,0,0,0,1|2,1,0]=4 1391 B10R0.15 CC(C)NCCCC(C)(C)O 2230a_100138425928_100009888830 [0,0,0,0,0,1|1,0,0]=2 1392 B10R0.15 CC(C)NCCCC(C)(C)O 34a_100138425928_100009888830 [0,0,0,0,0,1|1,0,0]=2 1393 B10R0.15 CC(C)NCCC[N+](C)(C)C 2230a_100138425928_100016990835 [0,0,0,0,0,1|3,0,0]=4 1394 B10R0.15 CC(C)NCCC[N+](C)(C)C 34a_100138425928_100016990835 [0,0,0,0,0,1|3,0,0]=4 1395 B10R0.15 CC(C)NCCC[Si](C)(C)C 2230a_100138425928_100011219597 [0,0,0,0,0,1|2,1,0]=4 1396 B10R0.15 CC(C)NCCC[Si](C)(C)C 34a_100138425928_100011219597 [0,0,0,0,0,1|2,1,0]=4 1397 B10R0.15 CC(C)NCCOC(C)(C)C 2230a_100000747557_100000210206 [0,0,0,0,0,1|3,0,0]=4 1398 B10R0.15 CC(C)NCCOC(C)(C)C 34a_100000224655_100000210625 [0,0,0,0,0,1|3,0,0]=4 1399 B10R0.15 CC(C)NCCSC(C)(C)C 2230a_100000689375_100000210206 [0,0,0,0,0,1|3,0,0]=4 1400 B10R0.15 CC(C)OCCCC(C)(C)O 34a_100000212225_100009888830 [0,0,0,0,0,1|1,0,0]=2 1401 B10R0.15 CC(C)OCCC[N+](C)(C)C 34a_100000212225_100016990835 [0,0,0,0,0,1|3,0,0]=4 1402 B10R0.15 CC(C)OCCC[Si](C)(C)C 34a_100000212225_100011219597 [0,0,0,0,0,1|2,1,0]=4 1403 B10R0.15 CC(C)OCCC[Si](C)(C)C 7a_200011215415_100000210206 [0,0,0,0,0,1|2,1,0]=4 1404 B10R0.15 CC(C)OCCNC(C)(C)C 2230a_100000715429_100000211751 [0,0,0,0,0,1|3,0,0]=4 1405 B10R0.15 CC(C)OCCNC(C)(C)C 34a_100000701111_100000210625 [0,0,0,0,0,1|3,0,0]=4 1406 B10R0.15 CC(C)OCCOC(C)(C)C 34a_100000211219_100000210625 [0,0,0,0,0,1|3,0,0]=4 1407 B10R0.15 CC(C)OCCOC(C)(C)C 34a_100000693234_100000210206 [0,0,0,0,0,1|3,0,0]=4 1408 B10R0.15 CC(C)OCCOC(C)(C)C 34a_100015890283_100000211751 [0,0,0,0,0,1|3,0,0]=4 1409 B10R0.15 CC(C)OCCOC(C)(C)C 7a_100000693234_100000210206 [0,0,0,0,0,1|3,0,0]=4 1410 B10R0.15 CC(C)OCCOC(C)(C)C 7a_100015890283_100000211751 [0,0,0,0,0,1|3,0,0]=4 1411 B10R0.15 CC(C)OCCSC(C)(C)C 62a_100000211751_100000211941 [0,0,0,0,0,1|3,0,0]=4 1412 B10R0.15 CC(C)OCCSC(C)(C)C 62a_100000211941_100000211751 [0,0,0,0,0,1|3,0,0]=4 1413 B10R0.15 CC(C)OCNCC(C)(C)C 2230a_100000743828_100000709892 [0,0,0,0,0,1|3,0,0]=4 1414 B10R0.15 CC(C)OCNCC(C)(C)F 2230a_100020643315_100000709892 [0,0,0,0,0,1|3,0,0]=4 1415 B10R0.15 CC(C)OCNCC(C)(C)O 2230a_100000751335_100000709892 [0,0,0,0,0,1|2,0,0]=3 1416 B10R0.15 CC(C)OCOCC(C)(C)F 34a_100000716592_100000709892 [0,0,0,0,0,1|3,0,0]=4 1417 B10R0.15 CC(C)OCSCC(C)(C)C 62a_100000709892_100011219605 [0,0,0,0,0,1|3,0,0]=4 1418 B10R0.15 CC(C)OCSCC(C)(C)C 62a_100011219605_100000709892 [0,0,0,0,0,1|3,0,0]=4 1419 B10R0.15 CC(C)OCSCC(C)(C)F 62a_100000709892_100011997219 [0,0,0,0,0,1|3,0,0]=4 1420 B10R0.15 CC(C)OCSCC(C)(C)F 62a_100011997219_100000709892 [0,0,0,0,0,1|3,0,0]=4 1421 B10R0.15 CC(C)OCSCC(C)(C)O 62a_100000709892_100000764493 [0,0,0,0,0,1|2,0,0]=3 1422 B10R0.15 CC(C)OCSCC(C)(C)O 62a_100000764493_100000709892 [0,0,0,0,0,1|2,0,0]=3 1423 B10R0.15 CC(C)SCCCC(C)(C)O 62a_100000210206_100009888830 [0,0,0,0,0,1|1,0,0]=2 1424 B10R0.15 CC(C)SCCCC(C)(C)O 62a_100009888830_100000210206 [0,0,0,0,0,1|1,0,0]=2 1425 B10R0.15 CC(C)SCCC[N+](C)(C)C 62a_100000210206_100016990835 [0,0,0,0,0,1|3,0,0]=4 1426 B10R0.15 CC(C)SCCC[N+](C)(C)C 62a_100016990835_100000210206 [0,0,0,0,0,1|3,0,0]=4 1427 B10R0.15 CC(C)SCCC[Si](C)(C)C 62a_100000210206_100011219597 [0,0,0,0,0,1|2,1,0]=4 1428 B10R0.15 CC(C)SCCC[Si](C)(C)C 62a_100011219597_100000210206 [0,0,0,0,0,1|2,1,0]=4 1429 B10R0.15 CC(C)SCCNC(C)(C)C 2230a_100000715429_100000730970 [0,0,0,0,0,1|3,0,0]=4 1430 B10R0.15 CC(C)SCCNC(C)(C)C 34a_100000731138_100000210625 [0,0,0,0,0,1|3,0,0]=4 1431 B10R0.15 CC(C)SCCOC(C)(C)C 34a_100015890283_100000730970 [0,0,0,0,0,1|3,0,0]=4 1432 B10R0.15 CC(C)SCCOC(C)(C)C 34a_200011212901_100000210625 [0,0,0,0,0,1|3,0,0]=4 1433 B10R0.15 CC(C)SCCOC(C)(C)C 7a_100015890283_100000730970 [0,0,0,0,0,1|3,0,0]=4 1434 B10R0.15 CC(C)SCCSC(C)(C)C 62a_100000211941_100000730970 [0,0,0,0,0,1|3,0,0]=4 1435 B10R0.15 CC(C)SCCSC(C)(C)C 62a_100000730970_100000211941 [0,0,0,0,0,1|3,0,0]=4 1436 B10R0.15 CC(F)COCCC(C)(C)C 34a_100015925927_100000755188 [0,0,0,0,0,1|2,0,0]=3 1437 B10R0.15 CC(F)COCCC(C)(C)O 34a_100015925927_100000702414 [0,0,0,0,0,1|1,0,0]=2 1438 B10R0.15 CC(F)COCC[N+](C)(C)C 34a_100015925927_100000085578 [0,0,0,0,0,1|3,0,0]=4 1439 B10R0.15 CC(F)COCC[Si](C)(C)C 34a_100015925927_200000733723 [0,0,0,0,0,1|2,1,0]=4 1440 B10R0.15 CC(O)CCCNC(C)(C)C 2230a_100000715429_200000718107 [0,0,0,0,0,1|2,0,0]=3 1441 B10R0.15 CC(O)CCCOC(C)(C)C 34a_100015890283_200000718107 [0,0,0,0,0,1|2,0,0]=3 1442 B10R0.15 CC(O)CCCOC(C)(C)C 7a_100015890283_200000718107 [0,0,0,0,0,1|2,0,0]=3 1443 B10R0.15 CC(O)CCCSC(C)(C)C 62a_100000211941_200000718107 [0,0,0,0,0,1|2,0,0]=3 1444 B10R0.15 CC(O)CCCSC(C)(C)C 62a_200000718107_100000211941 [0,0,0,0,0,1|2,0,0]=3 1445 B10R0.15 CC(O)CCNCC(C)(C)C 2230a_100000743828_100012276601 [0,0,0,0,0,1|2,0,0]=3 1446 B10R0.15 CC(O)CCNCC(C)(C)C 270004a_200000755665_100011204126 [0,0,0,0,0,1|2,0,0]=3 1447 B10R0.15 CC(O)CCNCC(C)(C)F 2230a_100020643315_100012276601 [0,0,0,0,0,1|2,0,0]=3 1448 B10R0.15 CC(O)CCNCC(C)(C)O 2230a_100000751335_100012276601 [0,0,0,0,0,1|1,0,0]=2 1449 B10R0.15 CC(O)CCNC[Si](C)(C)C 2230a_200000755665_100000037933 [0,0,0,0,0,1|2,1,0]=4 1450 B10R0.15 CC(O)CCOCC(C)(C)F 34a_100000716592_100012276601 [0,0,0,0,0,1|2,0,0]=3 1451 B10R0.15 CC(O)CCOCC(C)(F)F 34a_100000068830_100012276601 [0,0,0,0,0,1|3,0,0]=4 1452 B10R0.15 CC(O)CCSCC(C)(C)C 62a_100011219605_100012276601 [0,0,0,0,0,1|2,0,0]=3 1453 B10R0.15 CC(O)CCSCC(C)(C)C 62a_100012276601_100011219605 [0,0,0,0,0,1|2,0,0]=3 1454 B10R0.15 CC(O)CCSCC(C)(C)F 62a_100011997219_100012276601 [0,0,0,0,0,1|2,0,0]=3 1455 B10R0.15 CC(O)CCSCC(C)(C)F 62a_100012276601_100011997219 [0,0,0,0,0,1|2,0,0]=3 1456 B10R0.15 CC(O)CCSCC(C)(C)O 62a_100000764493_100012276601 [0,0,0,0,0,1|1,0,0]=2 1457 B10R0.15 CC(O)CCSCC(C)(C)O 62a_100012276601_100000764493 [0,0,0,0,0,1|1,0,0]=2 1458 B10R0.15 CC(O)CCSC[N+](C)(C)C 62a_100012276601_200000036245 [0,0,0,0,0,1|3,0,0]=4 1459 B10R0.15 CC(O)CCSC[N+](C)(C)C 62a_200000036245_100012276601 [0,0,0,0,0,1|3,0,0]=4 1460 B10R0.15 CC(O)CCSC[Si](C)(C)C 62a_100000037933_100012276601 [0,0,0,0,0,1|2,1,0]=4 1461 B10R0.15 CC(O)CCSC[Si](C)(C)C 62a_100012276601_100000037933 [0,0,0,0,0,1|2,1,0]=4 1462 B10R0.15 CC(O)CNCCC(C)(C)C 2230a_100000210904_100000755188 [0,0,0,0,0,1|2,0,0]=3 1463 B10R0.15 CC(O)CNCCC(C)(C)C 2230a_100000738805_100011218427 [0,0,0,0,0,1|2,0,0]=3 1464 B10R0.15 CC(O)CNCCC(C)(C)C 34a_100000210904_100000755188 [0,0,0,0,0,1|2,0,0]=3 1465 B10R0.15 CC(O)CNCCC(C)(C)F 2230a_100016253952_100011218427 [0,0,0,0,0,1|2,0,0]=3 1466 B10R0.15 CC(O)CNCCC(C)(C)O 2230a_100000210904_100000702414 [0,0,0,0,0,1|1,0,0]=2 1467 B10R0.15 CC(O)CNCCC(C)(C)O 34a_100000210904_100000702414 [0,0,0,0,0,1|1,0,0]=2 1468 B10R0.15 CC(O)CNCC[N+](C)(C)C 34a_100000210904_100000085578 [0,0,0,0,0,1|3,0,0]=4 1469 B10R0.15 CC(O)CNCC[Si](C)(C)C 2230a_100000210904_200000733723 [0,0,0,0,0,1|2,1,0]=4 1470 B10R0.15 CC(O)CNCC[Si](C)(C)C 34a_100000210904_200000733723 [0,0,0,0,0,1|2,1,0]=4 1471 B10R0.15 CC(O)COCCC(C)(C)C 7a_100000765024_100011218427 [0,0,0,0,0,1|2,0,0]=3 1472 B10R0.15 CC(O)COCC[N+](C)(C)C 7a_200020618287_100011218427 [0,0,0,0,0,1|3,0,0]=4 1473 B10R0.15 CC(O)COCC[Si](C)(C)C 7a_100000039746_100011218427 [0,0,0,0,0,1|2,1,0]=4 1474 B10R0.15 CC(O)CSCCC(C)(C)C 62a_100000755188_100011218427 [0,0,0,0,0,1|2,0,0]=3 1475 B10R0.15 CC(O)CSCCC(C)(C)C 62a_100011218427_100000755188 [0,0,0,0,0,1|2,0,0]=3 1476 B10R0.15 CC(O)CSCCC(C)(C)O 62a_100000702414_100011218427 [0,0,0,0,0,1|1,0,0]=2 1477 B10R0.15 CC(O)CSCCC(C)(C)O 62a_100011218427_100000702414 [0,0,0,0,0,1|1,0,0]=2 1478 B10R0.15 CC(O)CSCC[N+](C)(C)C 62a_100000085578_100011218427 [0,0,0,0,0,1|3,0,0]=4 1479 B10R0.15 CC(O)CSCC[N+](C)(C)C 62a_100011218427_100000085578 [0,0,0,0,0,1|3,0,0]=4 1480 B10R0.15 CC(O)CSCC[Si](C)(C)C 62a_100011218427_200000733723 [0,0,0,0,0,1|2,1,0]=4 1481 B10R0.15 CC(O)CSCC[Si](C)(C)C 62a_200000733723_100011218427 [0,0,0,0,0,1|2,1,0]=4 1482 B10R0.15 CN(C)CCCOC(C)(C)C 7a_100015890283_100000757444 [0,0,0,0,0,1|3,0,0]=4 1483 B10R0.15 CN(C)CCCSC(C)(C)C 62a_100000211941_100000757444 [0,0,0,0,0,1|3,0,0]=4 1484 B10R0.15 CN(C)CCNCC(C)(C)C 270004a_100000210585_100011204126 [0,0,0,0,0,1|3,0,0]=4 1485 B10R0.15 CN(C)CCSCC(C)(C)C 62a_100011219605_100000755713 [0,0,0,0,0,1|3,0,0]=4 1486 B10R0.15 CN(C)CCSCC(C)(C)F 62a_100011997219_100000755713 [0,0,0,0,0,1|3,0,0]=4 1487 B10R0.15 CN(C)CCSCC(C)(C)O 62a_100000764493_100000755713 [0,0,0,0,0,1|2,0,0]=3 1488 B10R0.15 C[C@@H](Cl)COCCC(C)(C)C 34a_100016084084_100000755188 [0,0,0,0,0,1|2,0,0]=3 1489 B10R0.15 C[C@@H](Cl)COCCC(C)(C)O 34a_100016084084_100000702414 [0,0,0,0,0,1|1,0,0]=2 1490 B10R0.15 C[C@@H](Cl)COCC[N+](C)(C)C 34a_100016084084_100000085578 [0,0,0,0,0,1|3,0,0]=4 1491 B10R0.15 C[C@@H](Cl)COCC[Si](C)(C)C 34a_100016084084_200000733723 [0,0,0,0,0,1|2,1,0]=4 1492 B10R0.15 C[C@@H](N)CCOCC(C)(C)C 34a_100000706166_100011219605 [0,0,0,0,0,1|1,0,0]=2 1493 B10R0.15 C[C@@H](N)CCOCC(C)(C)F 34a_100000706166_100011997219 [0,0,0,0,0,1|1,0,0]=2 1494 B10R0.15 C[C@@H](N)CCOCC(C)(C)O 34a_100000706166_100000764493 [0,0,0,0,0,1|0,0,0]=1 1495 B10R0.15 C[C@@H](N)COCCC(C)(C)C 34a_100000737577_100000755188 [0,0,0,0,0,1|1,0,0]=2 1496 B10R0.15 C[C@@H](N)COCCC(C)(C)O 34a_100000737577_100000702414 [0,0,0,0,0,1|0,0,0]=1 1497 B10R0.15 C[C@@H](N)COCCC(F)(F)F 34a_100000737577_100011219754 [0,0,0,0,0,1|3,0,0]=4 1498 B10R0.15 C[C@@H](N)COCCS(=O)(=O)C 34a_100000737577_100000731031 [0,0,0,0,0,1|2,0,1]=4 1499 B10R0.15 C[C@@H](N)COCC[N+](C)(C)C 34a_100000737577_100000085578 [0,0,0,0,0,1|2,0,0]=3 1500 B10R0.15 C[C@@H](N)COCC[Si](C)(C)C 34a_100000737577_200000733723 [0,0,0,0,0,1|1,1,0]=3 1501 B10R0.15 C[C@@H](O)CNCCC(C)(C)C 2230a_100000738805_100009817552 [0,0,0,0,0,1|2,0,0]=3 1502 B10R0.15 C[C@@H](O)CNCCC(C)(C)F 2230a_100016253952_100009817552 [0,0,0,0,0,1|2,0,0]=3 1503 B10R0.15 C[C@@H](O)COCCC(C)(C)C 7a_100000765024_100009817552 [0,0,0,0,0,1|2,0,0]=3 1504 B10R0.15 C[C@@H](O)COCC[N+](C)(C)C 7a_200020618287_100009817552 [0,0,0,0,0,1|3,0,0]=4 1505 B10R0.15 C[C@@H](O)COCC[Si](C)(C)C 7a_100000039746_100009817552 [0,0,0,0,0,1|2,1,0]=4 1506 B10R0.15 C[C@@H](O)CSCCC(C)(C)C 62a_100000755188_100009817552 [0,0,0,0,0,1|2,0,0]=3 1507 B10R0.15 C[C@@H](O)CSCCC(C)(C)C 62a_100009817552_100000755188 [0,0,0,0,0,1|2,0,0]=3 1508 B10R0.15 C[C@@H](O)CSCCC(C)(C)O 62a_100000702414_100009817552 [0,0,0,0,0,1|1,0,0]=2 1509 B10R0.15 C[C@@H](O)CSCCC(C)(C)O 62a_100009817552_100000702414 [0,0,0,0,0,1|1,0,0]=2 1510 B10R0.15 C[C@@H](O)CSCC[N+](C)(C)C 62a_100000085578_100009817552 [0,0,0,0,0,1|3,0,0]=4 1511 B10R0.15 C[C@@H](O)CSCC[N+](C)(C)C 62a_100009817552_100000085578 [0,0,0,0,0,1|3,0,0]=4 1512 B10R0.15 C[C@@H](O)CSCC[Si](C)(C)C 62a_100009817552_200000733723 [0,0,0,0,0,1|2,1,0]=4 1513 B10R0.15 C[C@@H](O)CSCC[Si](C)(C)C 62a_200000733723_100009817552 [0,0,0,0,0,1|2,1,0]=4 1514 B7R0.4 CC(=O)CCCCO 1458a_100000070787_100000210776 [2,0,0,0,0,0|1,0,1]=4 1515 B7R0.4 CC(=O)CCCCO 1458a_100000695505_200000210301 [2,0,0,0,0,0|1,0,1]=4 1516 B7R0.4 CC(Br)COCCO 34a_100012180447_100000211926 [2,0,0,0,0,0|2,0,0]=4 1517 B7R0.4 CC(C)CCCN[13CH3] 2230a_200000737386_200025704644 [2,0,0,0,0,0|1,0,0]=3 1518 B7R0.4 CC(C)CCCN[13CH3] 34a_200000737386_200025704644 [2,0,0,0,0,0|1,0,0]=3 1519 B7R0.4 CC(C)CCCO[13CH3] 34a_100000210774_200025704644 [2,0,0,0,0,0|1,0,0]=3 1520 B7R0.4 CC(C)CCCO[13CH3] 7a_100000210774_200025704644 [2,0,0,0,0,0|1,0,0]=3 1521 B7R0.4 CC(C)CCCS[13CH3] 62a_100011214892_200025704644 [2,0,0,0,0,0|1,0,0]=3 1522 B7R0.4 CC(C)CCCS[13CH3] 62a_200025704644_100011214892 [2,0,0,0,0,0|1,0,0]=3 1523 B7R0.4 CC(C)CCOCF 34a_100000210254_100015361967 [2,0,0,0,0,0|2,0,0]=4 1524 B7R0.4 CC(C)CCOCF 7a_100000210254_100015361967 [2,0,0,0,0,0|2,0,0]=4 1525 B7R0.4 CC(C)CCSCF 62a_100000210312_100015361967 [2,0,0,0,0,0|2,0,0]=4 1526 B7R0.4 CC(C)CCSCF 62a_100015361967_100000210312 [2,0,0,0,0,0|2,0,0]=4 1527 B7R0.4 CC(C)CNCCF 2230a_100000210953_100011217306 [2,0,0,0,0,0|2,0,0]=4 1528 B7R0.4 CC(C)CNCCF 34a_100000210953_100011217306 [2,0,0,0,0,0|2,0,0]=4 1529 B7R0.4 CC(C)CNCCF 34a_100000724931_100000210624 [2,0,0,0,0,0|2,0,0]=4 1530 B7R0.4 CC(C)CNCCO 2230a_100000210953_100000211926 [2,0,0,0,0,0|2,0,0]=4 1531 B7R0.4 CC(C)CNCCO 2230a_100016997473_100000210760 [2,0,0,0,0,0|2,0,0]=4 1532 B7R0.4 CC(C)CNCCO 270004a_100000210304_100000210432 [2,0,0,0,0,0|2,0,0]=4 1533 B7R0.4 CC(C)CNCCO 34a_100000210953_100000211926 [2,0,0,0,0,0|2,0,0]=4 1534 B7R0.4 CC(C)CNCCO 34a_100016990907_100000210624 [2,0,0,0,0,0|2,0,0]=4 1535 B7R0.4 CC(C)COCCBr 34a_100000211926_100000210624 [2,0,0,0,0,0|2,0,0]=4 1536 B7R0.4 CC(C)COCCF 34a_100000210257_100011217306 [2,0,0,0,0,0|2,0,0]=4 1537 B7R0.4 CC(C)COCCN 34a_100000210304_100000210624 [2,0,0,0,0,0|1,0,0]=3 1538 B7R0.4 CC(C)COCCO 34a_100000210257_100000211926 [2,0,0,0,0,0|2,0,0]=4 1539 B7R0.4 CC(C)CSCCF 62a_100000210624_100011217306 [2,0,0,0,0,0|2,0,0]=4 1540 B7R0.4 CC(C)CSCCF 62a_100011217306_100000210760 [2,0,0,0,0,0|2,0,0]=4 1541 B7R0.4 CC(C)CSCCO 62a_100000210624_100000211926 [2,0,0,0,0,0|2,0,0]=4 1542 B7R0.4 CC(C)CSCCO 62a_100000211926_100000210760 [2,0,0,0,0,0|2,0,0]=4 1543 B7R0.4 CC(C)NCCCF 2230a_100015189416_100000210206 [2,0,0,0,0,0|2,0,0]=4 1544 B7R0.4 CC(C)NCCCF 2230a_100138425928_100011934791 [2,0,0,0,0,0|2,0,0]=4 1545 B7R0.4 CC(C)NCCCF 34a_100015189416_100000210206 [2,0,0,0,0,0|2,0,0]=4 1546 B7R0.4 CC(C)NCCCF 34a_100138425928_100011934791 [2,0,0,0,0,0|2,0,0]=4 1547 B7R0.4 CC(C)NCCCO 2230a_100138425928_100000230001 [2,0,0,0,0,0|2,0,0]=4 1548 B7R0.4 CC(C)NCCCO 34a_100138425928_100000230001 [2,0,0,0,0,0|2,0,0]=4 1549 B7R0.4 CC(C)NCCO[13CH3] 34a_100000224655_200025704644 [2,0,0,0,0,0|2,0,0]=4 1550 B7R0.4 CC(C)OCCCBr 34a_100011217188_100000210206 [2,0,0,0,0,0|2,0,0]=4 1551 B7R0.4 CC(C)OCCCCl 34a_100000230001_100000210206 [2,0,0,0,0,0|2,0,0]=4 1552 B7R0.4 CC(C)OCCCF 34a_100000212225_100011934791 [2,0,0,0,0,0|2,0,0]=4 1553 B7R0.4 CC(C)OCCCF 34a_100000759539_100000210206 [2,0,0,0,0,0|2,0,0]=4 1554 B7R0.4 CC(C)OCCCN 34a_100000182051_100000210206 [2,0,0,0,0,0|1,0,0]=3 1555 B7R0.4 CC(C)OCCCO 34a_100000212225_100000230001 [2,0,0,0,0,0|2,0,0]=4 1556 B7R0.4 CC(C)OCCN[13CH3] 2230a_100000701111_200025704644 [2,0,0,0,0,0|2,0,0]=4 1557 B7R0.4 CC(C)OCCN[13CH3] 34a_100000701111_200025704644 [2,0,0,0,0,0|2,0,0]=4 1558 B7R0.4 CC(C)OCCON 34a_100000700252_100000210206 [2,0,0,0,0,0|2,0,0]=4 1559 B7R0.4 CC(C)OCCO[13CH3] 34a_100000211219_200025704644 [2,0,0,0,0,0|2,0,0]=4 1560 B7R0.4 CC(C)OCCO[13CH3] 7a_100000211219_200025704644 [2,0,0,0,0,0|2,0,0]=4 1561 B7R0.4 CC(C)OCCS[13CH3] 62a_100000211751_200025704644 [2,0,0,0,0,0|2,0,0]=4 1562 B7R0.4 CC(C)OCCS[13CH3] 62a_200025704644_100000211751 [2,0,0,0,0,0|2,0,0]=4 1563 B7R0.4 CC(C)SCCCF 62a_100000210206_100011934791 [2,0,0,0,0,0|2,0,0]=4 1564 B7R0.4 CC(C)SCCCF 62a_100011934791_100000210206 [2,0,0,0,0,0|2,0,0]=4 1565 B7R0.4 CC(C)SCCCO 62a_100000210206_100011215043 [2,0,0,0,0,0|2,0,0]=4 1566 B7R0.4 CC(C)SCCCO 62a_100011215043_100000210206 [2,0,0,0,0,0|2,0,0]=4 1567 B7R0.4 CC(C)SCCN[13CH3] 2230a_100000731138_200025704644 [2,0,0,0,0,0|2,0,0]=4 1568 B7R0.4 CC(C)SCCN[13CH3] 34a_100000731138_200025704644 [2,0,0,0,0,0|2,0,0]=4 1569 B7R0.4 CC(C)SCCO[13CH3] 34a_200011212901_200025704644 [2,0,0,0,0,0|2,0,0]=4 1570 B7R0.4 CC(C)SCCO[13CH3] 7a_200011212901_200025704644 [2,0,0,0,0,0|2,0,0]=4 1571 B7R0.4 CC(C)SCCS[13CH3] 62a_100000730970_200025704644 [2,0,0,0,0,0|2,0,0]=4 1572 B7R0.4 CC(C)SCCS[13CH3] 62a_200025704644_100000730970 [2,0,0,0,0,0|2,0,0]=4 1573 B7R0.4 CC(F)COCCO 34a_100015925927_100000211926 [2,0,0,0,0,0|2,0,0]=4 1574 B7R0.4 CC(O)CCCS[13CH3] 62a_200000718107_200025704644 [2,0,0,0,0,0|1,0,0]=3 1575 B7R0.4 CC(O)CCCS[13CH3] 62a_200025704644_200000718107 [2,0,0,0,0,0|1,0,0]=3 1576 B7R0.4 CC(O)CCSCF 62a_100012276601_100015361967 [2,0,0,0,0,0|2,0,0]=4 1577 B7R0.4 CC(O)CCSCF 62a_100015361967_100012276601 [2,0,0,0,0,0|2,0,0]=4 1578 B7R0.4 CC(O)CNCCF 2230a_100000210904_100011217306 [2,0,0,0,0,0|2,0,0]=4 1579 B7R0.4 CC(O)CNCCF 34a_100000210904_100011217306 [2,0,0,0,0,0|2,0,0]=4 1580 B7R0.4 CC(O)CNCCF 34a_100000724931_100011218427 [2,0,0,0,0,0|2,0,0]=4 1581 B7R0.4 CC(O)CNCCO 2230a_100000210904_100000211926 [2,0,0,0,0,0|2,0,0]=4 1582 B7R0.4 CC(O)CNCCO 2230a_100016997473_100011218427 [2,0,0,0,0,0|2,0,0]=4 1583 B7R0.4 CC(O)CNCCO 34a_100000210904_100000211926 [2,0,0,0,0,0|2,0,0]=4 1584 B7R0.4 CC(O)CNCCO 34a_100016990907_100011218427 [2,0,0,0,0,0|2,0,0]=4 1585 B7R0.4 CC(O)COCCBr 34a_100000211926_100011218427 [2,0,0,0,0,0|2,0,0]=4 1586 B7R0.4 CC(O)COCCN 34a_100000210304_100011218427 [2,0,0,0,0,0|1,0,0]=3 1587 B7R0.4 CC(O)CSCCF 62a_100011217306_100011218427 [2,0,0,0,0,0|2,0,0]=4 1588 B7R0.4 CC(O)CSCCF 62a_100011218427_100011217306 [2,0,0,0,0,0|2,0,0]=4 1589 B7R0.4 CC(O)CSCCO 62a_100000211926_100011218427 [2,0,0,0,0,0|2,0,0]=4 1590 B7R0.4 CC(O)CSCCO 62a_100011218427_100000211926 [2,0,0,0,0,0|2,0,0]=4 1591 B7R0.4 CCCCCC(=O)C 1458a_100000070787_100000210326 [2,0,0,0,0,0|0,0,2]=4 1592 B7R0.4 CCCCCC(=O)C 1458a_100000212188_200000210301 [2,0,0,0,0,0|0,0,2]=4 1593 B7R0.4 CCCCCC(=O)[13CH3] 1458a_100000212188_200025704644 [2,0,0,0,0,0|0,0,2]=4 1594 B7R0.4 CCCCCN(C)C 2230a_100000223495_200000210301 [2,0,0,0,0,0|1,0,0]=3 1595 B7R0.4 CCCCCN(C)C 2230a_100102631434_100000210326 [2,0,0,0,0,0|1,0,0]=3 1596 B7R0.4 CCCCCN(C)C 269982a_100000223495_200000210301 [2,0,0,0,0,0|1,0,0]=3 1597 B7R0.4 CCCCCN(C)C 269982a_100102631434_100000210215 [2,0,0,0,0,0|1,0,0]=3 1598 B7R0.4 CCCCCN(C)[13CH3] 2230a_100000223495_200025704644 [2,0,0,0,0,0|1,0,0]=3 1599 B7R0.4 CCCCCN(C)[13CH3] 269982a_100000223495_200025704644 [2,0,0,0,0,0|1,0,0]=3 1600 B7R0.4 CCCCNC(C)C 2230a_100000102301_100000210206 [2,0,0,0,0,0|1,0,0]=3 1601 B7R0.4 CCCCNC(C)C 2230a_100138425928_100000210211 [2,0,0,0,0,0|1,0,0]=3 1602 B7R0.4 CCCCNC(C)C 34a_100138425928_100000210210 [2,0,0,0,0,0|1,0,0]=3 1603 B7R0.4 CCCCNC(C)C 7a_106832991798_100000210206 [2,0,0,0,0,0|1,0,0]=3 1604 B7R0.4 CCCCOC(C)C 34a_100000210227_100000210206 [2,0,0,0,0,0|1,0,0]=3 1605 B7R0.4 CCCCOC(C)C 34a_100000212225_100000210210 [2,0,0,0,0,0|1,0,0]=3 1606 B7R0.4 CCCCOC(C)C 7a_100000210227_100000210206 [2,0,0,0,0,0|1,0,0]=3 1607 B7R0.4 CCCCSC(C)C 62a_100000210206_100000210210 [2,0,0,0,0,0|1,0,0]=3 1608 B7R0.4 CCCCSC(C)C 62a_100000210211_100000210206 [2,0,0,0,0,0|1,0,0]=3 1609 B7R0.4 CCCNCC(C)C 2230a_100000210953_100000210303 [2,0,0,0,0,0|1,0,0]=3 1610 B7R0.4 CCCNCC(C)C 270004a_100020643023_100000210432 [2,0,0,0,0,0|1,0,0]=3 1611 B7R0.4 CCCNCC(C)C 34a_100000210953_100000210303 [2,0,0,0,0,0|1,0,0]=3 1612 B7R0.4 CCCNCC(C)O 2230a_100000210904_100000210303 [2,0,0,0,0,0|1,0,0]=3 1613 B7R0.4 CCCNCC(C)O 34a_100000210904_100000210303 [2,0,0,0,0,0|1,0,0]=3 1614 B7R0.4 CCCOCC(C)Br 34a_100012180447_100000210303 [2,0,0,0,0,0|2,0,0]=4 1615 B7R0.4 CCCOCC(C)C 34a_100000210257_100000210303 [2,0,0,0,0,0|1,0,0]=3 1616 B7R0.4 CCCOCC(C)C 34a_100000210258_100000210624 [2,0,0,0,0,0|1,0,0]=3 1617 B7R0.4 CCCOCC(C)F 34a_100015925927_100000210303 [2,0,0,0,0,0|2,0,0]=4 1618 B7R0.4 CCCOCC(C)O 34a_100000210258_100011218427 [2,0,0,0,0,0|1,0,0]=3 1619 B7R0.4 CCCOC[C@@H](C)Cl 34a_100016084084_100000210303 [2,0,0,0,0,0|2,0,0]=4 1620 B7R0.4 CCCOC[C@@H](C)N 34a_100000737577_100000210303 [2,0,0,0,0,0|1,0,0]=3 1621 B7R0.4 CCCOC[C@@H](C)O 34a_100000210258_100009817552 [2,0,0,0,0,0|1,0,0]=3 1622 B7R0.4 CCCSCC(C)C 62a_100000210303_100000210760 [2,0,0,0,0,0|1,0,0]=3 1623 B7R0.4 CCCSCC(C)C 62a_100000210624_100000210303 [2,0,0,0,0,0|1,0,0]=3 1624 B7R0.4 CCCSCC(C)O 62a_100000210303_100011218427 [2,0,0,0,0,0|1,0,0]=3 1625 B7R0.4 CCCSCC(C)O 62a_100011218427_100000210303 [2,0,0,0,0,0|1,0,0]=3 1626 B7R0.4 CCCSC[C@@H](C)O 62a_100000210303_100009817552 [2,0,0,0,0,0|1,0,0]=3 1627 B7R0.4 CCCSC[C@@H](C)O 62a_100009817552_100000210303 [2,0,0,0,0,0|1,0,0]=3 1628 B7R0.4 CCNCCC(C)C 2230a_100015525214_100000210312 [2,0,0,0,0,0|1,0,0]=3 1629 B7R0.4 CCNCCC(C)C 269862a_100015525214_100000185833 [2,0,0,0,0,0|1,0,0]=3 1630 B7R0.4 CCNCCC(C)O 2230a_100015525214_100012276601 [2,0,0,0,0,0|1,0,0]=3 1631 B7R0.4 CCNCCC(C)O 2230a_200000755665_100000210202 [2,0,0,0,0,0|1,0,0]=3 1632 B7R0.4 CCNCOC(C)C 2230a_100015525214_100000709892 [2,0,0,0,0,0|2,0,0]=4 1633 B7R0.4 CCOCCC(C)Br 34a_100009893172_100000210202 [2,0,0,0,0,0|2,0,0]=4 1634 B7R0.4 CCOCCC(C)C 34a_100000210254_100000210202 [2,0,0,0,0,0|1,0,0]=3 1635 B7R0.4 CCOCCC(C)C 34a_100121572206_100000210312 [2,0,0,0,0,0|1,0,0]=3 1636 B7R0.4 CCOCCC(C)C 7a_100000210254_100000210202 [2,0,0,0,0,0|1,0,0]=3 1637 B7R0.4 CCOCCC(C)O 34a_100121572206_100012276601 [2,0,0,0,0,0|1,0,0]=3 1638 B7R0.4 CCOCCN(C)C 2230a_100102631434_100011215890 [2,0,0,0,0,0|2,0,0]=4 1639 B7R0.4 CCOCCN(C)C 269982a_100102631434_100011215890 [2,0,0,0,0,0|2,0,0]=4 1640 B7R0.4 CCOCC[C@@H](C)N 34a_100000706166_100000210202 [2,0,0,0,0,0|1,0,0]=3 1641 B7R0.4 CCOCOC(C)C 34a_100121572206_100000709892 [2,0,0,0,0,0|2,0,0]=4 1642 B7R0.4 CCOCSC(C)C 62a_100000210206_100000739092 [2,0,0,0,0,0|2,0,0]=4 1643 B7R0.4 CCOCSC(C)C 62a_100000739092_100000210206 [2,0,0,0,0,0|2,0,0]=4 1644 B7R0.4 CCSCCC(C)C 62a_100000210202_100000210312 [2,0,0,0,0,0|1,0,0]=3 1645 B7R0.4 CCSCCC(C)C 62a_100000210312_100000210202 [2,0,0,0,0,0|1,0,0]=3 1646 B7R0.4 CCSCCC(C)O 62a_100000210202_100012276601 [2,0,0,0,0,0|1,0,0]=3 1647 B7R0.4 CCSCCC(C)O 62a_100012276601_100000210202 [2,0,0,0,0,0|1,0,0]=3 1648 B7R0.4 CCSCCN(C)C 2230a_100102631434_100000757381 [2,0,0,0,0,0|2,0,0]=4 1649 B7R0.4 CCSCCN(C)C 269982a_100102631434_100000757381 [2,0,0,0,0,0|2,0,0]=4 1650 B7R0.4 CCSCCN(C)C 62a_100000210202_100000755713 [2,0,0,0,0,0|2,0,0]=4 1651 B7R0.4 CCSCOC(C)C 62a_100000210202_100000709892 [2,0,0,0,0,0|2,0,0]=4 1652 B7R0.4 CCSCOC(C)C 62a_100000709892_100000210202 [2,0,0,0,0,0|2,0,0]=4 1653 B7R0.4 CN(C)CCCCF 2230a_100102631434_100000729493 [2,0,0,0,0,0|2,0,0]=4 1654 B7R0.4 CN(C)CCCCF 269982a_100102631434_100000729493 [2,0,0,0,0,0|2,0,0]=4 1655 B7R0.4 CN(C)CCCCO 2230a_100000717598_200000210301 [2,0,0,0,0,0|2,0,0]=4 1656 B7R0.4 CN(C)CCCCO 2230a_100102631434_100000210776 [2,0,0,0,0,0|2,0,0]=4 1657 B7R0.4 CN(C)CCCCO 269982a_100000717598_200000210301 [2,0,0,0,0,0|2,0,0]=4 1658 B7R0.4 CN(C)CCCCO 269982a_100102631434_100000210776 [2,0,0,0,0,0|2,0,0]=4 1659 B7R0.4 CN(C)CCCS[13CH3] 62a_200025704644_100000757444 [2,0,0,0,0,0|2,0,0]=4 1660 B7R0.4 CN([13CH3])CCCCO 2230a_100000717598_200025704644 [2,0,0,0,0,0|2,0,0]=4 1661 B7R0.4 CN([13CH3])CCCCO 269982a_100000717598_200025704644 [2,0,0,0,0,0|2,0,0]=4 1662 B7R0.4 CNCCCC(C)C 2230a_106832991635_100011214892 [2,0,0,0,0,0|1,0,0]=3 1663 B7R0.4 CNCCCC(C)C 2230a_200000737386_200000210301 [2,0,0,0,0,0|1,0,0]=3 1664 B7R0.4 CNCCCC(C)C 34a_100102657272_100011214892 [2,0,0,0,0,0|1,0,0]=3 1665 B7R0.4 CNCCCC(C)C 34a_200000737386_200000210301 [2,0,0,0,0,0|1,0,0]=3 1666 B7R0.4 CNCCCC(C)C 7a_106832991635_100011214892 [2,0,0,0,0,0|1,0,0]=3 1667 B7R0.4 CNCCCC(C)O 2230a_106832991635_200000718107 [2,0,0,0,0,0|1,0,0]=3 1668 B7R0.4 CNCCCC(C)O 34a_100102657272_200000718107 [2,0,0,0,0,0|1,0,0]=3 1669 B7R0.4 CNCCCC(C)O 7a_106832991635_200000718107 [2,0,0,0,0,0|1,0,0]=3 1670 B7R0.4 CNCCCN(C)C 7a_106832991635_100000757444 [2,0,0,0,0,0|2,0,0]=4 1671 B7R0.4 CNCCOC(C)C 2230a_100000701111_200000210301 [2,0,0,0,0,0|2,0,0]=4 1672 B7R0.4 CNCCOC(C)C 2230a_106832991635_100000211751 [2,0,0,0,0,0|2,0,0]=4 1673 B7R0.4 CNCCOC(C)C 34a_100000701111_200000210301 [2,0,0,0,0,0|2,0,0]=4 1674 B7R0.4 CNCCOC(C)C 34a_100102657272_100000211751 [2,0,0,0,0,0|2,0,0]=4 1675 B7R0.4 CNCCOC(C)C 7a_106832991635_100000211751 [2,0,0,0,0,0|2,0,0]=4 1676 B7R0.4 CNCCSC(C)C 2230a_100000731138_200000210301 [2,0,0,0,0,0|2,0,0]=4 1677 B7R0.4 CNCCSC(C)C 2230a_106832991635_100000730970 [2,0,0,0,0,0|2,0,0]=4 1678 B7R0.4 CNCCSC(C)C 34a_100000731138_200000210301 [2,0,0,0,0,0|2,0,0]=4 1679 B7R0.4 CNCCSC(C)C 34a_100102657272_100000730970 [2,0,0,0,0,0|2,0,0]=4 1680 B7R0.4 CNCCSC(C)C 7a_106832991635_100000730970 [2,0,0,0,0,0|2,0,0]=4 1681 B7R0.4 COCCCC(C)C 34a_100000210774_200000210301 [2,0,0,0,0,0|1,0,0]=3 1682 B7R0.4 COCCCC(C)C 34a_100138415774_100011214892 [2,0,0,0,0,0|1,0,0]=3 1683 B7R0.4 COCCCC(C)C 7a_100000210774_200000210301 [2,0,0,0,0,0|1,0,0]=3 1684 B7R0.4 COCCCC(C)O 34a_100138415774_200000718107 [2,0,0,0,0,0|1,0,0]=3 1685 B7R0.4 COCCCN(C)C 2230a_100000224831_200000210301 [2,0,0,0,0,0|2,0,0]=4 1686 B7R0.4 COCCCN(C)C 2230a_100102631434_100000740836 [2,0,0,0,0,0|2,0,0]=4 1687 B7R0.4 COCCCN(C)C 269982a_100000224831_200000210301 [2,0,0,0,0,0|2,0,0]=4 1688 B7R0.4 COCCCN(C)C 269982a_100102631434_100000740836 [2,0,0,0,0,0|2,0,0]=4 1689 B7R0.4 COCCCN(C)[13CH3] 2230a_100000224831_200025704644 [2,0,0,0,0,0|2,0,0]=4 1690 B7R0.4 COCCCN(C)[13CH3] 269982a_100000224831_200025704644 [2,0,0,0,0,0|2,0,0]=4 1691 B7R0.4 COCCNC(C)C 2230a_100000209980_100000210206 [2,0,0,0,0,0|2,0,0]=4 1692 B7R0.4 COCCNC(C)C 2230a_100138425928_100011201679 [2,0,0,0,0,0|2,0,0]=4 1693 B7R0.4 COCCNC(C)C 34a_100000224655_200000210301 [2,0,0,0,0,0|2,0,0]=4 1694 B7R0.4 COCCNC(C)C 34a_100138425928_100011201679 [2,0,0,0,0,0|2,0,0]=4 1695 B7R0.4 COCCOC(C)C 34a_100000210237_100000210206 [2,0,0,0,0,0|2,0,0]=4 1696 B7R0.4 COCCOC(C)C 34a_100000211219_200000210301 [2,0,0,0,0,0|2,0,0]=4 1697 B7R0.4 COCCOC(C)C 34a_100000212225_100011201679 [2,0,0,0,0,0|2,0,0]=4 1698 B7R0.4 COCCOC(C)C 34a_100138415774_100000211751 [2,0,0,0,0,0|2,0,0]=4 1699 B7R0.4 COCCOC(C)C 7a_100000211219_200000210301 [2,0,0,0,0,0|2,0,0]=4 1700 B7R0.4 COCCSC(C)C 34a_100138415774_100000730970 [2,0,0,0,0,0|2,0,0]=4 1701 B7R0.4 COCCSC(C)C 34a_200011212901_200000210301 [2,0,0,0,0,0|2,0,0]=4 1702 B7R0.4 COCCSC(C)C 62a_100000210206_100000233755 [2,0,0,0,0,0|2,0,0]=4 1703 B7R0.4 COCCSC(C)C 62a_100000233755_100000210206 [2,0,0,0,0,0|2,0,0]=4 1704 B7R0.4 COCCSC(C)C 7a_200011212901_200000210301 [2,0,0,0,0,0|2,0,0]=4 1705 B7R0.4 COCNCC(C)C 2230a_100000210953_100000766300 [2,0,0,0,0,0|2,0,0]=4 1706 B7R0.4 COCNCC(C)O 2230a_100000210904_100000766300 [2,0,0,0,0,0|2,0,0]=4 1707 B7R0.4 COCSCC(C)C 62a_100000210624_100000766300 [2,0,0,0,0,0|2,0,0]=4 1708 B7R0.4 COCSCC(C)C 62a_100000766300_100000210760 [2,0,0,0,0,0|2,0,0]=4 1709 B7R0.4 COCSCC(C)O 62a_100000766300_100011218427 [2,0,0,0,0,0|2,0,0]=4 1710 B7R0.4 COCSCC(C)O 62a_100011218427_100000766300 [2,0,0,0,0,0|2,0,0]=4 1711 B7R0.4 COCSC[C@@H](C)O 62a_100000766300_100009817552 [2,0,0,0,0,0|2,0,0]=4 1712 B7R0.4 COCSC[C@@H](C)O 62a_100009817552_100000766300 [2,0,0,0,0,0|2,0,0]=4 1713 B7R0.4 CSCCCC(C)C 62a_100011214892_200000210301 [2,0,0,0,0,0|1,0,0]=3 1714 B7R0.4 CSCCCC(C)C 62a_200000210301_100011214892 [2,0,0,0,0,0|1,0,0]=3 1715 B7R0.4 CSCCCC(C)O 62a_200000210301_200000718107 [2,0,0,0,0,0|1,0,0]=3 1716 B7R0.4 CSCCCC(C)O 62a_200000718107_200000210301 [2,0,0,0,0,0|1,0,0]=3 1717 B7R0.4 CSCCCN(C)C 62a_200000210301_100000757444 [2,0,0,0,0,0|2,0,0]=4 1718 B7R0.4 CSCCNC(C)C 2230a_100020590264_100000210206 [2,0,0,0,0,0|2,0,0]=4 1719 B7R0.4 CSCCNC(C)C 2230a_100138425928_100000751147 [2,0,0,0,0,0|2,0,0]=4 1720 B7R0.4 CSCCNC(C)C 34a_100138425928_100000212216 [2,0,0,0,0,0|2,0,0]=4 1721 B7R0.4 CSCCOC(C)C 34a_100000212225_100000212216 [2,0,0,0,0,0|2,0,0]=4 1722 B7R0.4 CSCCOC(C)C 34a_100000230434_100000210206 [2,0,0,0,0,0|2,0,0]=4 1723 B7R0.4 CSCCOC(C)C 62a_100000211751_200000210301 [2,0,0,0,0,0|2,0,0]=4 1724 B7R0.4 CSCCOC(C)C 62a_200000210301_100000211751 [2,0,0,0,0,0|2,0,0]=4 1725 B7R0.4 CSCCOC(C)C 7a_100000230434_100000210206 [2,0,0,0,0,0|2,0,0]=4 1726 B7R0.4 CSCCSC(C)C 62a_100000210206_100000751147 [2,0,0,0,0,0|2,0,0]=4 1727 B7R0.4 CSCCSC(C)C 62a_100000212216_100000210206 [2,0,0,0,0,0|2,0,0]=4 1728 B7R0.4 CSCCSC(C)C 62a_100000730970_200000210301 [2,0,0,0,0,0|2,0,0]=4 1729 B7R0.4 CSCCSC(C)C 62a_200000210301_100000730970 [2,0,0,0,0,0|2,0,0]=4 1730 B7R0.4 CSCNCC(C)C 2230a_100000210953_100011218213 [2,0,0,0,0,0|2,0,0]=4 1731 B7R0.4 CSCNCC(C)C 34a_100000210953_100011218213 [2,0,0,0,0,0|2,0,0]=4 1732 B7R0.4 CSCNCC(C)O 2230a_100000210904_100011218213 [2,0,0,0,0,0|2,0,0]=4 1733 B7R0.4 CSCNCC(C)O 34a_100000210904_100011218213 [2,0,0,0,0,0|2,0,0]=4 1734 B7R0.4 CSCOCC(C)C 34a_100000210257_100011218213 [2,0,0,0,0,0|2,0,0]=4 1735 B7R0.4 CSCOC[C@@H](C)N 34a_100000737577_100011218213 [2,0,0,0,0,0|2,0,0]=4 1736 B7R0.4 CSCSCC(C)C 62a_100000210624_100011218213 [2,0,0,0,0,0|2,0,0]=4 1737 B7R0.4 CSCSCC(C)C 62a_100011218213_100000210760 [2,0,0,0,0,0|2,0,0]=4 1738 B7R0.4 CSCSCC(C)O 62a_100011218213_100011218427 [2,0,0,0,0,0|2,0,0]=4 1739 B7R0.4 CSCSCC(C)O 62a_100011218427_100011218213 [2,0,0,0,0,0|2,0,0]=4 1740 B7R0.4 CSCSC[C@@H](C)O 62a_100009817552_100011218213 [2,0,0,0,0,0|2,0,0]=4 1741 B7R0.4 CSCSC[C@@H](C)O 62a_100011218213_100009817552 [2,0,0,0,0,0|2,0,0]=4 1742 B7R0.4 C[C@@H](Cl)COCCO 34a_100016084084_100000211926 [2,0,0,0,0,0|2,0,0]=4 1743 B7R0.4 C[C@@H](N)CCOCF 34a_100000706166_100015361967 [2,0,0,0,0,0|2,0,0]=4 1744 B7R0.4 C[C@@H](N)COCCF 34a_100000737577_100011217306 [2,0,0,0,0,0|2,0,0]=4 1745 B7R0.4 C[C@@H](N)COCCO 34a_100000737577_100000211926 [2,0,0,0,0,0|1,0,0]=3 1746 B7R0.4 C[C@@H](O)CNCCF 34a_100000724931_100009817552 [2,0,0,0,0,0|2,0,0]=4 1747 B7R0.4 C[C@@H](O)CNCCO 2230a_100016997473_100009817552 [2,0,0,0,0,0|2,0,0]=4 1748 B7R0.4 C[C@@H](O)CNCCO 34a_100016990907_100009817552 [2,0,0,0,0,0|2,0,0]=4 1749 B7R0.4 C[C@@H](O)COCCBr 34a_100000211926_100009817552 [2,0,0,0,0,0|2,0,0]=4 1750 B7R0.4 C[C@@H](O)COCCN 34a_100000210304_100009817552 [2,0,0,0,0,0|1,0,0]=3 1751 B7R0.4 C[C@@H](O)CSCCF 62a_100009817552_100011217306 [2,0,0,0,0,0|2,0,0]=4 1752 B7R0.4 C[C@@H](O)CSCCF 62a_100011217306_100009817552 [2,0,0,0,0,0|2,0,0]=4 1753 B7R0.4 C[C@@H](O)CSCCO 62a_100000211926_100009817552 [2,0,0,0,0,0|2,0,0]=4 1754 B7R0.4 C[C@@H](O)CSCCO 62a_100009817552_100000211926 [2,0,0,0,0,0|2,0,0]=4 1755 B7R0.4 [13CH3]C(=O)CCCCO 1458a_100000695505_200025704644 [2,0,0,0,0,0|1,0,1]=4 1756 B7R0.8 CC(C)(C)CCN[13CH3] 2230a_100000738805_200025704644 [2,0,0,0,0,0|2,0,0]=4 1757 B7R0.8 CC(C)(C)CCO[13CH3] 7a_100000765024_200025704644 [2,0,0,0,0,0|2,0,0]=4 1758 B7R0.8 CC(C)(C)CCS[13CH3] 62a_100000755188_200025704644 [2,0,0,0,0,0|2,0,0]=4 1759 B7R0.8 CC(C)(C)CCS[13CH3] 62a_200025704644_100000755188 [2,0,0,0,0,0|2,0,0]=4 1760 B7R0.8 CC(C)(C)OCCN 34a_100000210304_100000210625 [2,0,0,0,0,0|2,0,0]=4 1761 B7R0.8 CC(C)(F)CCN[13CH3] 2230a_100016253952_200025704644 [2,0,0,0,0,0|2,0,0]=4 1762 B7R0.8 CC(C)(O)CCS[13CH3] 62a_100000702414_200025704644 [2,0,0,0,0,0|1,0,0]=3 1763 B7R0.8 CC(C)(O)CCS[13CH3] 62a_200025704644_100000702414 [2,0,0,0,0,0|1,0,0]=3 1764 B7R0.8 CC(C)(O)CSCF 62a_100000764493_100015361967 [2,0,0,0,0,0|2,0,0]=4 1765 B7R0.8 CC(C)(O)CSCF 62a_100015361967_100000764493 [2,0,0,0,0,0|2,0,0]=4 1766 B7R0.8 CCCNC(C)(C)C 2230a_100000715429_100000210303 [2,0,0,0,0,0|2,0,0]=4 1767 B7R0.8 CCCOC(C)(C)C 34a_100000210258_100000210625 [2,0,0,0,0,0|2,0,0]=4 1768 B7R0.8 CCCOC(C)(C)C 34a_100015890283_100000210303 [2,0,0,0,0,0|2,0,0]=4 1769 B7R0.8 CCCOC(C)(C)C 7a_100015890283_100000210303 [2,0,0,0,0,0|2,0,0]=4 1770 B7R0.8 CCCSC(C)(C)C 62a_100000210303_100000211941 [2,0,0,0,0,0|2,0,0]=4 1771 B7R0.8 CCCSC(C)(C)C 62a_100000211941_100000210303 [2,0,0,0,0,0|2,0,0]=4 1772 B7R0.8 CCNCC(C)(C)C 2230a_100000743828_100000210202 [2,0,0,0,0,0|2,0,0]=4 1773 B7R0.8 CCNCC(C)(C)C 270004a_100015525214_100011204126 [2,0,0,0,0,0|2,0,0]=4 1774 B7R0.8 CCNCC(C)(C)F 2230a_100020643315_100000210202 [2,0,0,0,0,0|2,0,0]=4 1775 B7R0.8 CCNCC(C)(C)O 2230a_100000751335_100000210202 [2,0,0,0,0,0|1,0,0]=3 1776 B7R0.8 CCOCC(C)(C)C 34a_100121572206_100011219605 [2,0,0,0,0,0|2,0,0]=4 1777 B7R0.8 CCOCC(C)(C)F 34a_100000716592_100000210202 [2,0,0,0,0,0|2,0,0]=4 1778 B7R0.8 CCOCC(C)(C)F 34a_100121572206_100011997219 [2,0,0,0,0,0|2,0,0]=4 1779 B7R0.8 CCOCC(C)(C)O 34a_100121572206_100000764493 [2,0,0,0,0,0|1,0,0]=3 1780 B7R0.8 CCSCC(C)(C)C 62a_100000210202_100011219605 [2,0,0,0,0,0|2,0,0]=4 1781 B7R0.8 CCSCC(C)(C)C 62a_100011219605_100000210202 [2,0,0,0,0,0|2,0,0]=4 1782 B7R0.8 CCSCC(C)(C)F 62a_100000210202_100011997219 [2,0,0,0,0,0|2,0,0]=4 1783 B7R0.8 CCSCC(C)(C)F 62a_100011997219_100000210202 [2,0,0,0,0,0|2,0,0]=4 1784 B7R0.8 CCSCC(C)(C)O 62a_100000210202_100000764493 [2,0,0,0,0,0|1,0,0]=3 1785 B7R0.8 CCSCC(C)(C)O 62a_100000764493_100000210202 [2,0,0,0,0,0|1,0,0]=3 1786 B7R0.8 CNCCC(C)(C)C 2230a_100000738805_200000210301 [2,0,0,0,0,0|2,0,0]=4 1787 B7R0.8 CNCCC(C)(C)C 2230a_106832991635_100000755188 [2,0,0,0,0,0|2,0,0]=4 1788 B7R0.8 CNCCC(C)(C)C 34a_100102657272_100000755188 [2,0,0,0,0,0|2,0,0]=4 1789 B7R0.8 CNCCC(C)(C)C 7a_106832991635_100000755188 [2,0,0,0,0,0|2,0,0]=4 1790 B7R0.8 CNCCC(C)(C)F 2230a_100016253952_200000210301 [2,0,0,0,0,0|2,0,0]=4 1791 B7R0.8 CNCCC(C)(C)O 2230a_106832991635_100000702414 [2,0,0,0,0,0|1,0,0]=3 1792 B7R0.8 CNCCC(C)(C)O 34a_100102657272_100000702414 [2,0,0,0,0,0|1,0,0]=3 1793 B7R0.8 CNCCC(C)(C)O 7a_106832991635_100000702414 [2,0,0,0,0,0|1,0,0]=3 1794 B7R0.8 COCCC(C)(C)C 34a_100138415774_100000755188 [2,0,0,0,0,0|2,0,0]=4 1795 B7R0.8 COCCC(C)(C)C 7a_100000765024_200000210301 [2,0,0,0,0,0|2,0,0]=4 1796 B7R0.8 COCCC(C)(C)O 34a_100138415774_100000702414 [2,0,0,0,0,0|1,0,0]=3 1797 B7R0.8 CSCCC(C)(C)C 62a_100000755188_200000210301 [2,0,0,0,0,0|2,0,0]=4 1798 B7R0.8 CSCCC(C)(C)C 62a_200000210301_100000755188 [2,0,0,0,0,0|2,0,0]=4 1799 B7R0.8 CSCCC(C)(C)O 62a_100000702414_200000210301 [2,0,0,0,0,0|1,0,0]=3 1800 B7R0.8 CSCCC(C)(C)O 62a_200000210301_100000702414 [2,0,0,0,0,0|1,0,0]=3 1801 B9R0.3 CC(C)(O)C(=O)CCCF 1458a_100000242741_100011934791 [1,1,0,0,0,0|1,0,1]=4 1802 B9R0.3 CC(C)(O)C(=O)CCCO 1458a_100000242741_100011215043 [1,1,0,0,0,0|1,0,1]=4 1803 B9R0.3 CC(NCCF)C(C)(C)O 269862a_100000724931_100000747739 [1,1,0,0,0,0|2,0,0]=4 1804 B9R0.3 CC(NCCO)C(C)(C)O 269862a_100000210304_100000747739 [1,1,0,0,0,0|2,0,0]=4 1805 B9R0.3 CCCCC(=O)C(C)(C)C 1458a_106744555173_100000210211 [1,1,0,0,0,0|1,0,1]=4 1806 B9R0.3 CCCCC(=O)C(C)(C)F 1458a_100000765255_100000210211 [1,1,0,0,0,0|1,0,1]=4 1807 B9R0.3 CCCCC(=O)C(C)(C)O 1458a_100000242741_100000210211 [1,1,0,0,0,0|0,0,1]=3 1808 B9R0.3 CCCCN(C)C(C)(C)C 269982a_100000207549_100000210625 [1,1,0,0,0,0|2,0,0]=4 1809 B9R0.3 CCCCN(C)C(C)(C)C 269982a_100011215553_100000210211 [1,1,0,0,0,0|2,0,0]=4 1810 B9R0.3 CCCNC(=O)C(C)(C)O 240690a_100020643023_100000242741 [1,1,0,0,0,0|1,0,1]=4 1811 B9R0.3 CCCNC(C)C(C)(C)O 269862a_100020643023_100000747739 [1,1,0,0,0,0|1,0,0]=3 1812 B9R0.3 CCCN[C@@H](C)C(C)(C)O 2230a_100025708725_100000210303 [1,1,0,0,0,0|1,0,0]=3 1813 B9R0.3 CCCN[C@H](C)C(C)(C)C 2230a_100025703359_100000210303 [1,1,0,0,0,0|2,0,0]=4 1814 B9R0.3 COCCC(=O)C(C)(C)O 1458a_100000242741_100000233755 [1,1,0,0,0,0|1,0,1]=4 1815 B9R0.3 COCN[C@@H](C)C(C)(C)O 2230a_100025708725_100000766300 [1,1,0,0,0,0|2,0,0]=4 1816 B9R0.3 CSCCC(=O)C(C)(C)O 1458a_100000242741_100000751147 [1,1,0,0,0,0|1,0,1]=4 1817 B9R0.3 CSCN[C@@H](C)C(C)(C)O 2230a_100025708725_100011218213 [1,1,0,0,0,0|2,0,0]=4 1818 B9R0.3 C[C@H](NCCF)C(C)(C)O 2230a_100025708725_100011217306 [1,1,0,0,0,0|2,0,0]=4 1819 B9R0.3 C[C@H](NCCO)C(C)(C)O 2230a_100025708725_100000211926 [1,1,0,0,0,0|2,0,0]=4 1820 B9R0.20 C#CC(C)(C)NCCCC 34a_100000054563_100000210210 [1,1,0,0,0,0|2,0,0]=4 1821 B9R0.20 C#CC(C)(C)OCCCC 34a_100000189450_100000210210 [1,1,0,0,0,0|2,0,0]=4 1822 B9R0.20 C#CC(C)(C)OCCCC 34a_100000210227_100000038118 [1,1,0,0,0,0|2,0,0]=4 1823 B9R0.20 C#CC(C)(C)OCCCC 7a_100000189450_100000210211 [1,1,0,0,0,0|2,0,0]=4 1824 B9R0.20 C#CC(C)(C)OCCCN 34a_100000182051_100000038118 [1,1,0,0,0,0|2,0,0]=4 1825 B9R0.20 C#CC(C)(C)SCCCC 62a_100000038118_100000210210 [1,1,0,0,0,0|2,0,0]=4 1826 B9R0.20 C#CC(C)(C)SCCCC 62a_100000210211_100000038118 [1,1,0,0,0,0|2,0,0]=4 1827 B9R0.20 C=CC(C)(C)OCCCC 34a_100011215311_100000210210 [1,1,0,0,0,0|2,0,0]=4 1828 B9R0.20 C=CC(C)(C)OCCCC 7a_100011215311_100000210211 [1,1,0,0,0,0|2,0,0]=4 1829 B9R0.20 CC(C)(C#N)CCCS[13CH3] 62a_100000759902_200025704644 [1,1,0,0,0,0|2,0,0]=4 1830 B9R0.20 CC(C)(C#N)CCCS[13CH3] 62a_200025704644_100000759902 [1,1,0,0,0,0|2,0,0]=4 1831 B9R0.20 CC(C)(C#N)OCCCN 34a_100000182051_100011162410 [1,1,0,0,0,0|2,0,0]=4 1832 B9R0.20 CC(C)(CO)CCCN[13CH3] 2230a_100000039164_200025704644 [1,1,0,0,0,0|1,0,0]=3 1833 B9R0.20 CC(C)(CO)CNCCF 2230a_100020635058_100011217306 [1,1,0,0,0,0|2,0,0]=4 1834 B9R0.20 CC(C)(CO)CNCCF 34a_100000724931_100009813988 [1,1,0,0,0,0|2,0,0]=4 1835 B9R0.20 CC(C)(CO)CNCCO 2230a_100020635058_100000211926 [1,1,0,0,0,0|2,0,0]=4 1836 B9R0.20 CC(C)(CO)CNCCO 34a_100016990907_100009813988 [1,1,0,0,0,0|2,0,0]=4 1837 B9R0.20 CC(C)(CO)COCCBr 34a_100000211926_100009813988 [1,1,0,0,0,0|2,0,0]=4 1838 B9R0.20 CC(C)(CO)COCCN 34a_100000210304_100009813988 [1,1,0,0,0,0|1,0,0]=3 1839 B9R0.20 CC(C)(CO)CSCCF 62a_100009813988_100011217306 [1,1,0,0,0,0|2,0,0]=4 1840 B9R0.20 CC(C)(CO)CSCCF 62a_100011217306_100009813988 [1,1,0,0,0,0|2,0,0]=4 1841 B9R0.20 CC(C)(CO)CSCCO 62a_100000211926_100009813988 [1,1,0,0,0,0|2,0,0]=4 1842 B9R0.20 CC(C)(CO)CSCCO 62a_100009813988_100000211926 [1,1,0,0,0,0|2,0,0]=4 1843 B9R0.20 CC(C)(CO)NCCCF 2230a_100000210608_100011934791 [1,1,0,0,0,0|2,0,0]=4 1844 B9R0.20 CC(C)(CO)NCCCO 2230a_100000210608_100000230001 [1,1,0,0,0,0|2,0,0]=4 1845 B9R0.20 CCCCNC(C)(C)C#N 7a_106832991798_100011162410 [1,1,0,0,0,0|2,0,0]=4 1846 B9R0.20 CCCCNC(C)(C)CC 2230a_100000211385_100000210211 [1,1,0,0,0,0|2,0,0]=4 1847 B9R0.20 CCCCNC(C)(C)CC 7a_106832991798_100000210677 [1,1,0,0,0,0|2,0,0]=4 1848 B9R0.20 CCCCNC(C)(C)CO 2230a_100000210608_100000210211 [1,1,0,0,0,0|1,0,0]=3 1849 B9R0.20 CCCCOC(C)(C)C#N 34a_100000210227_100011162410 [1,1,0,0,0,0|2,0,0]=4 1850 B9R0.20 CCCCOC(C)(C)C#N 34a_200015195151_100000210210 [1,1,0,0,0,0|2,0,0]=4 1851 B9R0.20 CCCCOC(C)(C)C#N 7a_100000210227_100011162410 [1,1,0,0,0,0|2,0,0]=4 1852 B9R0.20 CCCCOC(C)(C)CC 7a_100000210227_100000210677 [1,1,0,0,0,0|2,0,0]=4 1853 B9R0.20 CCCCOC(C)(C)CC 7a_100000210230_100000210211 [1,1,0,0,0,0|2,0,0]=4 1854 B9R0.20 CCCCOC(C)(C)CCl 7a_100000764493_100000210211 [1,1,0,0,0,0|2,0,0]=4 1855 B9R0.20 CCCCSC(C)(C)C#N 62a_100000210211_100011162410 [1,1,0,0,0,0|2,0,0]=4 1856 B9R0.20 CCCCSC(C)(C)C#N 62a_100011162410_100000210210 [1,1,0,0,0,0|2,0,0]=4 1857 B9R0.20 CCCCSC(C)(C)CC 62a_100000032637_100000210210 [1,1,0,0,0,0|2,0,0]=4 1858 B9R0.20 CCCCSC(C)(C)CC 62a_100000210211_100000032637 [1,1,0,0,0,0|2,0,0]=4 1859 B9R0.20 CCCNCC(C)(C)CO 2230a_100020635058_100000210303 [1,1,0,0,0,0|1,0,0]=3 1860 B9R0.20 CCCNCC(C)(C)OC 2230a_100000763424_100000210303 [1,1,0,0,0,0|1,0,0]=3 1861 B9R0.20 CCCNCC(C)(C)SC 270004a_100020643023_100009845794 [1,1,0,0,0,0|1,1,0]=4 1862 B9R0.20 CCCOCC(C)(C)CC 7a_100000765029_100000210303 [1,1,0,0,0,0|2,0,0]=4 1863 B9R0.20 CCCOCC(C)(C)CCl 7a_100011217199_100000210303 [1,1,0,0,0,0|2,0,0]=4 1864 B9R0.20 CCCOCC(C)(C)CO 34a_100000210258_100009813988 [1,1,0,0,0,0|1,0,0]=3 1865 B9R0.20 CCCOCC(C)(C)OC 34a_100000210258_100000701081 [1,1,0,0,0,0|1,0,0]=3 1866 B9R0.20 CCCSCC(C)(C)CO 62a_100000210303_100009813988 [1,1,0,0,0,0|1,0,0]=3 1867 B9R0.20 CCCSCC(C)(C)CO 62a_100009813988_100000210303 [1,1,0,0,0,0|1,0,0]=3 1868 B9R0.20 CCCSCC(C)(C)OC 62a_100000210303_100000701081 [1,1,0,0,0,0|1,0,0]=3 1869 B9R0.20 CCCSCC(C)(C)OC 62a_100000701081_100000210303 [1,1,0,0,0,0|1,0,0]=3 1870 B9R0.20 CCOCCC(C)(C)OC 7a_100000699976_100000210202 [1,1,0,0,0,0|1,0,0]=3 1871 B9R0.20 CNCCCC(C)(C)C#N 2230a_106832991635_100000759902 [1,1,0,0,0,0|2,0,0]=4 1872 B9R0.20 CNCCCC(C)(C)C#N 34a_100102657272_100000759902 [1,1,0,0,0,0|2,0,0]=4 1873 B9R0.20 CNCCCC(C)(C)C#N 7a_106832991635_100000759902 [1,1,0,0,0,0|2,0,0]=4 1874 B9R0.20 CNCCCC(C)(C)CO 2230a_100000039164_200000210301 [1,1,0,0,0,0|1,0,0]=3 1875 B9R0.20 COC(C)(C)CCOCF 7a_100000699976_100015361967 [1,1,0,0,0,0|2,0,0]=4 1876 B9R0.20 COC(C)(C)CNCCF 2230a_100000763424_100011217306 [1,1,0,0,0,0|2,0,0]=4 1877 B9R0.20 COC(C)(C)CNCCF 34a_100000724931_100000701081 [1,1,0,0,0,0|2,0,0]=4 1878 B9R0.20 COC(C)(C)CNCCO 2230a_100000763424_100000211926 [1,1,0,0,0,0|2,0,0]=4 1879 B9R0.20 COC(C)(C)CNCCO 34a_100016990907_100000701081 [1,1,0,0,0,0|2,0,0]=4 1880 B9R0.20 COC(C)(C)CNCSC 2230a_100000763424_100011218213 [1,1,0,0,0,0|2,0,0]=4 1881 B9R0.20 COC(C)(C)COCCBr 34a_100000211926_100000701081 [1,1,0,0,0,0|2,0,0]=4 1882 B9R0.20 COC(C)(C)COCCN 34a_100000210304_100000701081 [1,1,0,0,0,0|1,0,0]=3 1883 B9R0.20 COC(C)(C)CSCCF 62a_100000701081_100011217306 [1,1,0,0,0,0|2,0,0]=4 1884 B9R0.20 COC(C)(C)CSCCF 62a_100011217306_100000701081 [1,1,0,0,0,0|2,0,0]=4 1885 B9R0.20 COC(C)(C)CSCCO 62a_100000211926_100000701081 [1,1,0,0,0,0|2,0,0]=4 1886 B9R0.20 COC(C)(C)CSCCO 62a_100000701081_100000211926 [1,1,0,0,0,0|2,0,0]=4 1887 B9R0.20 COC(C)(C)CSCSC 62a_100000701081_100011218213 [1,1,0,0,0,0|2,0,0]=4 1888 B9R0.20 COC(C)(C)CSCSC 62a_100011218213_100000701081 [1,1,0,0,0,0|2,0,0]=4 1889 B9R0.20 COCCCC(C)(C)C#N 34a_100138415774_100000759902 [1,1,0,0,0,0|2,0,0]=4 1890 B9R0.20 COCCNC(C)(C)CO 2230a_100000210608_100011201679 [1,1,0,0,0,0|2,0,0]=4 1891 B9R0.20 COCNCC(C)(C)CO 2230a_100020635058_100000766300 [1,1,0,0,0,0|2,0,0]=4 1892 B9R0.20 COCNCC(C)(C)OC 2230a_100000763424_100000766300 [1,1,0,0,0,0|2,0,0]=4 1893 B9R0.20 COCSCC(C)(C)CO 62a_100000766300_100009813988 [1,1,0,0,0,0|2,0,0]=4 1894 B9R0.20 COCSCC(C)(C)CO 62a_100009813988_100000766300 [1,1,0,0,0,0|2,0,0]=4 1895 B9R0.20 COCSCC(C)(C)OC 62a_100000701081_100000766300 [1,1,0,0,0,0|2,0,0]=4 1896 B9R0.20 COCSCC(C)(C)OC 62a_100000766300_100000701081 [1,1,0,0,0,0|2,0,0]=4 1897 B9R0.20 CSCCCC(C)(C)C#N 62a_100000759902_200000210301 [1,1,0,0,0,0|2,0,0]=4 1898 B9R0.20 CSCCCC(C)(C)C#N 62a_200000210301_100000759902 [1,1,0,0,0,0|2,0,0]=4 1899 B9R0.20 CSCCNC(C)(C)CO 2230a_100000210608_100000751147 [1,1,0,0,0,0|2,0,0]=4 1900 B9R0.20 CSCNCC(C)(C)CO 2230a_100020635058_100011218213 [1,1,0,0,0,0|2,0,0]=4 1901 B9R0.20 CSCSCC(C)(C)CO 62a_100009813988_100011218213 [1,1,0,0,0,0|2,0,0]=4 1902 B9R0.20 CSCSCC(C)(C)CO 62a_100011218213_100009813988 [1,1,0,0,0,0|2,0,0]=4 1903 B9R0.21 CC(C)(C)OC[C@H](F)CN 34a_100015665980_100000210625 [1,1,0,0,0,0|2,0,0]=4 1904 B9R0.21 CC(CF)OCC(C)(C)O 34a_100016041109_100000764493 [1,1,0,0,0,0|2,0,0]=4 1905 B9R0.21 CC(CF)OCC(C)(C)O 7a_100016041109_100000764493 [1,1,0,0,0,0|2,0,0]=4 1906 B9R0.21 CC(CN)COC(C)(C)C 34a_100000744482_100000210625 [1,1,0,0,0,0|2,0,0]=4 1907 B9R0.21 CC(CN)OCC(C)(C)C 34a_100000210904_100011219605 [1,1,0,0,0,0|2,0,0]=4 1908 B9R0.21 CC(CN)OCC(C)(C)F 34a_100000210904_100011997219 [1,1,0,0,0,0|2,0,0]=4 1909 B9R0.21 CC(CN)OCC(C)(C)O 34a_100000210904_100000764493 [1,1,0,0,0,0|1,0,0]=3 1910 B9R0.21 CC(CO)NCC(C)(C)O 2230a_100000751335_100012180447 [1,1,0,0,0,0|2,0,0]=4 1911 B9R0.21 CC(CO)SCC(C)(C)O 62a_100012180447_100000764493 [1,1,0,0,0,0|2,0,0]=4 1912 B9R0.21 CCC(=O)CCC(C)(C)C 1458a_100000210414_100000755188 [1,1,0,0,0,0|1,0,1]=4 1913 B9R0.21 CCC(=O)CCC(C)(C)C 1458a_100000757465_100000210202 [1,1,0,0,0,0|1,0,1]=4 1914 B9R0.21 CCC(=O)NCC(C)(C)O 1626a_100000751335_100000210414 [1,1,0,0,0,0|1,0,1]=4 1915 B9R0.21 CCC(=O)NCC(C)(C)O 240690a_100000751335_100000210414 [1,1,0,0,0,0|1,0,1]=4 1916 B9R0.21 CCC(=O)NCC(C)(C)O 527a_100000751335_100000210414 [1,1,0,0,0,0|1,0,1]=4 1917 B9R0.21 CCC(C)CNC(C)(C)C 2230a_100000715429_100000748023 [1,1,0,0,0,0|2,0,0]=4 1918 B9R0.21 CCC(C)COC(C)(C)C 34a_100015890283_100000748023 [1,1,0,0,0,0|2,0,0]=4 1919 B9R0.21 CCC(C)COC(C)(C)C 7a_100015890283_100000748023 [1,1,0,0,0,0|2,0,0]=4 1920 B9R0.21 CCC(C)CSC(C)(C)C 62a_100000211941_100000748023 [1,1,0,0,0,0|2,0,0]=4 1921 B9R0.21 CCC(C)CSC(C)(C)C 62a_100000748023_100000211941 [1,1,0,0,0,0|2,0,0]=4 1922 B9R0.21 CCC(C)NCC(C)(C)C 2230a_100000743828_100000758301 [1,1,0,0,0,0|2,0,0]=4 1923 B9R0.21 CCC(C)NCC(C)(C)C 270004a_100000209981_100011204126 [1,1,0,0,0,0|2,0,0]=4 1924 B9R0.21 CCC(C)NCC(C)(C)F 2230a_100020643315_100000758301 [1,1,0,0,0,0|2,0,0]=4 1925 B9R0.21 CCC(C)NCC(C)(C)O 2230a_100000751335_100000758301 [1,1,0,0,0,0|1,0,0]=3 1926 B9R0.21 CCC(C)OCC(C)(C)F 34a_100000716592_100011215416 [1,1,0,0,0,0|2,0,0]=4 1927 B9R0.21 CCC(C)OCC(C)(C)O 7a_100000210228_100000764493 [1,1,0,0,0,0|1,0,0]=3 1928 B9R0.21 CCC(C)SCC(C)(C)C 62a_100000758301_100011219605 [1,1,0,0,0,0|2,0,0]=4 1929 B9R0.21 CCC(C)SCC(C)(C)C 62a_100011219605_100000758301 [1,1,0,0,0,0|2,0,0]=4 1930 B9R0.21 CCC(C)SCC(C)(C)F 62a_100000758301_100011997219 [1,1,0,0,0,0|2,0,0]=4 1931 B9R0.21 CCC(C)SCC(C)(C)F 62a_100011997219_100000758301 [1,1,0,0,0,0|2,0,0]=4 1932 B9R0.21 CCC(C)SCC(C)(C)O 62a_100000758301_100000764493 [1,1,0,0,0,0|1,0,0]=3 1933 B9R0.21 CCC(C)SCC(C)(C)O 62a_100000764493_100000758301 [1,1,0,0,0,0|1,0,0]=3 1934 B9R0.21 CCC(O)CNC(C)(C)C 2230a_100000715429_100011218378 [1,1,0,0,0,0|2,0,0]=4 1935 B9R0.21 CCC(O)COC(C)(C)C 34a_100015890283_100011218378 [1,1,0,0,0,0|2,0,0]=4 1936 B9R0.21 CCC(O)COC(C)(C)C 7a_100015890283_100011218378 [1,1,0,0,0,0|2,0,0]=4 1937 B9R0.21 CCC(O)CSC(C)(C)C 62a_100000211941_100011218378 [1,1,0,0,0,0|2,0,0]=4 1938 B9R0.21 CCC(O)CSC(C)(C)C 62a_100011218378_100000211941 [1,1,0,0,0,0|2,0,0]=4 1939 B9R0.21 CCN(C)CCC(C)(C)C 2230a_100000225621_100000755188 [1,1,0,0,0,0|2,0,0]=4 1940 B9R0.21 CCN(C)CCC(C)(C)C 269982a_100000225621_100000755188 [1,1,0,0,0,0|2,0,0]=4 1941 B9R0.21 CCN(C)CCC(C)(C)O 2230a_100000225621_100000702414 [1,1,0,0,0,0|1,0,0]=3 1942 B9R0.21 CC[C@H](C)CNC(C)(C)C 2230a_100000715429_100009816398 [1,1,0,0,0,0|2,0,0]=4 1943 B9R0.21 CC[C@H](C)COC(C)(C)C 34a_100015890283_100009816398 [1,1,0,0,0,0|2,0,0]=4 1944 B9R0.21 CC[C@H](C)COC(C)(C)C 7a_100015890283_100009816398 [1,1,0,0,0,0|2,0,0]=4 1945 B9R0.21 CC[C@H](C)CSC(C)(C)C 62a_100000211941_100009816398 [1,1,0,0,0,0|2,0,0]=4 1946 B9R0.21 CC[C@H](C)CSC(C)(C)C 62a_100009816398_100000211941 [1,1,0,0,0,0|2,0,0]=4 1947 B9R0.21 COC(C)SCC(C)(C)O 62a_100000764493_100009879195 [1,1,0,0,0,0|2,0,0]=4 1948 B9R0.21 COC(C)SCC(C)(C)O 62a_100009879195_100000764493 [1,1,0,0,0,0|2,0,0]=4 1949 B9R0.21 C[C@H](CO)SCC(C)(C)O 62a_100000764493_100016084084 [1,1,0,0,0,0|2,0,0]=4 1950 B9R0.21 C[C@H](CO)SCC(C)(C)O 62a_100016084084_100000764493 [1,1,0,0,0,0|2,0,0]=4 1951 B9R0.38 C#CCCNCC(C)(C)O 2230a_100000751335_100000688953 [1,1,0,0,0,0|0,0,2]=4 1952 B9R0.38 C#CCCNCC(C)(C)O 34a_100000755551_100000764493 [1,1,0,0,0,0|0,0,2]=4 1953 B9R0.38 C#CCCOCC(C)(C)O 34a_100011215631_100000764493 [1,1,0,0,0,0|0,0,2]=4 1954 B9R0.38 C#CCCSCC(C)(C)O 62a_100000688953_100000764493 [1,1,0,0,0,0|0,0,2]=4 1955 B9R0.38 C#CCCSCC(C)(C)O 62a_100000764493_100000688953 [1,1,0,0,0,0|0,0,2]=4 1956 B9R0.38 C#CCNCCC(C)(C)O 34a_100000212058_100000702414 [1,1,0,0,0,0|0,0,2]=4 1957 B9R0.38 C#CCOCCC(C)(C)O 34a_100000210247_100000702414 [1,1,0,0,0,0|0,0,2]=4 1958 B9R0.38 C#CCSCCC(C)(C)O 62a_100000038162_100000702414 [1,1,0,0,0,0|0,0,2]=4 1959 B9R0.38 C/C=C/COCC(C)(C)O 34a_100016270725_100000764493 [1,1,0,0,0,0|0,0,2]=4 1960 B9R0.38 C/C=C/CSCC(C)(C)O 62a_100000764493_100102629194 [1,1,0,0,0,0|0,0,2]=4 1961 B9R0.38 C/C=C/CSCC(C)(C)O 62a_100102629194_100000764493 [1,1,0,0,0,0|0,0,2]=4 1962 B9R0.38 C=CCCNCC(C)(C)O 2230a_100000751335_100000754431 [1,1,0,0,0,0|0,0,2]=4 1963 B9R0.38 C=CCCOCC(C)(C)O 34a_100011205117_100000764493 [1,1,0,0,0,0|0,0,2]=4 1964 B9R0.38 C=CCCSCC(C)(C)O 62a_100000754431_100000764493 [1,1,0,0,0,0|0,0,2]=4 1965 B9R0.38 C=CCCSCC(C)(C)O 62a_100000764493_100000754431 [1,1,0,0,0,0|0,0,2]=4 1966 B9R0.38 C=CCNCCC(C)(C)O 2230a_100020586998_100000702414 [1,1,0,0,0,0|0,0,2]=4 1967 B9R0.38 C=CCOCCC(C)(C)O 34a_200000210373_100000702414 [1,1,0,0,0,0|0,0,2]=4 1968 B9R0.38 C=CCSCCC(C)(C)O 62a_100000210623_100000702414 [1,1,0,0,0,0|0,0,2]=4 1969 B9R0.38 C=CCSCCC(C)(C)O 62a_100000702414_100000210623 [1,1,0,0,0,0|0,0,2]=4 1970 B9R0.38 CC#CCNCC(C)(C)O 2230a_100000751335_100000748600 [1,1,0,0,0,0|0,0,2]=4 1971 B9R0.38 CC#CCNCC(C)(C)O 34a_100000685387_100000764493 [1,1,0,0,0,0|0,0,2]=4 1972 B9R0.38 CC#CCOCC(C)(C)O 34a_100000761923_100000764493 [1,1,0,0,0,0|0,0,2]=4 1973 B9R0.38 CC#CCSCC(C)(C)O 62a_100000748600_100000764493 [1,1,0,0,0,0|0,0,2]=4 1974 B9R0.38 CC#CCSCC(C)(C)O 62a_100000764493_100000748600 [1,1,0,0,0,0|0,0,2]=4 1975 B9R0.38 CC(C)(C)CCNCCF 2230a_100000738805_100011217306 [1,1,0,0,0,0|2,0,0]=4 1976 B9R0.38 CC(C)(C)CCNCCF 34a_100000724931_100000755188 [1,1,0,0,0,0|2,0,0]=4 1977 B9R0.38 CC(C)(C)CCNCCO 2230a_100000738805_100000211926 [1,1,0,0,0,0|2,0,0]=4 1978 B9R0.38 CC(C)(C)CCNCCO 2230a_100016997473_100000755188 [1,1,0,0,0,0|2,0,0]=4 1979 B9R0.38 CC(C)(C)CCNCCO 34a_100016990907_100000755188 [1,1,0,0,0,0|2,0,0]=4 1980 B9R0.38 CC(C)(C)CCOCCBr 34a_100000211926_100000755188 [1,1,0,0,0,0|2,0,0]=4 1981 B9R0.38 CC(C)(C)CCOCCF 7a_100000765024_100011217306 [1,1,0,0,0,0|2,0,0]=4 1982 B9R0.38 CC(C)(C)CCOCCN 34a_100000210304_100000755188 [1,1,0,0,0,0|1,0,0]=3 1983 B9R0.38 CC(C)(C)CCOCCO 7a_100000765024_100000211926 [1,1,0,0,0,0|2,0,0]=4 1984 B9R0.38 CC(C)(C)CCSCCF 62a_100000755188_100011217306 [1,1,0,0,0,0|2,0,0]=4 1985 B9R0.38 CC(C)(C)CCSCCF 62a_100011217306_100000755188 [1,1,0,0,0,0|2,0,0]=4 1986 B9R0.38 CC(C)(C)CCSCCO 62a_100000211926_100000755188 [1,1,0,0,0,0|2,0,0]=4 1987 B9R0.38 CC(C)(C)CCSCCO 62a_100000755188_100000211926 [1,1,0,0,0,0|2,0,0]=4 1988 B9R0.38 CC(C)(C)CNCCCF 2230a_100000743828_100011934791 [1,1,0,0,0,0|2,0,0]=4 1989 B9R0.38 CC(C)(C)CNCCCF 270004a_100015189416_100011204126 [1,1,0,0,0,0|2,0,0]=4 1990 B9R0.38 CC(C)(C)CNCCCF 34a_100015189416_100011219605 [1,1,0,0,0,0|2,0,0]=4 1991 B9R0.38 CC(C)(C)CNCCCO 2230a_100000743828_100000230001 [1,1,0,0,0,0|2,0,0]=4 1992 B9R0.38 CC(C)(C)CNCCCO 270004a_100000182051_100011204126 [1,1,0,0,0,0|2,0,0]=4 1993 B9R0.38 CC(C)(C)COCCCBr 34a_100011217188_100011219605 [1,1,0,0,0,0|2,0,0]=4 1994 B9R0.38 CC(C)(C)COCCCCl 34a_100000230001_100011219605 [1,1,0,0,0,0|2,0,0]=4 1995 B9R0.38 CC(C)(C)COCCCF 34a_100000759539_100011219605 [1,1,0,0,0,0|2,0,0]=4 1996 B9R0.38 CC(C)(C)COCCCN 34a_100000182051_100011219605 [1,1,0,0,0,0|1,0,0]=3 1997 B9R0.38 CC(C)(C)COCCON 34a_100000700252_100011219605 [1,1,0,0,0,0|2,0,0]=4 1998 B9R0.38 CC(C)(C)CSCCCF 62a_100011219605_100011934791 [1,1,0,0,0,0|2,0,0]=4 1999 B9R0.38 CC(C)(C)CSCCCF 62a_100011934791_100011219605 [1,1,0,0,0,0|2,0,0]=4 2000 B9R0.38 CC(C)(C)CSCCCO 62a_100011215043_100011219605 [1,1,0,0,0,0|2,0,0]=4 2001 B9R0.38 CC(C)(C)CSCCCO 62a_100011219605_100011215043 [1,1,0,0,0,0|2,0,0]=4 2002 B9R0.38 CC(C)(C)NCCCCF 2230a_100000715429_100000729493 [1,1,0,0,0,0|2,0,0]=4 2003 B9R0.38 CC(C)(C)NCCCCO 2230a_100000715429_100000210776 [1,1,0,0,0,0|2,0,0]=4 2004 B9R0.38 CC(C)(C)NCCCCO 34a_100000750430_100000210625 [1,1,0,0,0,0|2,0,0]=4 2005 B9R0.38 CC(C)(C)OCCCCBr 34a_100011216708_100000210625 [1,1,0,0,0,0|2,0,0]=4 2006 B9R0.38 CC(C)(C)OCCCCCl 34a_100000210776_100000210625 [1,1,0,0,0,0|2,0,0]=4 2007 B9R0.38 CC(C)(C)OCCCCF 34a_100011995726_100000210625 [1,1,0,0,0,0|2,0,0]=4 2008 B9R0.38 CC(C)(C)OCCCCF 34a_100015890283_100000729493 [1,1,0,0,0,0|2,0,0]=4 2009 B9R0.38 CC(C)(C)OCCCCF 7a_100015890283_100000729493 [1,1,0,0,0,0|2,0,0]=4 2010 B9R0.38 CC(C)(C)OCCCCI 34a_200012148704_100000210625 [1,1,0,0,0,0|2,0,0]=4 2011 B9R0.38 CC(C)(C)OCCCCN 34a_100000750430_100000210625 [1,1,0,0,0,0|1,0,0]=3 2012 B9R0.38 CC(C)(C)OCCCCO 34a_100015890283_100011216708 [1,1,0,0,0,0|2,0,0]=4 2013 B9R0.38 CC(C)(C)OCCCCO 7a_100015890283_100000210776 [1,1,0,0,0,0|2,0,0]=4 2014 B9R0.38 CC(C)(C)OCCCN[13CH3] 2230a_100011250582_200025704644 [1,1,0,0,0,0|2,0,0]=4 2015 B9R0.38 CC(C)(C)SCCCCF 62a_100000211941_100000729493 [1,1,0,0,0,0|2,0,0]=4 2016 B9R0.38 CC(C)(C)SCCCCF 62a_100000729493_100000211941 [1,1,0,0,0,0|2,0,0]=4 2017 B9R0.38 CC(C)(C)SCCCCO 62a_100000210776_100000211941 [1,1,0,0,0,0|2,0,0]=4 2018 B9R0.38 CC(C)(C)SCCCCO 62a_100000211941_100000210776 [1,1,0,0,0,0|2,0,0]=4 2019 B9R0.38 CC(C)(F)CCNCCF 2230a_100016253952_100011217306 [1,1,0,0,0,0|2,0,0]=4 2020 B9R0.38 CC(C)(F)CCNCCO 2230a_100016253952_100000211926 [1,1,0,0,0,0|2,0,0]=4 2021 B9R0.38 CC(C)(F)CNCCCF 2230a_100020643315_100011934791 [1,1,0,0,0,0|2,0,0]=4 2022 B9R0.38 CC(C)(F)CNCCCF 34a_100015189416_100011997219 [1,1,0,0,0,0|2,0,0]=4 2023 B9R0.38 CC(C)(F)CNCCCO 2230a_100020643315_100000230001 [1,1,0,0,0,0|2,0,0]=4 2024 B9R0.38 CC(C)(F)COCCCBr 34a_100011217188_100011997219 [1,1,0,0,0,0|2,0,0]=4 2025 B9R0.38 CC(C)(F)COCCCCl 34a_100000230001_100011997219 [1,1,0,0,0,0|2,0,0]=4 2026 B9R0.38 CC(C)(F)COCCCF 34a_100000716592_100011934791 [1,1,0,0,0,0|2,0,0]=4 2027 B9R0.38 CC(C)(F)COCCCF 34a_100000759539_100011997219 [1,1,0,0,0,0|2,0,0]=4 2028 B9R0.38 CC(C)(F)COCCCN 34a_100000182051_100011997219 [1,1,0,0,0,0|1,0,0]=3 2029 B9R0.38 CC(C)(F)COCCCO 34a_100000716592_100000230001 [1,1,0,0,0,0|2,0,0]=4 2030 B9R0.38 CC(C)(F)COCCON 34a_100000700252_100011997219 [1,1,0,0,0,0|2,0,0]=4 2031 B9R0.38 CC(C)(F)CSCCCF 62a_100011934791_100011997219 [1,1,0,0,0,0|2,0,0]=4 2032 B9R0.38 CC(C)(F)CSCCCF 62a_100011997219_100011934791 [1,1,0,0,0,0|2,0,0]=4 2033 B9R0.38 CC(C)(F)CSCCCO 62a_100011215043_100011997219 [1,1,0,0,0,0|2,0,0]=4 2034 B9R0.38 CC(C)(F)CSCCCO 62a_100011997219_100011215043 [1,1,0,0,0,0|2,0,0]=4 2035 B9R0.38 CC(C)(O)CCCSCF 62a_100009888830_100015361967 [1,1,0,0,0,0|1,0,0]=3 2036 B9R0.38 CC(C)(O)CCCSCF 62a_100015361967_100009888830 [1,1,0,0,0,0|1,0,0]=3 2037 B9R0.38 CC(C)(O)CCNCCF 34a_100000724931_100000702414 [1,1,0,0,0,0|1,0,0]=3 2038 B9R0.38 CC(C)(O)CCNCCO 2230a_100016997473_100000702414 [1,1,0,0,0,0|1,0,0]=3 2039 B9R0.38 CC(C)(O)CCNCCO 34a_100016990907_100000702414 [1,1,0,0,0,0|1,0,0]=3 2040 B9R0.38 CC(C)(O)CCOCCBr 34a_100000211926_100000702414 [1,1,0,0,0,0|1,0,0]=3 2041 B9R0.38 CC(C)(O)CCOCCN 34a_100000210304_100000702414 [1,1,0,0,0,0|0,0,0]=2 2042 B9R0.38 CC(C)(O)CCSCC#N 62a_100000702414_100011215382 [1,1,0,0,0,0|0,0,2]=4 2043 B9R0.38 CC(C)(O)CCSCC#N 62a_100011215382_100000702414 [1,1,0,0,0,0|0,0,2]=4 2044 B9R0.38 CC(C)(O)CCSCC=O 62a_100000702414_200015260668 [1,1,0,0,0,0|1,0,1]=4 2045 B9R0.38 CC(C)(O)CCSCC=O 62a_200015260668_100000702414 [1,1,0,0,0,0|1,0,1]=4 2046 B9R0.38 CC(C)(O)CCSCCF 62a_100000702414_100011217306 [1,1,0,0,0,0|1,0,0]=3 2047 B9R0.38 CC(C)(O)CCSCCF 62a_100011217306_100000702414 [1,1,0,0,0,0|1,0,0]=3 2048 B9R0.38 CC(C)(O)CCSCCO 62a_100000211926_100000702414 [1,1,0,0,0,0|1,0,0]=3 2049 B9R0.38 CC(C)(O)CCSCCO 62a_100000702414_100000211926 [1,1,0,0,0,0|1,0,0]=3 2050 B9R0.38 CC(C)(O)CNCCC#N 2230a_100000751335_100011215226 [1,1,0,0,0,0|0,0,2]=4 2051 B9R0.38 CC(C)(O)CNCCCF 2230a_100000751335_100011934791 [1,1,0,0,0,0|1,0,0]=3 2052 B9R0.38 CC(C)(O)CNCCCF 34a_100015189416_100000764493 [1,1,0,0,0,0|1,0,0]=3 2053 B9R0.38 CC(C)(O)CNCCCO 2230a_100000751335_100000230001 [1,1,0,0,0,0|1,0,0]=3 2054 B9R0.38 CC(C)(O)COCCCBr 34a_100011217188_100000764493 [1,1,0,0,0,0|1,0,0]=3 2055 B9R0.38 CC(C)(O)COCCCCl 34a_100000230001_100000764493 [1,1,0,0,0,0|1,0,0]=3 2056 B9R0.38 CC(C)(O)COCCCF 34a_100000759539_100000764493 [1,1,0,0,0,0|1,0,0]=3 2057 B9R0.38 CC(C)(O)COCCCN 34a_100000182051_100000764493 [1,1,0,0,0,0|0,0,0]=2 2058 B9R0.38 CC(C)(O)COCCON 34a_100000700252_100000764493 [1,1,0,0,0,0|1,0,0]=3 2059 B9R0.38 CC(C)(O)CSCCC#N 62a_100000764493_100011215226 [1,1,0,0,0,0|0,0,2]=4 2060 B9R0.38 CC(C)(O)CSCCC#N 62a_100011215226_100000764493 [1,1,0,0,0,0|0,0,2]=4 2061 B9R0.38 CC(C)(O)CSCCCF 62a_100000764493_100011934791 [1,1,0,0,0,0|1,0,0]=3 2062 B9R0.38 CC(C)(O)CSCCCF 62a_100011934791_100000764493 [1,1,0,0,0,0|1,0,0]=3 2063 B9R0.38 CC(C)(O)CSCCCO 62a_100000764493_100011215043 [1,1,0,0,0,0|1,0,0]=3 2064 B9R0.38 CC(C)(O)CSCCCO 62a_100011215043_100000764493 [1,1,0,0,0,0|1,0,0]=3 2065 B9R0.38 CC=CCNCC(C)(C)O 2230a_100000751335_100000070051 [1,1,0,0,0,0|0,0,2]=4 2066 B9R0.38 CC=CCSCC(C)(C)O 62a_100000070051_100000764493 [1,1,0,0,0,0|0,0,2]=4 2067 B9R0.38 CC=CCSCC(C)(C)O 62a_100000764493_100000070051 [1,1,0,0,0,0|0,0,2]=4 2068 B9R0.38 CCCCCNC(C)(C)C 2230a_100000715429_100000210326 [1,1,0,0,0,0|1,0,0]=3 2069 B9R0.38 CCCCCOC(C)(C)C 34a_100000210253_100000210625 [1,1,0,0,0,0|1,0,0]=3 2070 B9R0.38 CCCCCOC(C)(C)C 34a_100015890283_100000718602 [1,1,0,0,0,0|1,0,0]=3 2071 B9R0.38 CCCCCOC(C)(C)C 7a_100015890283_100000210326 [1,1,0,0,0,0|1,0,0]=3 2072 B9R0.38 CCCCCSC(C)(C)C 62a_100000210326_100000211941 [1,1,0,0,0,0|1,0,0]=3 2073 B9R0.38 CCCCCSC(C)(C)C 62a_100000211941_100000210326 [1,1,0,0,0,0|1,0,0]=3 2074 B9R0.38 CCCCNCC(C)(C)C 2230a_100000743828_100000210211 [1,1,0,0,0,0|1,0,0]=3 2075 B9R0.38 CCCCNCC(C)(C)C 270004a_100000102301_100011204126 [1,1,0,0,0,0|1,0,0]=3 2076 B9R0.38 CCCCNCC(C)(C)F 2230a_100020643315_100000210211 [1,1,0,0,0,0|1,0,0]=3 2077 B9R0.38 CCCCNCC(C)(C)O 2230a_100000751335_100000210211 [1,1,0,0,0,0|0,0,0]=2 2078 B9R0.38 CCCCNCC(C)(C)O 7a_106832991798_100000764493 [1,1,0,0,0,0|0,0,0]=2 2079 B9R0.38 CCCCNC[Si](C)(C)C 2230a_100000102301_100000037933 [1,1,0,0,0,0|1,1,0]=4 2080 B9R0.38 CCCCNC[Si](C)(C)C 7a_106832991798_100000233785 [1,1,0,0,0,0|1,1,0]=4 2081 B9R0.38 CCCCOCC(C)(C)C 34a_100000210227_100011219605 [1,1,0,0,0,0|1,0,0]=3 2082 B9R0.38 CCCCOCC(C)(C)F 34a_100000210227_100011997219 [1,1,0,0,0,0|1,0,0]=3 2083 B9R0.38 CCCCOCC(C)(C)F 34a_100000716592_100000210210 [1,1,0,0,0,0|1,0,0]=3 2084 B9R0.38 CCCCOCC(C)(C)O 34a_100000210227_100000764493 [1,1,0,0,0,0|0,0,0]=2 2085 B9R0.38 CCCCOCC(C)(C)O 7a_100000210227_100000764493 [1,1,0,0,0,0|0,0,0]=2 2086 B9R0.38 CCCCOCC(C)(F)F 34a_100000068830_100000210210 [1,1,0,0,0,0|2,0,0]=4 2087 B9R0.38 CCCCOC[Si](C)(C)C 7a_100000210227_100000233785 [1,1,0,0,0,0|1,1,0]=4 2088 B9R0.38 CCCCSCC(C)(C)C 62a_100000210211_100011219605 [1,1,0,0,0,0|1,0,0]=3 2089 B9R0.38 CCCCSCC(C)(C)C 62a_100011219605_100000210210 [1,1,0,0,0,0|1,0,0]=3 2090 B9R0.38 CCCCSCC(C)(C)F 62a_100000210211_100011997219 [1,1,0,0,0,0|1,0,0]=3 2091 B9R0.38 CCCCSCC(C)(C)F 62a_100011997219_100000210210 [1,1,0,0,0,0|1,0,0]=3 2092 B9R0.38 CCCCSCC(C)(C)O 62a_100000210211_100000764493 [1,1,0,0,0,0|0,0,0]=2 2093 B9R0.38 CCCCSCC(C)(C)O 62a_100000764493_100000210210 [1,1,0,0,0,0|0,0,0]=2 2094 B9R0.38 CCCCSC[N+](C)(C)C 62a_100000210211_200000036245 [1,1,0,0,0,0|2,0,0]=4 2095 B9R0.38 CCCCSC[N+](C)(C)C 62a_200000036245_100000210210 [1,1,0,0,0,0|2,0,0]=4 2096 B9R0.38 CCCCSC[Si](C)(C)C 62a_100000037933_100000210210 [1,1,0,0,0,0|1,1,0]=4 2097 B9R0.38 CCCCSC[Si](C)(C)C 62a_100000210211_100000037933 [1,1,0,0,0,0|1,1,0]=4 2098 B9R0.38 CCCNCCC(C)(C)C 2230a_100000738805_100000210303 [1,1,0,0,0,0|1,0,0]=3 2099 B9R0.38 CCCNCCC(C)(C)F 2230a_100016253952_100000210303 [1,1,0,0,0,0|1,0,0]=3 2100 B9R0.38 CCCOCCC(C)(C)C 34a_100000210258_100000755188 [1,1,0,0,0,0|1,0,0]=3 2101 B9R0.38 CCCOCCC(C)(C)C 7a_100000765024_100000210303 [1,1,0,0,0,0|1,0,0]=3 2102 B9R0.38 CCCOCCC(C)(C)O 34a_100000210258_100000702414 [1,1,0,0,0,0|0,0,0]=2 2103 B9R0.38 CCCOCC[N+](C)(C)C 34a_100000210258_100000085578 [1,1,0,0,0,0|2,0,0]=4 2104 B9R0.38 CCCOCC[N+](C)(C)C 7a_200020618287_100000210303 [1,1,0,0,0,0|2,0,0]=4 2105 B9R0.38 CCCOCC[Si](C)(C)C 34a_100000210258_200000733723 [1,1,0,0,0,0|1,1,0]=4 2106 B9R0.38 CCCOCC[Si](C)(C)C 7a_100000039746_100000210303 [1,1,0,0,0,0|1,1,0]=4 2107 B9R0.38 CCCSCCC(C)(C)C 62a_100000210303_100000755188 [1,1,0,0,0,0|1,0,0]=3 2108 B9R0.38 CCCSCCC(C)(C)C 62a_100000755188_100000210303 [1,1,0,0,0,0|1,0,0]=3 2109 B9R0.38 CCCSCCC(C)(C)O 62a_100000210303_100000702414 [1,1,0,0,0,0|0,0,0]=2 2110 B9R0.38 CCCSCCC(C)(C)O 62a_100000702414_100000210303 [1,1,0,0,0,0|0,0,0]=2 2111 B9R0.38 CCCSCC[N+](C)(C)C 62a_100000085578_100000210303 [1,1,0,0,0,0|2,0,0]=4 2112 B9R0.38 CCCSCC[N+](C)(C)C 62a_100000210303_100000085578 [1,1,0,0,0,0|2,0,0]=4 2113 B9R0.38 CCCSCC[Si](C)(C)C 62a_100000210303_200000733723 [1,1,0,0,0,0|1,1,0]=4 2114 B9R0.38 CCCSCC[Si](C)(C)C 62a_200000733723_100000210303 [1,1,0,0,0,0|1,1,0]=4 2115 B9R0.38 CCNCCCC(C)(C)O 2230a_100015525214_100009888830 [1,1,0,0,0,0|0,0,0]=2 2116 B9R0.38 CCNCCC[N+](C)(C)C 2230a_100015525214_100016990835 [1,1,0,0,0,0|2,0,0]=4 2117 B9R0.38 CCNCCC[Si](C)(C)C 2230a_100015525214_100011219597 [1,1,0,0,0,0|1,1,0]=4 2118 B9R0.38 CCNCCOC(C)(C)C 2230a_100000747557_100000210202 [1,1,0,0,0,0|2,0,0]=4 2119 B9R0.38 CCNCCSC(C)(C)C 2230a_100000689375_100000210202 [1,1,0,0,0,0|2,0,0]=4 2120 B9R0.38 CCOCCCC(C)(C)O 34a_100121572206_100009888830 [1,1,0,0,0,0|0,0,0]=2 2121 B9R0.38 CCOCCC[N+](C)(C)C 34a_100121572206_100016990835 [1,1,0,0,0,0|2,0,0]=4 2122 B9R0.38 CCOCCC[Si](C)(C)C 34a_100121572206_100011219597 [1,1,0,0,0,0|1,1,0]=4 2123 B9R0.38 CCOCCC[Si](C)(C)C 7a_200011215415_100000210202 [1,1,0,0,0,0|1,1,0]=4 2124 B9R0.38 CCOCCNC(C)(C)C 2230a_100000715429_100011215890 [1,1,0,0,0,0|2,0,0]=4 2125 B9R0.38 CCOCCNC(C)(C)C 34a_102516460346_100000210625 [1,1,0,0,0,0|2,0,0]=4 2126 B9R0.38 CCOCCOC(C)(C)C 34a_100000210136_100000210625 [1,1,0,0,0,0|2,0,0]=4 2127 B9R0.38 CCOCCOC(C)(C)C 34a_100000693234_100000210202 [1,1,0,0,0,0|2,0,0]=4 2128 B9R0.38 CCOCCOC(C)(C)C 34a_100015890283_100000210147 [1,1,0,0,0,0|2,0,0]=4 2129 B9R0.38 CCOCCOC(C)(C)C 7a_100000693234_100000210202 [1,1,0,0,0,0|2,0,0]=4 2130 B9R0.38 CCOCCOC(C)(C)C 7a_100015890283_100011215890 [1,1,0,0,0,0|2,0,0]=4 2131 B9R0.38 CCOCCSC(C)(C)C 62a_100000210147_100000211941 [1,1,0,0,0,0|2,0,0]=4 2132 B9R0.38 CCOCCSC(C)(C)C 62a_100000211941_100011215890 [1,1,0,0,0,0|2,0,0]=4 2133 B9R0.38 CCOCSCC(C)(C)C 62a_100000739092_100011219605 [1,1,0,0,0,0|2,0,0]=4 2134 B9R0.38 CCOCSCC(C)(C)C 62a_100011219605_100000739092 [1,1,0,0,0,0|2,0,0]=4 2135 B9R0.38 CCOCSCC(C)(C)F 62a_100000739092_100011997219 [1,1,0,0,0,0|2,0,0]=4 2136 B9R0.38 CCOCSCC(C)(C)F 62a_100011997219_100000739092 [1,1,0,0,0,0|2,0,0]=4 2137 B9R0.38 CCOCSCC(C)(C)O 62a_100000739092_100000764493 [1,1,0,0,0,0|1,0,0]=3 2138 B9R0.38 CCOCSCC(C)(C)O 62a_100000764493_100000739092 [1,1,0,0,0,0|1,0,0]=3 2139 B9R0.38 CCSCCCC(C)(C)O 62a_100000210202_100009888830 [1,1,0,0,0,0|0,0,0]=2 2140 B9R0.38 CCSCCCC(C)(C)O 62a_100009888830_100000210202 [1,1,0,0,0,0|0,0,0]=2 2141 B9R0.38 CCSCCC[N+](C)(C)C 62a_100000210202_100016990835 [1,1,0,0,0,0|2,0,0]=4 2142 B9R0.38 CCSCCC[N+](C)(C)C 62a_100016990835_100000210202 [1,1,0,0,0,0|2,0,0]=4 2143 B9R0.38 CCSCCC[Si](C)(C)C 62a_100000210202_100011219597 [1,1,0,0,0,0|1,1,0]=4 2144 B9R0.38 CCSCCC[Si](C)(C)C 62a_100011219597_100000210202 [1,1,0,0,0,0|1,1,0]=4 2145 B9R0.38 CCSCCNC(C)(C)C 2230a_100000715429_100000757381 [1,1,0,0,0,0|2,0,0]=4 2146 B9R0.38 CCSCCOC(C)(C)C 34a_100000212035_100000210625 [1,1,0,0,0,0|2,0,0]=4 2147 B9R0.38 CCSCCOC(C)(C)C 34a_100015890283_100000757381 [1,1,0,0,0,0|2,0,0]=4 2148 B9R0.38 CCSCCOC(C)(C)C 7a_100015890283_100000757381 [1,1,0,0,0,0|2,0,0]=4 2149 B9R0.38 CCSCCSC(C)(C)C 62a_100000211941_100000757381 [1,1,0,0,0,0|2,0,0]=4 2150 B9R0.38 CCSCCSC(C)(C)C 62a_100000757381_100000211941 [1,1,0,0,0,0|2,0,0]=4 2151 B9R0.38 CNCCCOC(C)(C)C 2230a_100011250582_200000210301 [1,1,0,0,0,0|2,0,0]=4 2152 B9R0.38 CNCCCOC(C)(C)C 34a_100000213112_100000210625 [1,1,0,0,0,0|2,0,0]=4 2153 B9R0.38 COCCCC[Si](C)(C)C 7a_200009881916_200000210301 [1,1,0,0,0,0|1,1,0]=4 2154 B9R0.38 COCCCNC(C)(C)C 2230a_100000715429_100000740836 [1,1,0,0,0,0|2,0,0]=4 2155 B9R0.38 COCCCNC(C)(C)C 34a_100150723488_100000210625 [1,1,0,0,0,0|2,0,0]=4 2156 B9R0.38 COCCCOC(C)(C)C 34a_100000740835_100000210625 [1,1,0,0,0,0|2,0,0]=4 2157 B9R0.38 COCCCOC(C)(C)C 34a_100015890283_100000740836 [1,1,0,0,0,0|2,0,0]=4 2158 B9R0.38 COCCCOC(C)(C)C 7a_100015890283_100000740836 [1,1,0,0,0,0|2,0,0]=4 2159 B9R0.38 COCCCSC(C)(C)C 62a_100000211941_100000709357 [1,1,0,0,0,0|2,0,0]=4 2160 B9R0.38 COCCCSC(C)(C)C 62a_100000709357_100000211941 [1,1,0,0,0,0|2,0,0]=4 2161 B9R0.38 COCCNCC(C)(C)C 2230a_100000743828_100011201679 [1,1,0,0,0,0|2,0,0]=4 2162 B9R0.38 COCCNCC(C)(C)C 270004a_100000209980_100011204126 [1,1,0,0,0,0|2,0,0]=4 2163 B9R0.38 COCCNCC(C)(C)F 2230a_100020643315_100011201679 [1,1,0,0,0,0|2,0,0]=4 2164 B9R0.38 COCCNCC(C)(C)O 2230a_100000751335_100011201679 [1,1,0,0,0,0|1,0,0]=3 2165 B9R0.38 COCCOCC(C)(C)C 34a_100000210237_100011219605 [1,1,0,0,0,0|2,0,0]=4 2166 B9R0.38 COCCOCC(C)(C)F 34a_100000210237_100011997219 [1,1,0,0,0,0|2,0,0]=4 2167 B9R0.38 COCCOCC(C)(C)F 34a_100000716592_100011201679 [1,1,0,0,0,0|2,0,0]=4 2168 B9R0.38 COCCOCC(C)(C)O 34a_100000210237_100000764493 [1,1,0,0,0,0|1,0,0]=3 2169 B9R0.38 COCCSCC(C)(C)C 62a_100000233755_100011219605 [1,1,0,0,0,0|2,0,0]=4 2170 B9R0.38 COCCSCC(C)(C)C 62a_100011219605_100000233755 [1,1,0,0,0,0|2,0,0]=4 2171 B9R0.38 COCCSCC(C)(C)F 62a_100000233755_100011997219 [1,1,0,0,0,0|2,0,0]=4 2172 B9R0.38 COCCSCC(C)(C)F 62a_100011997219_100000233755 [1,1,0,0,0,0|2,0,0]=4 2173 B9R0.38 COCCSCC(C)(C)O 62a_100000233755_100000764493 [1,1,0,0,0,0|1,0,0]=3 2174 B9R0.38 COCCSCC(C)(C)O 62a_100000764493_100000233755 [1,1,0,0,0,0|1,0,0]=3 2175 B9R0.38 COCNCCC(C)(C)C 2230a_100000738805_100000766300 [1,1,0,0,0,0|2,0,0]=4 2176 B9R0.38 COCNCCC(C)(C)F 2230a_100016253952_100000766300 [1,1,0,0,0,0|2,0,0]=4 2177 B9R0.38 COCSCCC(C)(C)C 62a_100000755188_100000766300 [1,1,0,0,0,0|2,0,0]=4 2178 B9R0.38 COCSCCC(C)(C)C 62a_100000766300_100000755188 [1,1,0,0,0,0|2,0,0]=4 2179 B9R0.38 COCSCCC(C)(C)O 62a_100000702414_100000766300 [1,1,0,0,0,0|1,0,0]=3 2180 B9R0.38 COCSCCC(C)(C)O 62a_100000766300_100000702414 [1,1,0,0,0,0|1,0,0]=3 2181 B9R0.38 CSCCCOC(C)(C)C 34a_100000690336_100000210625 [1,1,0,0,0,0|2,0,0]=4 2182 B9R0.38 CSCCNCC(C)(C)C 2230a_100000743828_100000751147 [1,1,0,0,0,0|2,0,0]=4 2183 B9R0.38 CSCCNCC(C)(C)C 270004a_100020590264_100011204126 [1,1,0,0,0,0|2,0,0]=4 2184 B9R0.38 CSCCNCC(C)(C)F 2230a_100020643315_100000751147 [1,1,0,0,0,0|2,0,0]=4 2185 B9R0.38 CSCCNCC(C)(C)O 2230a_100000751335_100000751147 [1,1,0,0,0,0|1,0,0]=3 2186 B9R0.38 CSCCOCC(C)(C)C 34a_100000230434_100011219605 [1,1,0,0,0,0|2,0,0]=4 2187 B9R0.38 CSCCOCC(C)(C)F 34a_100000230434_100011997219 [1,1,0,0,0,0|2,0,0]=4 2188 B9R0.38 CSCCOCC(C)(C)F 34a_100000716592_100000212216 [1,1,0,0,0,0|2,0,0]=4 2189 B9R0.38 CSCCOCC(C)(C)O 34a_100000230434_100000764493 [1,1,0,0,0,0|1,0,0]=3 2190 B9R0.38 CSCCOCC(C)(C)O 7a_100000230434_100000764493 [1,1,0,0,0,0|1,0,0]=3 2191 B9R0.38 CSCCSCC(C)(C)C 62a_100000212216_100011219605 [1,1,0,0,0,0|2,0,0]=4 2192 B9R0.38 CSCCSCC(C)(C)C 62a_100011219605_100000751147 [1,1,0,0,0,0|2,0,0]=4 2193 B9R0.38 CSCCSCC(C)(C)F 62a_100000212216_100011997219 [1,1,0,0,0,0|2,0,0]=4 2194 B9R0.38 CSCCSCC(C)(C)F 62a_100011997219_100000751147 [1,1,0,0,0,0|2,0,0]=4 2195 B9R0.38 CSCCSCC(C)(C)O 62a_100000212216_100000764493 [1,1,0,0,0,0|1,0,0]=3 2196 B9R0.38 CSCCSCC(C)(C)O 62a_100000764493_100000751147 [1,1,0,0,0,0|1,0,0]=3 2197 B9R0.38 CSCNCCC(C)(C)C 2230a_100000738805_100011218213 [1,1,0,0,0,0|2,0,0]=4 2198 B9R0.38 CSCNCCC(C)(C)F 2230a_100016253952_100011218213 [1,1,0,0,0,0|2,0,0]=4 2199 B9R0.38 CSCSCCC(C)(C)C 62a_100000755188_100011218213 [1,1,0,0,0,0|2,0,0]=4 2200 B9R0.38 CSCSCCC(C)(C)C 62a_100011218213_100000755188 [1,1,0,0,0,0|2,0,0]=4 2201 B9R0.38 CSCSCCC(C)(C)O 62a_100000702414_100011218213 [1,1,0,0,0,0|1,0,0]=3 2202 B9R0.38 CSCSCCC(C)(C)O 62a_100011218213_100000702414 [1,1,0,0,0,0|1,0,0]=3 2203 B9R0.38 C[N+](C)(C)CCOCCN 34a_100000210304_100000085578 [1,1,0,0,0,0|2,0,0]=4 2204 B9R0.38 C[Si](C)(C)CCCCO[13CH3] 7a_200009881916_200025704644 [1,1,0,0,0,0|1,1,0]=4 2205 B9R0.38 C[Si](C)(C)CCOCCN 34a_100000210304_200000733723 [1,1,0,0,0,0|1,1,0]=4 2206 B9R0.44 CC(C)(O)CC(=O)CCF 1458a_100000693243_100011217306 [1,1,0,0,0,0|1,0,1]=4 2207 B9R0.44 CC(C)(O)CC(=O)CCO 1458a_100000693243_100000211926 [1,1,0,0,0,0|1,0,1]=4 2208 B9R0.44 CC(CO[13CH3])CC(C)(C)C 7a_200011215325_200025704644 [1,1,0,0,0,0|2,0,0]=4 2209 B9R0.44 CCCC(=O)CC(C)(C)C 1458a_100000211214_100000210303 [1,1,0,0,0,0|1,0,1]=4 2210 B9R0.44 CCCC(=O)CC(C)(C)O 1458a_100000693243_100000210303 [1,1,0,0,0,0|0,0,1]=3 2211 B9R0.44 CCCC(C)NC(C)(C)C 2230a_100000715429_100000766640 [1,1,0,0,0,0|2,0,0]=4 2212 B9R0.44 CCCC(C)OC(C)(C)C 34a_100000764384_100000210625 [1,1,0,0,0,0|2,0,0]=4 2213 B9R0.44 CCCC(C)OC(C)(C)C 34a_100015890283_100000766640 [1,1,0,0,0,0|2,0,0]=4 2214 B9R0.44 CCCC(C)OC(C)(C)C 7a_100015890283_100000766640 [1,1,0,0,0,0|2,0,0]=4 2215 B9R0.44 CCCC(C)SC(C)(C)C 62a_100000211941_100000766640 [1,1,0,0,0,0|2,0,0]=4 2216 B9R0.44 CCCC(C)SC(C)(C)C 62a_100000766640_100000211941 [1,1,0,0,0,0|2,0,0]=4 2217 B9R0.44 CCCN(C)CC(C)(C)C 2230a_100000742839_100000210303 [1,1,0,0,0,0|2,0,0]=4 2218 B9R0.44 CCCN(C)CC(C)(C)C 2230a_107254831479_200000210301 [1,1,0,0,0,0|2,0,0]=4 2219 B9R0.44 CCCN(C)CC(C)(C)C 269982a_100000742839_100000210303 [1,1,0,0,0,0|2,0,0]=4 2220 B9R0.44 CCCN(C)CC(C)(C)C 269982a_107254831479_200000210301 [1,1,0,0,0,0|2,0,0]=4 2221 B9R0.44 CCCN(C)CC(C)(C)C 270004a_100000747261_100011204126 [1,1,0,0,0,0|2,0,0]=4 2222 B9R0.44 CCCN(C)CC(C)(C)O 2230a_100000755907_100000210303 [1,1,0,0,0,0|1,0,0]=3 2223 B9R0.44 CCCN(C)CC(C)(C)O 269982a_100000755907_100000210303 [1,1,0,0,0,0|1,0,0]=3 2224 B9R0.44 CCCN([13CH3])CC(C)(C)C 2230a_107254831479_200025704644 [1,1,0,0,0,0|2,0,0]=4 2225 B9R0.44 CCCN([13CH3])CC(C)(C)C 269982a_107254831479_200025704644 [1,1,0,0,0,0|2,0,0]=4 2226 B9R0.44 CCNC(=O)CC(C)(C)O 527a_100015525214_100000693243 [1,1,0,0,0,0|1,0,1]=4 2227 B9R0.44 CCN[C@@H](C)CC(C)(C)C 2230a_106358413534_100000210202 [1,1,0,0,0,0|2,0,0]=4 2228 B9R0.44 CCOC(C)CC(C)(C)C 7a_200011218616_100000210202 [1,1,0,0,0,0|2,0,0]=4 2229 B9R0.44 CN(CCF)CC(C)(C)O 2230a_100000755907_100011217306 [1,1,0,0,0,0|2,0,0]=4 2230 B9R0.44 CN(CCF)CC(C)(C)O 269982a_100000755907_100011217306 [1,1,0,0,0,0|2,0,0]=4 2231 B9R0.44 CN(CCO)CC(C)(C)O 2230a_100000755907_100000211926 [1,1,0,0,0,0|2,0,0]=4 2232 B9R0.44 CN(CCO)CC(C)(C)O 269982a_100000755907_100000211926 [1,1,0,0,0,0|2,0,0]=4 2233 B9R0.44 COCC(C)CC(C)(C)C 7a_200011215325_200000210301 [1,1,0,0,0,0|2,0,0]=4 2234 B9R0.44 COCN(C)CC(C)(C)O 2230a_100000755907_100000766300 [1,1,0,0,0,0|2,0,0]=4 2235 B9R0.44 COCN(C)CC(C)(C)O 269982a_100000755907_100000766300 [1,1,0,0,0,0|2,0,0]=4 2236 B9R0.44 CSCN(C)CC(C)(C)O 2230a_100000755907_100011218213 [1,1,0,0,0,0|2,0,0]=4 2237 B9R0.44 CSCN(C)CC(C)(C)O 269982a_100000755907_100011218213 [1,1,0,0,0,0|2,0,0]=4 2238 B9R0.1 C#CC(C)NCCC(C)C 2230a_100000707721_100000210312 [1,1,0,0,0,0|2,0,0]=4 2239 B9R0.1 C#CC(C)NCCC(C)C 34a_100000707721_100000210312 [1,1,0,0,0,0|2,0,0]=4 2240 B9R0.1 C#CC(C)NCCC(C)O 2230a_100000707721_100012276601 [1,1,0,0,0,0|2,0,0]=4 2241 B9R0.1 C#CC(C)NCCC(C)O 34a_100000707721_100012276601 [1,1,0,0,0,0|2,0,0]=4 2242 B9R0.1 C#CC(C)OCCC(C)C 34a_100000210254_200000035995 [1,1,0,0,0,0|2,0,0]=4 2243 B9R0.1 C#CC(C)OCC[C@@H](C)N 34a_100000706166_200000035995 [1,1,0,0,0,0|1,0,1]=4 2244 B9R0.1 C#CC(C)SCCC(C)C 62a_200000035995_100000210312 [1,1,0,0,0,0|2,0,0]=4 2245 B9R0.1 C#CC(C)SCCC(C)O 62a_200000035995_100012276601 [1,1,0,0,0,0|2,0,0]=4 2246 B9R0.1 C#C[C@@H](C)OCCC(C)C 34a_100009815206_100000210312 [1,1,0,0,0,0|2,0,0]=4 2247 B9R0.1 C#C[C@@H](C)OCCC(C)C 7a_100009815206_100000210626 [1,1,0,0,0,0|2,0,0]=4 2248 B9R0.1 C#C[C@@H](C)OCCC(C)O 34a_100009815206_100012276601 [1,1,0,0,0,0|2,0,0]=4 2249 B9R0.1 C#C[C@@H](C)OCCC(C)O 7a_100009815206_100012276601 [1,1,0,0,0,0|2,0,0]=4 2250 B9R0.1 C=CC(C)COCC(C)C 34a_100011215527_100000210624 [1,1,0,0,0,0|2,0,0]=4 2251 B9R0.1 C=CC(C)COCC(C)C 7a_100011215527_100000210760 [1,1,0,0,0,0|2,0,0]=4 2252 B9R0.1 C=CC(C)COCC(C)O 34a_100011215527_100011218427 [1,1,0,0,0,0|2,0,0]=4 2253 B9R0.1 C=CC(C)COCC(C)O 7a_100011215527_100011218427 [1,1,0,0,0,0|2,0,0]=4 2254 B9R0.1 C=CC(C)COC[C@@H](C)O 34a_100011215527_100009817552 [1,1,0,0,0,0|2,0,0]=4 2255 B9R0.1 C=CC(C)COC[C@@H](C)O 7a_100011215527_100009817552 [1,1,0,0,0,0|2,0,0]=4 2256 B9R0.1 C=CC(C)OCCC(C)C 34a_100000695699_100000210312 [1,1,0,0,0,0|2,0,0]=4 2257 B9R0.1 C=CC(C)OCCC(C)O 34a_100000695699_100012276601 [1,1,0,0,0,0|2,0,0]=4 2258 B9R0.1 C=CC(C)SCCC(C)C 62a_100011215867_100000210312 [1,1,0,0,0,0|2,0,0]=4 2259 B9R0.1 C=CC(C)SCCC(C)O 62a_100011215867_100012276601 [1,1,0,0,0,0|2,0,0]=4 2260 B9R0.1 C=CC(O)COC[C@@H](C)N 34a_100000737577_100000730141 [1,1,0,0,0,0|1,0,1]=4 2261 B9R0.1 C=C[C@H](N)COCC(C)C 34a_100016989147_100000210624 [1,1,0,0,0,0|1,0,1]=4 2262 B9R0.1 C=C[C@H](N)COCC(C)O 34a_100016989147_100011218427 [1,1,0,0,0,0|1,0,1]=4 2263 B9R0.1 C=C[C@H](N)COC[C@@H](C)O 34a_100016989147_100009817552 [1,1,0,0,0,0|1,0,1]=4 2264 B9R0.1 CC(Br)CCOC(C)CO 34a_100009893172_100012180447 [1,1,0,0,0,0|2,0,0]=4 2265 B9R0.1 CC(Br)COCC(O)CO 34a_100012180447_100011219619 [1,1,0,0,0,0|2,0,0]=4 2266 B9R0.1 CC(Br)COC[C@@H](C)CO 34a_100012180447_100000059175 [1,1,0,0,0,0|2,0,0]=4 2267 B9R0.1 CC(Br)COC[C@@H](O)CF 34a_100012180447_100015614560 [1,1,0,0,0,0|2,0,0]=4 2268 B9R0.1 CC(Br)COC[C@@H](O)CO 34a_100012180447_100009815848 [1,1,0,0,0,0|2,0,0]=4 2269 B9R0.1 CC(C)CCCC(=O)CF 1458a_100011216857_100015361967 [1,1,0,0,0,0|1,0,1]=4 2270 B9R0.1 CC(C)CCCC(=O)CO 1458a_100000210174_100011214892 [1,1,0,0,0,0|1,0,1]=4 2271 B9R0.1 CC(C)CCCC(C)N[13CH3] 2230a_100000210607_200025704644 [1,1,0,0,0,0|0,0,0]=2 2272 B9R0.1 CC(C)CCCC(C)O[13CH3] 34a_200011218570_200025704644 [1,1,0,0,0,0|1,0,0]=3 2273 B9R0.1 CC(C)CCCC(C)O[13CH3] 7a_200011218570_200025704644 [1,1,0,0,0,0|1,0,0]=3 2274 B9R0.1 CC(C)CCNC(C)C#N 2230a_100000737613_100000210312 [1,1,0,0,0,0|1,0,1]=4 2275 B9R0.1 CC(C)CCN[C@H](C)CF 269862a_100102880703_100000185833 [1,1,0,0,0,0|2,0,0]=4 2276 B9R0.1 CC(C)CCN[C@H](C)CO 2230a_100000737577_100000210312 [1,1,0,0,0,0|2,0,0]=4 2277 B9R0.1 CC(C)CCN[C@H](C)CO 269862a_100000737577_100000185833 [1,1,0,0,0,0|2,0,0]=4 2278 B9R0.1 CC(C)CCOC(C)C#N 34a_100011218135_100000210312 [1,1,0,0,0,0|1,0,1]=4 2279 B9R0.1 CC(C)CCOC(C)C#N 7a_100000210254_100000703298 [1,1,0,0,0,0|1,0,1]=4 2280 B9R0.1 CC(C)CCOC(C)CF 34a_100016041109_100000210312 [1,1,0,0,0,0|2,0,0]=4 2281 B9R0.1 CC(C)CCOC(C)CF 7a_100016041109_100000210626 [1,1,0,0,0,0|2,0,0]=4 2282 B9R0.1 CC(C)CCOC(C)CN 34a_100000210904_100000210312 [1,1,0,0,0,0|1,0,0]=3 2283 B9R0.1 CC(C)CCOC(C)CO 34a_100000210254_100012180447 [1,1,0,0,0,0|2,0,0]=4 2284 B9R0.1 CC(C)CCOC(C)CO 7a_100000210254_100012180447 [1,1,0,0,0,0|2,0,0]=4 2285 B9R0.1 CC(C)CCSC(C)C#N 62a_100000210312_100000703298 [1,1,0,0,0,0|1,0,1]=4 2286 B9R0.1 CC(C)CCSC(C)C#N 62a_100000703298_100000210312 [1,1,0,0,0,0|1,0,1]=4 2287 B9R0.1 CC(C)CCSC(C)CO 62a_100012180447_100000210312 [1,1,0,0,0,0|2,0,0]=4 2288 B9R0.1 CC(C)CCS[C@H](C)CO 62a_100000210312_100016084084 [1,1,0,0,0,0|2,0,0]=4 2289 B9R0.1 CC(C)CCS[C@H](C)CO 62a_100016084084_100000210312 [1,1,0,0,0,0|2,0,0]=4 2290 B9R0.1 CC(C)CNCC(C)CO 34a_100000744482_100000210624 [1,1,0,0,0,0|2,0,0]=4 2291 B9R0.1 CC(C)CNCC(O)CO 2230a_100000210953_100011219619 [1,1,0,0,0,0|2,0,0]=4 2292 B9R0.1 CC(C)CNCC(O)CO 34a_100000210953_100011219619 [1,1,0,0,0,0|2,0,0]=4 2293 B9R0.1 CC(C)CNC[C@@H](C)CO 2230a_100000210953_100000059175 [1,1,0,0,0,0|2,0,0]=4 2294 B9R0.1 CC(C)CNC[C@@H](C)CO 34a_100000210953_100000059175 [1,1,0,0,0,0|2,0,0]=4 2295 B9R0.1 CC(C)CNC[C@@H](F)CO 270004a_100015665980_100000210432 [1,1,0,0,0,0|2,0,0]=4 2296 B9R0.1 CC(C)CNC[C@@H](F)CO 34a_100015665980_100000210624 [1,1,0,0,0,0|2,0,0]=4 2297 B9R0.1 CC(C)CNC[C@@H](O)CF 2230a_100000210953_100015614560 [1,1,0,0,0,0|2,0,0]=4 2298 B9R0.1 CC(C)CNC[C@@H](O)CF 34a_100000210953_100015614560 [1,1,0,0,0,0|2,0,0]=4 2299 B9R0.1 CC(C)CNC[C@@H](O)CO 2230a_100000210953_100009815848 [1,1,0,0,0,0|2,0,0]=4 2300 B9R0.1 CC(C)CNC[C@@H](O)CO 34a_100000210953_100009815848 [1,1,0,0,0,0|2,0,0]=4 2301 B9R0.1 CC(C)CNC[C@H](O)CO 2230a_100020644852_100000210760 [1,1,0,0,0,0|2,0,0]=4 2302 B9R0.1 CC(C)COCC(C)CN 34a_100000744482_100000210624 [1,1,0,0,0,0|1,0,0]=3 2303 B9R0.1 CC(C)COCC(Cl)CCl 34a_100000033668_100000210624 [1,1,0,0,0,0|2,0,0]=4 2304 B9R0.1 CC(C)COCC(O)CO 34a_100000210257_100011219619 [1,1,0,0,0,0|2,0,0]=4 2305 B9R0.1 CC(C)COC[C@@H](C)CO 34a_100000210257_100000059175 [1,1,0,0,0,0|2,0,0]=4 2306 B9R0.1 CC(C)COC[C@@H](O)CF 34a_100000210257_100015614560 [1,1,0,0,0,0|2,0,0]=4 2307 B9R0.1 CC(C)COC[C@@H](O)CO 34a_100000210257_100009815848 [1,1,0,0,0,0|2,0,0]=4 2308 B9R0.1 CC(C)COC[C@H](F)CN 34a_100015665980_100000210624 [1,1,0,0,0,0|2,0,0]=4 2309 B9R0.1 CC(C)CSCC(O)CO 62a_100000210624_100011219619 [1,1,0,0,0,0|2,0,0]=4 2310 B9R0.1 CC(C)CSCC(O)CO 62a_100011219619_100000210760 [1,1,0,0,0,0|2,0,0]=4 2311 B9R0.1 CC(C)CSC[C@@H](C)CO 62a_100000059175_100000210760 [1,1,0,0,0,0|2,0,0]=4 2312 B9R0.1 CC(C)CSC[C@@H](C)CO 62a_100000210624_100000059175 [1,1,0,0,0,0|2,0,0]=4 2313 B9R0.1 CC(C)CSC[C@@H](O)CF 62a_100000210624_100015614560 [1,1,0,0,0,0|2,0,0]=4 2314 B9R0.1 CC(C)CSC[C@@H](O)CF 62a_100015614560_100000210760 [1,1,0,0,0,0|2,0,0]=4 2315 B9R0.1 CC(C)CSC[C@@H](O)CO 62a_100000210624_100009815848 [1,1,0,0,0,0|2,0,0]=4 2316 B9R0.1 CC(C)CSC[C@@H](O)CO 62a_100009815848_100000210760 [1,1,0,0,0,0|2,0,0]=4 2317 B9R0.1 CC(C)OCOC(C)CN 34a_100000210904_100000709892 [1,1,0,0,0,0|2,0,0]=4 2318 B9R0.1 CC(CN)COC[C@@H](C)O 34a_100000744482_100009817552 [1,1,0,0,0,0|1,0,0]=3 2319 B9R0.1 CC(CO)CCNC(C)C 2230a_106354213184_100000210206 [1,1,0,0,0,0|2,0,0]=4 2320 B9R0.1 CC(CO)CCNC(C)C 34a_106354213184_100000210206 [1,1,0,0,0,0|2,0,0]=4 2321 B9R0.1 CC(CO)CNC[C@@H](C)O 34a_100000744482_100009817552 [1,1,0,0,0,0|2,0,0]=4 2322 B9R0.1 CC(CO)OCC[C@@H](C)N 34a_100000706166_100012180447 [1,1,0,0,0,0|1,0,0]=3 2323 B9R0.1 CC(F)COCC(O)CO 34a_100015925927_100011219619 [1,1,0,0,0,0|2,0,0]=4 2324 B9R0.1 CC(F)COC[C@@H](C)CO 34a_100015925927_100000059175 [1,1,0,0,0,0|2,0,0]=4 2325 B9R0.1 CC(F)COC[C@@H](O)CF 34a_100015925927_100015614560 [1,1,0,0,0,0|2,0,0]=4 2326 B9R0.1 CC(F)COC[C@@H](O)CO 34a_100015925927_100009815848 [1,1,0,0,0,0|2,0,0]=4 2327 B9R0.1 CC(O)CCCC(=O)CO 1458a_100000210174_200000718107 [1,1,0,0,0,0|1,0,1]=4 2328 B9R0.1 CC(O)CCNC(C)C#N 2230a_100000737613_100012276601 [1,1,0,0,0,0|1,0,1]=4 2329 B9R0.1 CC(O)CCNC(C)C#N 2230a_200000755665_100000184139 [1,1,0,0,0,0|1,0,1]=4 2330 B9R0.1 CC(O)CCNC(C)CO 2230a_200000755665_100012180447 [1,1,0,0,0,0|2,0,0]=4 2331 B9R0.1 CC(O)CCN[C@H](C)CO 2230a_100000737577_100012276601 [1,1,0,0,0,0|2,0,0]=4 2332 B9R0.1 CC(O)CCOC(C)C#N 34a_100011218135_100012276601 [1,1,0,0,0,0|1,0,1]=4 2333 B9R0.1 CC(O)CCOC(C)CF 34a_100016041109_100012276601 [1,1,0,0,0,0|2,0,0]=4 2334 B9R0.1 CC(O)CCOC(C)CF 7a_100016041109_100012276601 [1,1,0,0,0,0|2,0,0]=4 2335 B9R0.1 CC(O)CCOC(C)CN 34a_100000210904_100012276601 [1,1,0,0,0,0|1,0,0]=3 2336 B9R0.1 CC(O)CCSC(C)C#N 62a_100000703298_100012276601 [1,1,0,0,0,0|1,0,1]=4 2337 B9R0.1 CC(O)CCSC(C)C#N 62a_100012276601_100000703298 [1,1,0,0,0,0|1,0,1]=4 2338 B9R0.1 CC(O)CCSC(C)CO 62a_100012180447_100012276601 [1,1,0,0,0,0|2,0,0]=4 2339 B9R0.1 CC(O)CCS[C@H](C)CO 62a_100012276601_100016084084 [1,1,0,0,0,0|2,0,0]=4 2340 B9R0.1 CC(O)CCS[C@H](C)CO 62a_100016084084_100012276601 [1,1,0,0,0,0|2,0,0]=4 2341 B9R0.1 CC(O)CNCC(C)CO 34a_100000744482_100011218427 [1,1,0,0,0,0|2,0,0]=4 2342 B9R0.1 CC(O)CNCC(O)CO 2230a_100000210904_100011219619 [1,1,0,0,0,0|2,0,0]=4 2343 B9R0.1 CC(O)CNCC(O)CO 34a_100000210904_100011219619 [1,1,0,0,0,0|2,0,0]=4 2344 B9R0.1 CC(O)CNC[C@@H](C)CO 2230a_100000210904_100000059175 [1,1,0,0,0,0|2,0,0]=4 2345 B9R0.1 CC(O)CNC[C@@H](C)CO 34a_100000210904_100000059175 [1,1,0,0,0,0|2,0,0]=4 2346 B9R0.1 CC(O)CNC[C@@H](F)CO 34a_100015665980_100011218427 [1,1,0,0,0,0|2,0,0]=4 2347 B9R0.1 CC(O)CNC[C@@H](O)CF 2230a_100000210904_100015614560 [1,1,0,0,0,0|2,0,0]=4 2348 B9R0.1 CC(O)CNC[C@@H](O)CF 34a_100000210904_100015614560 [1,1,0,0,0,0|2,0,0]=4 2349 B9R0.1 CC(O)CNC[C@@H](O)CO 2230a_100000210904_100009815848 [1,1,0,0,0,0|2,0,0]=4 2350 B9R0.1 CC(O)CNC[C@@H](O)CO 34a_100000210904_100009815848 [1,1,0,0,0,0|2,0,0]=4 2351 B9R0.1 CC(O)CNC[C@H](O)CO 2230a_100020644852_100011218427 [1,1,0,0,0,0|2,0,0]=4 2352 B9R0.1 CC(O)COCC(C)CN 34a_100000744482_100011218427 [1,1,0,0,0,0|1,0,0]=3 2353 B9R0.1 CC(O)COCC(Cl)CCl 34a_100000033668_100011218427 [1,1,0,0,0,0|2,0,0]=4 2354 B9R0.1 CC(O)COC[C@H](F)CN 34a_100015665980_100011218427 [1,1,0,0,0,0|2,0,0]=4 2355 B9R0.1 CC(O)CSCC(O)CO 62a_100011218427_100011219619 [1,1,0,0,0,0|2,0,0]=4 2356 B9R0.1 CC(O)CSCC(O)CO 62a_100011219619_100011218427 [1,1,0,0,0,0|2,0,0]=4 2357 B9R0.1 CC(O)CSC[C@@H](C)CO 62a_100000059175_100011218427 [1,1,0,0,0,0|2,0,0]=4 2358 B9R0.1 CC(O)CSC[C@@H](C)CO 62a_100011218427_100000059175 [1,1,0,0,0,0|2,0,0]=4 2359 B9R0.1 CC(O)CSC[C@@H](O)CF 62a_100011218427_100015614560 [1,1,0,0,0,0|2,0,0]=4 2360 B9R0.1 CC(O)CSC[C@@H](O)CF 62a_100015614560_100011218427 [1,1,0,0,0,0|2,0,0]=4 2361 B9R0.1 CC(O)CSC[C@@H](O)CO 62a_100009815848_100011218427 [1,1,0,0,0,0|2,0,0]=4 2362 B9R0.1 CC(O)CSC[C@@H](O)CO 62a_100011218427_100009815848 [1,1,0,0,0,0|2,0,0]=4 2363 B9R0.1 CCC(=O)CCCC(C)C 1458a_100000210414_100011214892 [1,1,0,0,0,0|1,0,1]=4 2364 B9R0.1 CCC(=O)CCCC(C)C 1458a_100011216857_100000210202 [1,1,0,0,0,0|1,0,1]=4 2365 B9R0.1 CCC(=O)CCCC(C)O 1458a_100000210414_200000718107 [1,1,0,0,0,0|1,0,1]=4 2366 B9R0.1 CCC(C)CCNC(C)C 2230a_100020591266_100000210206 [1,1,0,0,0,0|2,0,0]=4 2367 B9R0.1 CCC(C)CCOC(C)C 7a_100011215188_100000210206 [1,1,0,0,0,0|2,0,0]=4 2368 B9R0.1 CCC(C)CNCC(C)C 2230a_100000210953_100000748023 [1,1,0,0,0,0|2,0,0]=4 2369 B9R0.1 CCC(C)CNCC(C)C 2230a_100020588543_100000210760 [1,1,0,0,0,0|2,0,0]=4 2370 B9R0.1 CCC(C)CNCC(C)C 270004a_100000210953_100000243153 [1,1,0,0,0,0|2,0,0]=4 2371 B9R0.1 CCC(C)CNCC(C)C 270004a_100020588543_100000210432 [1,1,0,0,0,0|2,0,0]=4 2372 B9R0.1 CCC(C)CNCC(C)C 34a_100000210953_100000748023 [1,1,0,0,0,0|2,0,0]=4 2373 B9R0.1 CCC(C)CNCC(C)O 2230a_100000210904_100000748023 [1,1,0,0,0,0|2,0,0]=4 2374 B9R0.1 CCC(C)CNCC(C)O 2230a_100020588543_100011218427 [1,1,0,0,0,0|2,0,0]=4 2375 B9R0.1 CCC(C)CNCC(C)O 270004a_100000210904_100000243153 [1,1,0,0,0,0|2,0,0]=4 2376 B9R0.1 CCC(C)CNCC(C)O 34a_100000210904_100000748023 [1,1,0,0,0,0|2,0,0]=4 2377 B9R0.1 CCC(C)CNC[C@@H](C)O 2230a_100020588543_100009817552 [1,1,0,0,0,0|2,0,0]=4 2378 B9R0.1 CCC(C)COCC(C)Br 34a_100012180447_100000748023 [1,1,0,0,0,0|2,0,0]=4 2379 B9R0.1 CCC(C)COCC(C)C 34a_100000210257_100000748023 [1,1,0,0,0,0|2,0,0]=4 2380 B9R0.1 CCC(C)COCC(C)F 34a_100015925927_100000748023 [1,1,0,0,0,0|2,0,0]=4 2381 B9R0.1 CCC(C)COC[C@@H](C)Cl 34a_100016084084_100000748023 [1,1,0,0,0,0|2,0,0]=4 2382 B9R0.1 CCC(C)COC[C@@H](C)N 34a_100000737577_100000748023 [1,1,0,0,0,0|1,0,0]=3 2383 B9R0.1 CCC(C)CSCC(C)C 62a_100000210624_100000748023 [1,1,0,0,0,0|2,0,0]=4 2384 B9R0.1 CCC(C)CSCC(C)C 62a_100000748023_100000210760 [1,1,0,0,0,0|2,0,0]=4 2385 B9R0.1 CCC(C)CSCC(C)O 62a_100000748023_100011218427 [1,1,0,0,0,0|2,0,0]=4 2386 B9R0.1 CCC(C)CSCC(C)O 62a_100011218427_100000748023 [1,1,0,0,0,0|2,0,0]=4 2387 B9R0.1 CCC(C)CSC[C@@H](C)O 62a_100000748023_100009817552 [1,1,0,0,0,0|2,0,0]=4 2388 B9R0.1 CCC(C)CSC[C@@H](C)O 62a_100009817552_100000748023 [1,1,0,0,0,0|2,0,0]=4 2389 B9R0.1 CCC(C)NCCC(C)C 2230a_100000209981_100000210312 [1,1,0,0,0,0|2,0,0]=4 2390 B9R0.1 CCC(C)NCCC(C)C 269862a_100000209981_100000185833 [1,1,0,0,0,0|2,0,0]=4 2391 B9R0.1 CCC(C)NCCC(C)O 2230a_100000209981_100012276601 [1,1,0,0,0,0|2,0,0]=4 2392 B9R0.1 CCC(C)NCCC(C)O 2230a_200000755665_100000758301 [1,1,0,0,0,0|2,0,0]=4 2393 B9R0.1 CCC(C)OCCC(C)Br 34a_100009893172_100011215416 [1,1,0,0,0,0|2,0,0]=4 2394 B9R0.1 CCC(C)OCCC(C)C 34a_100000210254_100011215416 [1,1,0,0,0,0|2,0,0]=4 2395 B9R0.1 CCC(C)OCCC(C)C 7a_100000210228_100000210626 [1,1,0,0,0,0|2,0,0]=4 2396 B9R0.1 CCC(C)OCCC(C)C 7a_100000210254_100000758301 [1,1,0,0,0,0|2,0,0]=4 2397 B9R0.1 CCC(C)OCCC(C)O 7a_100000210228_100012276601 [1,1,0,0,0,0|2,0,0]=4 2398 B9R0.1 CCC(C)OCC[C@@H](C)N 34a_100000706166_100011215416 [1,1,0,0,0,0|1,0,0]=3 2399 B9R0.1 CCC(C)SCCC(C)C 62a_100000210312_100000758301 [1,1,0,0,0,0|2,0,0]=4 2400 B9R0.1 CCC(C)SCCC(C)C 62a_100000758301_100000210312 [1,1,0,0,0,0|2,0,0]=4 2401 B9R0.1 CCC(C)SCCC(C)O 62a_100000758301_100012276601 [1,1,0,0,0,0|2,0,0]=4 2402 B9R0.1 CCC(C)SCCC(C)O 62a_100012276601_100000758301 [1,1,0,0,0,0|2,0,0]=4 2403 B9R0.1 CCC(O)CNCC(C)C 2230a_100000210953_100011218378 [1,1,0,0,0,0|2,0,0]=4 2404 B9R0.1 CCC(O)CNCC(C)C 2230a_100011218483_100000210760 [1,1,0,0,0,0|2,0,0]=4 2405 B9R0.1 CCC(O)CNCC(C)C 270004a_100011218483_100000210432 [1,1,0,0,0,0|2,0,0]=4 2406 B9R0.1 CCC(O)CNCC(C)C 34a_100000210953_100011218378 [1,1,0,0,0,0|2,0,0]=4 2407 B9R0.1 CCC(O)CNCC(C)O 2230a_100000210904_100011218378 [1,1,0,0,0,0|2,0,0]=4 2408 B9R0.1 CCC(O)CNCC(C)O 2230a_100011218483_100011218427 [1,1,0,0,0,0|2,0,0]=4 2409 B9R0.1 CCC(O)CNCC(C)O 34a_100000210904_100011218378 [1,1,0,0,0,0|2,0,0]=4 2410 B9R0.1 CCC(O)CNC[C@@H](C)O 2230a_100011218483_100009817552 [1,1,0,0,0,0|2,0,0]=4 2411 B9R0.1 CCC(O)COCC(C)Br 34a_100012180447_100011218378 [1,1,0,0,0,0|2,0,0]=4 2412 B9R0.1 CCC(O)COCC(C)C 34a_100000210257_100011218378 [1,1,0,0,0,0|2,0,0]=4 2413 B9R0.1 CCC(O)COCC(C)F 34a_100015925927_100011218378 [1,1,0,0,0,0|2,0,0]=4 2414 B9R0.1 CCC(O)COC[C@@H](C)Cl 34a_100016084084_100011218378 [1,1,0,0,0,0|2,0,0]=4 2415 B9R0.1 CCC(O)COC[C@@H](C)N 34a_100000737577_100011218378 [1,1,0,0,0,0|1,0,0]=3 2416 B9R0.1 CCC(O)CSCC(C)C 62a_100000210624_100011218378 [1,1,0,0,0,0|2,0,0]=4 2417 B9R0.1 CCC(O)CSCC(C)C 62a_100011218378_100000210760 [1,1,0,0,0,0|2,0,0]=4 2418 B9R0.1 CCC(O)CSCC(C)O 62a_100011218378_100011218427 [1,1,0,0,0,0|2,0,0]=4 2419 B9R0.1 CCC(O)CSCC(C)O 62a_100011218427_100011218378 [1,1,0,0,0,0|2,0,0]=4 2420 B9R0.1 CCC(O)CSC[C@@H](C)O 62a_100009817552_100011218378 [1,1,0,0,0,0|2,0,0]=4 2421 B9R0.1 CCC(O)CSC[C@@H](C)O 62a_100011218378_100009817552 [1,1,0,0,0,0|2,0,0]=4 2422 B9R0.1 CCN(C)CCCC(C)C 2230a_100000225621_100011214892 [1,1,0,0,0,0|2,0,0]=4 2423 B9R0.1 CCN(C)CCCC(C)C 269982a_100000225621_100011214892 [1,1,0,0,0,0|2,0,0]=4 2424 B9R0.1 CCN(C)CCCC(C)O 2230a_100000225621_200000718107 [1,1,0,0,0,0|2,0,0]=4 2425 B9R0.1 CCN(C)CCCC(C)O 269982a_100000225621_200000718107 [1,1,0,0,0,0|2,0,0]=4 2426 B9R0.1 CC[C@H](C)CNCC(C)C 2230a_100000210953_100009816398 [1,1,0,0,0,0|2,0,0]=4 2427 B9R0.1 CC[C@H](C)CNCC(C)C 34a_100000210953_100009816398 [1,1,0,0,0,0|2,0,0]=4 2428 B9R0.1 CC[C@H](C)CNCC(C)O 2230a_100000210904_100009816398 [1,1,0,0,0,0|2,0,0]=4 2429 B9R0.1 CC[C@H](C)CNCC(C)O 34a_100000210904_100009816398 [1,1,0,0,0,0|2,0,0]=4 2430 B9R0.1 CC[C@H](C)COCC(C)Br 34a_100012180447_100009816398 [1,1,0,0,0,0|2,0,0]=4 2431 B9R0.1 CC[C@H](C)COCC(C)C 34a_100000210257_100009816398 [1,1,0,0,0,0|2,0,0]=4 2432 B9R0.1 CC[C@H](C)COCC(C)C 7a_100009816381_100000210760 [1,1,0,0,0,0|2,0,0]=4 2433 B9R0.1 CC[C@H](C)COCC(C)F 34a_100015925927_100009816398 [1,1,0,0,0,0|2,0,0]=4 2434 B9R0.1 CC[C@H](C)COCC(C)O 7a_100009816381_100011218427 [1,1,0,0,0,0|2,0,0]=4 2435 B9R0.1 CC[C@H](C)COC[C@@H](C)Cl 34a_100016084084_100009816398 [1,1,0,0,0,0|2,0,0]=4 2436 B9R0.1 CC[C@H](C)COC[C@@H](C)N 34a_100000737577_100009816398 [1,1,0,0,0,0|1,0,0]=3 2437 B9R0.1 CC[C@H](C)COC[C@@H](C)O 7a_100009816381_100009817552 [1,1,0,0,0,0|2,0,0]=4 2438 B9R0.1 CC[C@H](C)CSCC(C)C 62a_100000210624_100009816398 [1,1,0,0,0,0|2,0,0]=4 2439 B9R0.1 CC[C@H](C)CSCC(C)C 62a_100009816398_100000210760 [1,1,0,0,0,0|2,0,0]=4 2440 B9R0.1 CC[C@H](C)CSCC(C)O 62a_100009816398_100011218427 [1,1,0,0,0,0|2,0,0]=4 2441 B9R0.1 CC[C@H](C)CSCC(C)O 62a_100011218427_100009816398 [1,1,0,0,0,0|2,0,0]=4 2442 B9R0.1 CC[C@H](C)CSC[C@@H](C)O 62a_100009816398_100009817552 [1,1,0,0,0,0|2,0,0]=4 2443 B9R0.1 CC[C@H](C)CSC[C@@H](C)O 62a_100009817552_100009816398 [1,1,0,0,0,0|2,0,0]=4 2444 B9R0.1 CNC(=O)CCCC(C)C 11a_106832991635_100011216857 [1,1,0,0,0,0|1,0,1]=4 2445 B9R0.1 CNC(=O)CCCC(C)C 1626a_100102657272_100011216857 [1,1,0,0,0,0|1,0,1]=4 2446 B9R0.1 CNC(=O)CCCC(C)C 240690a_100102657272_100011216857 [1,1,0,0,0,0|1,0,1]=4 2447 B9R0.1 CNC(=O)CCCC(C)C 527a_100102657272_100011216857 [1,1,0,0,0,0|1,0,1]=4 2448 B9R0.1 CNC(=O)CCCC(C)O 1626a_100102657272_100000761597 [1,1,0,0,0,0|1,0,1]=4 2449 B9R0.1 CNC(=O)CCCC(C)O 527a_100102657272_100000761597 [1,1,0,0,0,0|1,0,1]=4 2450 B9R0.1 CNC(C)CCC=C(C)C 270004a_106832991635_100000765506 [1,1,0,0,0,0|0,0,2]=4 2451 B9R0.1 CNC(C)CCCC(C)C 2230a_100000210607_200000210301 [1,1,0,0,0,0|0,0,0]=2 2452 B9R0.1 CNC(C)CCCC(C)C 270004a_106832991635_100000753411 [1,1,0,0,0,0|0,0,0]=2 2453 B9R0.1 CNC(C)CCOC(C)C 270004a_106832991635_200011219172 [1,1,0,0,0,0|1,0,0]=3 2454 B9R0.1 COC(C)CCCC(C)C 34a_200011218570_200000210301 [1,1,0,0,0,0|1,0,0]=3 2455 B9R0.1 COC(C)CCCC(C)C 7a_200011218570_200000210301 [1,1,0,0,0,0|1,0,0]=3 2456 B9R0.1 COC(C)CCOC(C)C 7a_100000764861_100000210206 [1,1,0,0,0,0|2,0,0]=4 2457 B9R0.1 COC(C)COCC(C)C 34a_100000690652_100000210624 [1,1,0,0,0,0|2,0,0]=4 2458 B9R0.1 COC(C)COCC(C)O 34a_100000690652_100011218427 [1,1,0,0,0,0|2,0,0]=4 2459 B9R0.1 COC(C)COC[C@@H](C)O 34a_100000690652_100009817552 [1,1,0,0,0,0|2,0,0]=4 2460 B9R0.1 COC(C)SCCC(C)C 62a_100000210312_100009879195 [1,1,0,0,0,0|2,0,0]=4 2461 B9R0.1 COC(C)SCCC(C)C 62a_100009879195_100000210312 [1,1,0,0,0,0|2,0,0]=4 2462 B9R0.1 COC(C)SCCC(C)O 62a_100009879195_100012276601 [1,1,0,0,0,0|2,0,0]=4 2463 B9R0.1 COC(C)SCCC(C)O 62a_100012276601_100009879195 [1,1,0,0,0,0|2,0,0]=4 2464 B9R0.1 CO[C@H](C)CNCC(C)C 2230a_100020591295_100000210760 [1,1,0,0,0,0|2,0,0]=4 2465 B9R0.1 CO[C@H](C)CNCC(C)C 270004a_100020591295_100000210432 [1,1,0,0,0,0|2,0,0]=4 2466 B9R0.1 CO[C@H](C)CNCC(C)O 2230a_100020591295_100011218427 [1,1,0,0,0,0|2,0,0]=4 2467 B9R0.1 CO[C@H](C)CNC[C@@H](C)O 2230a_100020591295_100009817552 [1,1,0,0,0,0|2,0,0]=4 2468 B9R0.1 C[C@@H](CO)COC[C@@H](C)Cl 34a_100016084084_100000059175 [1,1,0,0,0,0|2,0,0]=4 2469 B9R0.1 C[C@@H](CO)COC[C@@H](C)N 34a_100000737577_100000059175 [1,1,0,0,0,0|1,0,0]=3 2470 B9R0.1 C[C@@H](CO)CSC[C@@H](C)O 62a_100000059175_100009817552 [1,1,0,0,0,0|2,0,0]=4 2471 B9R0.1 C[C@@H](CO)CSC[C@@H](C)O 62a_100009817552_100000059175 [1,1,0,0,0,0|2,0,0]=4 2472 B9R0.1 C[C@@H](Cl)COCC(O)CO 34a_100016084084_100011219619 [1,1,0,0,0,0|2,0,0]=4 2473 B9R0.1 C[C@@H](Cl)COC[C@@H](O)CF 34a_100016084084_100015614560 [1,1,0,0,0,0|2,0,0]=4 2474 B9R0.1 C[C@@H](Cl)COC[C@@H](O)CO 34a_100016084084_100009815848 [1,1,0,0,0,0|2,0,0]=4 2475 B9R0.1 C[C@@H](N)COCC(O)CO 34a_100000737577_100011219619 [1,1,0,0,0,0|1,0,0]=3 2476 B9R0.1 C[C@@H](N)COC[C@@H](O)CF 34a_100000737577_100015614560 [1,1,0,0,0,0|1,0,0]=3 2477 B9R0.1 C[C@@H](N)COC[C@@H](O)CO 34a_100000737577_100009815848 [1,1,0,0,0,0|1,0,0]=3 2478 B9R0.1 C[C@@H](O)CNC[C@@H](F)CO 34a_100015665980_100009817552 [1,1,0,0,0,0|2,0,0]=4 2479 B9R0.1 C[C@@H](O)CNC[C@H](O)CO 2230a_100020644852_100009817552 [1,1,0,0,0,0|2,0,0]=4 2480 B9R0.1 C[C@@H](O)COCC(Cl)CCl 34a_100000033668_100009817552 [1,1,0,0,0,0|2,0,0]=4 2481 B9R0.1 C[C@@H](O)COC[C@H](F)CN 34a_100015665980_100009817552 [1,1,0,0,0,0|2,0,0]=4 2482 B9R0.1 C[C@@H](O)CSCC(O)CO 62a_100009817552_100011219619 [1,1,0,0,0,0|2,0,0]=4 2483 B9R0.1 C[C@@H](O)CSCC(O)CO 62a_100011219619_100009817552 [1,1,0,0,0,0|2,0,0]=4 2484 B9R0.1 C[C@@H](O)CSC[C@@H](O)CF 62a_100009817552_100015614560 [1,1,0,0,0,0|2,0,0]=4 2485 B9R0.1 C[C@@H](O)CSC[C@@H](O)CF 62a_100015614560_100009817552 [1,1,0,0,0,0|2,0,0]=4 2486 B9R0.1 C[C@@H](O)CSC[C@@H](O)CO 62a_100009815848_100009817552 [1,1,0,0,0,0|2,0,0]=4 2487 B9R0.1 C[C@@H](O)CSC[C@@H](O)CO 62a_100009817552_100009815848 [1,1,0,0,0,0|2,0,0]=4 2488 B9R0.7 CC(=O)C(C)CCC(C)C 1458a_100000070787_100011261404 [1,1,0,0,0,0|1,0,1]=4 2489 B9R0.7 CC(C)C(C)NC[C@@H](C)O 2230a_100000211541_100009817552 [1,1,0,0,0,0|2,0,0]=4 2490 B9R0.7 CC(C)C(C)OC[C@@H](C)O 7a_100000748068_100009817552 [1,1,0,0,0,0|2,0,0]=4 2491 B9R0.7 CC(C)CCC(=O)C(C)C 1458a_100000181311_100000210206 [1,1,0,0,0,0|1,0,1]=4 2492 B9R0.7 CC(C)CCC(=O)C(C)C 1458a_100000210198_100000210312 [1,1,0,0,0,0|1,0,1]=4 2493 B9R0.7 CC(C)CCC(=O)C(C)F 1458a_100000062450_100000210312 [1,1,0,0,0,0|1,0,1]=4 2494 B9R0.7 CC(C)CCC(=O)[C@@H](C)O 1458a_100000717761_100000210312 [1,1,0,0,0,0|1,0,1]=4 2495 B9R0.7 CC(C)CCC(=O)[C@H](C)O 1458a_217856618621_100000210312 [1,1,0,0,0,0|1,0,1]=4 2496 B9R0.7 CC(C)CCC(C)N(C)C 2230a_100102631434_100011261404 [1,1,0,0,0,0|2,0,0]=4 2497 B9R0.7 CC(C)CCC(C)N(C)C 269982a_100102631434_100011261404 [1,1,0,0,0,0|2,0,0]=4 2498 B9R0.7 CC(C)CCC(C)N(C)C 270004a_100102631434_100000210476 [1,1,0,0,0,0|2,0,0]=4 2499 B9R0.7 CC(C)CCN(C)C(C)C 2230a_100000742789_100000210206 [1,1,0,0,0,0|2,0,0]=4 2500 B9R0.7 CC(C)CCN(C)C(C)C 269982a_100000742789_100000210206 [1,1,0,0,0,0|2,0,0]=4 2501 B9R0.7 CC(C)CCN(C)C(C)C 269982a_200000211004_100000210312 [1,1,0,0,0,0|2,0,0]=4 2502 B9R0.7 CC(C)CNC(C)C(C)C 2230a_100000211541_100000210760 [1,1,0,0,0,0|2,0,0]=4 2503 B9R0.7 CC(C)CNC(C)C(C)C 270004a_100000211541_100000210432 [1,1,0,0,0,0|2,0,0]=4 2504 B9R0.7 CC(C)COC(C)C(C)C 7a_100000748068_100000210760 [1,1,0,0,0,0|2,0,0]=4 2505 B9R0.7 CC(C)NCC(O)C(C)C 2230a_100000759067_100000210206 [1,1,0,0,0,0|2,0,0]=4 2506 B9R0.7 CC(C)NCC(O)C(C)C 34a_100000759067_100000210206 [1,1,0,0,0,0|2,0,0]=4 2507 B9R0.7 CC(C)OC[C@H](N)C(C)C 34a_100011830312_100000210206 [1,1,0,0,0,0|2,0,0]=4 2508 B9R0.7 CC(O)CCC(=O)C(C)C 1458a_100000210198_100012276601 [1,1,0,0,0,0|1,0,1]=4 2509 B9R0.7 CC(O)CCC(=O)C(C)F 1458a_100000062450_100012276601 [1,1,0,0,0,0|1,0,1]=4 2510 B9R0.7 CC(O)CCC(=O)[C@@H](C)O 1458a_100000717761_100012276601 [1,1,0,0,0,0|1,0,1]=4 2511 B9R0.7 CC(O)CCC(=O)[C@H](C)O 1458a_217856618621_100012276601 [1,1,0,0,0,0|1,0,1]=4 2512 B9R0.7 CC(O)CCN(C)C(C)C 269982a_200000211004_100012276601 [1,1,0,0,0,0|2,0,0]=4 2513 B9R0.7 CC(O)CNC(C)C(C)C 2230a_100000211541_100011218427 [1,1,0,0,0,0|2,0,0]=4 2514 B9R0.7 CC(O)COC(C)C(C)C 7a_100000748068_100011218427 [1,1,0,0,0,0|2,0,0]=4 2515 B9R0.53 CC(C)CC(=O)CC(C)C 1458a_100000210554_100000210624 [1,1,0,0,0,0|1,0,1]=4 2516 B9R0.53 CC(C)CC(=O)CC(C)O 1458a_100000210554_100011218427 [1,1,0,0,0,0|1,0,1]=4 2517 B9R0.53 CC(C)CC(=O)C[C@@H](C)O 1458a_100011933948_100000210624 [1,1,0,0,0,0|1,0,1]=4 2518 B9R0.53 CC(C)CC(C)NC(C)C 2230a_100000692259_100000210206 [1,1,0,0,0,0|2,0,0]=4 2519 B9R0.53 CC(C)CC(C)NC(C)C 2230a_100138425928_100000731052 [1,1,0,0,0,0|2,0,0]=4 2520 B9R0.53 CC(C)CC(C)NC(C)C 34a_100138425928_100000731052 [1,1,0,0,0,0|2,0,0]=4 2521 B9R0.53 CC(C)CC(C)OC(C)C 34a_100000211805_100000210206 [1,1,0,0,0,0|2,0,0]=4 2522 B9R0.53 CC(C)CC(C)OC(C)C 34a_100000212225_100000731052 [1,1,0,0,0,0|2,0,0]=4 2523 B9R0.53 CC(C)CC(C)OC(C)C 7a_100000211805_100000210206 [1,1,0,0,0,0|2,0,0]=4 2524 B9R0.53 CC(C)CC(C)SC(C)C 62a_100000210206_100000731052 [1,1,0,0,0,0|2,0,0]=4 2525 B9R0.53 CC(C)CC(C)SC(C)C 62a_100000731052_100000210206 [1,1,0,0,0,0|2,0,0]=4 2526 B9R0.53 CC(C)CN(C)CC(C)C 2230a_100000201412_200000210301 [1,1,0,0,0,0|2,0,0]=4 2527 B9R0.53 CC(C)CN(C)CC(C)C 2230a_100000747067_100000210760 [1,1,0,0,0,0|2,0,0]=4 2528 B9R0.53 CC(C)CN(C)CC(C)C 269982a_100000201412_200000210301 [1,1,0,0,0,0|2,0,0]=4 2529 B9R0.53 CC(C)CN(C)CC(C)C 269982a_100000747067_100000210624 [1,1,0,0,0,0|2,0,0]=4 2530 B9R0.53 CC(C)CN(C)CC(C)C 270004a_100000747067_100000210432 [1,1,0,0,0,0|2,0,0]=4 2531 B9R0.53 CC(C)CN(C)CC(C)C 34a_100000201412_200000210301 [1,1,0,0,0,0|2,0,0]=4 2532 B9R0.53 CC(C)CN(C)CC(C)O 2230a_100000227577_100000210760 [1,1,0,0,0,0|2,0,0]=4 2533 B9R0.53 CC(C)CN(C)CC(C)O 2230a_100000747067_100011218427 [1,1,0,0,0,0|2,0,0]=4 2534 B9R0.53 CC(C)CN(C)CC(C)O 269982a_100000227577_100000210624 [1,1,0,0,0,0|2,0,0]=4 2535 B9R0.53 CC(C)CN(C)CC(C)O 269982a_100000747067_100011218427 [1,1,0,0,0,0|2,0,0]=4 2536 B9R0.53 CC(C)CN(C)CC(C)O 270004a_100000227577_100000210432 [1,1,0,0,0,0|2,0,0]=4 2537 B9R0.53 CC(C)CN(C)C[C@@H](C)O 2230a_100000747067_100009817552 [1,1,0,0,0,0|2,0,0]=4 2538 B9R0.53 CC(C)CN(C)C[C@@H](C)O 269982a_100000747067_100009817552 [1,1,0,0,0,0|2,0,0]=4 2539 B9R0.53 CC(C)CN([13CH3])CC(C)C 2230a_100000201412_200025704644 [1,1,0,0,0,0|2,0,0]=4 2540 B9R0.53 CC(C)CN([13CH3])CC(C)C 269982a_100000201412_200025704644 [1,1,0,0,0,0|2,0,0]=4 2541 B9R0.53 CC(C)CN([13CH3])CC(C)C 34a_100000201412_200025704644 [1,1,0,0,0,0|2,0,0]=4 2542 B9R0.53 CC(O)CC(=O)C[C@@H](C)O 1458a_100011933948_100011218427 [1,1,0,0,0,0|1,0,1]=4 2543 B9R0.53 CC(O)CN(C)CC(C)O 2230a_100000227577_100011218427 [1,1,0,0,0,0|2,0,0]=4 2544 B9R0.53 CC(O)CN(C)CC(C)O 2230a_100011218400_200000210301 [1,1,0,0,0,0|2,0,0]=4 2545 B9R0.53 CC(O)CN(C)CC(C)O 269982a_100000227577_100011218427 [1,1,0,0,0,0|2,0,0]=4 2546 B9R0.53 CC(O)CN(C)CC(C)O 269982a_100011218400_200000210301 [1,1,0,0,0,0|2,0,0]=4 2547 B9R0.53 CC(O)CN(C)C[C@@H](C)O 2230a_100000227577_100009817552 [1,1,0,0,0,0|2,0,0]=4 2548 B9R0.53 CC(O)CN(C)C[C@@H](C)O 269982a_100000227577_100009817552 [1,1,0,0,0,0|2,0,0]=4 2549 B9R0.53 CC(O)CN([13CH3])CC(C)O 2230a_100011218400_200025704644 [1,1,0,0,0,0|2,0,0]=4 2550 B9R0.53 CC(O)CN([13CH3])CC(C)O 269982a_100011218400_200025704644 [1,1,0,0,0,0|2,0,0]=4 2551 B9R0.10 CC(C)CC(=O)C(C)(C)O 1458a_100000242741_100000210624 [0,1,0,0,1,0|1,0,1]=4 2552 B9R0.10 CC(C)N[C@@H](C)C(C)(C)O 2230a_100025708725_100000210206 [0,1,0,0,1,0|2,0,0]=4 2553 B9R0.10 CC(O)CC(=O)C(C)(C)O 1458a_100000242741_100011218427 [0,1,0,0,1,0|1,0,1]=4 2554 B9R0.57 CC(C)C(=O)CC(C)(C)O 1458a_100000693243_100000210206 [0,1,0,0,1,0|1,0,1]=4 2555 B9R0.57 CC(C)N(C)CC(C)(C)O 2230a_100000755907_100000210206 [0,1,0,0,1,0|2,0,0]=4 2556 B9R0.57 CC(C)N(C)CC(C)(C)O 269982a_100000755907_100000210206 [0,1,0,0,1,0|2,0,0]=4 2557 B9R0.64 C#CC(C)(C)OC[C@@H](C)N 34a_100000737577_100000038118 [0,1,0,0,1,0|2,0,0]=4 2558 B9R0.64 CC(C)CCC(C)(C)O[13CH3] 7a_200011218267_200025704644 [0,1,0,0,1,0|1,0,0]=3 2559 B9R0.64 CC(C)CCC(C)(C)S[13CH3] 62a_200000037585_200025704644 [0,1,0,0,1,0|1,1,0]=4 2560 B9R0.64 CC(C)CCC(C)(C)S[13CH3] 62a_200025704644_200000037585 [0,1,0,0,1,0|1,1,0]=4 2561 B9R0.64 CC(C)CNC(C)(C)CO 2230a_100000210608_100000210760 [0,1,0,0,1,0|2,0,0]=4 2562 B9R0.64 CC(C)CNC(C)(C)CO 270004a_100000210608_100000210432 [0,1,0,0,1,0|2,0,0]=4 2563 B9R0.64 CC(C)NCC(C)(C)CO 2230a_100020635058_100000210206 [0,1,0,0,1,0|2,0,0]=4 2564 B9R0.64 CC(C)NCC(C)(C)CO 34a_100138425928_100009813988 [0,1,0,0,1,0|2,0,0]=4 2565 B9R0.64 CC(C)OCC(C)(C)CO 34a_100000212225_100009813988 [0,1,0,0,1,0|2,0,0]=4 2566 B9R0.64 CC(C)SCC(C)(C)CO 62a_100000210206_100009813988 [0,1,0,0,1,0|2,0,0]=4 2567 B9R0.64 CC(C)SCC(C)(C)CO 62a_100009813988_100000210206 [0,1,0,0,1,0|2,0,0]=4 2568 B9R0.64 CC(O)CNC(C)(C)CO 2230a_100000210608_100011218427 [0,1,0,0,1,0|2,0,0]=4 2569 B9R0.64 CNC(C)(C)CCC(C)C 34a_100102657272_200000037585 [0,1,0,0,1,0|2,0,0]=4 2570 B9R0.64 COC(C)(C)CCC(C)C 34a_100138415774_200000037585 [0,1,0,0,1,0|1,0,0]=3 2571 B9R0.64 COC(C)(C)CCC(C)C 7a_200011218267_200000210301 [0,1,0,0,1,0|1,0,0]=3 2572 B9R0.64 COC(C)(C)CNC(C)C 2230a_100000763424_100000210206 [0,1,0,0,1,0|2,0,0]=4 2573 B9R0.64 COC(C)(C)CNC(C)C 34a_100138425928_100000701081 [0,1,0,0,1,0|2,0,0]=4 2574 B9R0.64 COC(C)(C)COC(C)C 34a_100000212225_100000701081 [0,1,0,0,1,0|2,0,0]=4 2575 B9R0.64 COC(C)(C)CSC(C)C 62a_100000210206_100000701081 [0,1,0,0,1,0|2,0,0]=4 2576 B9R0.64 COC(C)(C)CSC(C)C 62a_100000701081_100000210206 [0,1,0,0,1,0|2,0,0]=4 2577 B9R0.64 CSC(C)(C)CCC(C)C 62a_200000037585_200000210301 [0,1,0,0,1,0|1,1,0]=4 2578 B9R0.64 CSC(C)(C)CCC(C)C 62a_200000210301_200000037585 [0,1,0,0,1,0|1,1,0]=4 2579 B9R0.64 C[C@@H](N)COC(C)(C)C#N 34a_100000737577_100011162410 [0,1,0,0,1,0|2,0,0]=4 2580 B9R0.64 C[C@@H](O)CNC(C)(C)CO 2230a_100000210608_100009817552 [0,1,0,0,1,0|2,0,0]=4 2581 B9R0.77 CC(C)(O)COC(C)(C)C 34a_100015890283_100000764493 [0,1,0,0,1,0|2,0,0]=4 2582 B9R0.77 CC(C)(O)COC(C)(C)C 7a_100015890283_100000764493 [0,1,0,0,1,0|2,0,0]=4 2583 B9R0.77 CC(C)(O)CSC(C)(C)C 62a_100000211941_100000764493 [0,1,0,0,1,0|2,0,0]=4 2584 B9R0.77 CC(C)(O)CSC(C)(C)C 62a_100000764493_100000211941 [0,1,0,0,1,0|2,0,0]=4 2585 B11R0.34 C=C(C)CCC(=O)CC(C)(C)O 1458a_100000693243_100000730704 [0,1,0,0,0,1|1,0,1]=4 2586 B11R0.34 C=C(C)CCN(C)CC(C)(C)O 2230a_100000755907_100000730704 [0,1,0,0,0,1|1,0,1]=4 2587 B11R0.34 C=C(C)CCN(C)CC(C)(C)O 269982a_100000755907_100000730704 [0,1,0,0,0,1|1,0,1]=4 2588 B11R0.34 CC(=O)CCN(C)CC(C)(C)O 269982a_100000755907_100000053229 [0,1,0,0,0,1|1,0,1]=4 2589 B11R0.34 CC(C)CCC(=O)CC(C)(C)C 1458a_100000211214_100000210312 [0,1,0,0,0,1|2,0,0]=4 2590 B11R0.34 CC(C)CCC(=O)CC(C)(C)O 1458a_100000693243_100000210312 [0,1,0,0,0,1|1,0,0]=3 2591 B11R0.34 CC(C)CCC(C)NC(C)(C)C 2230a_100000715429_100011261404 [0,1,0,0,0,1|2,0,0]=4 2592 B11R0.34 CC(C)CCC(C)OC(C)(C)C 34a_100011215350_100000210625 [0,1,0,0,0,1|2,0,0]=4 2593 B11R0.34 CC(C)CCC(C)OC(C)(C)C 34a_100015890283_100011261404 [0,1,0,0,0,1|2,0,0]=4 2594 B11R0.34 CC(C)CCC(C)SC(C)(C)C 62a_100000211941_100011261404 [0,1,0,0,0,1|2,0,0]=4 2595 B11R0.34 CC(C)CCC(C)SC(C)(C)C 62a_100011261404_100000211941 [0,1,0,0,0,1|2,0,0]=4 2596 B11R0.34 CC(C)CCN(C)CC(C)(C)C 2230a_100000742839_100000210312 [0,1,0,0,0,1|2,0,0]=4 2597 B11R0.34 CC(C)CCN(C)CC(C)(C)C 269982a_100000742839_100000210312 [0,1,0,0,0,1|2,0,0]=4 2598 B11R0.34 CC(C)CCN(C)CC(C)(C)C 270004a_100000742789_100011204126 [0,1,0,0,0,1|2,0,0]=4 2599 B11R0.34 CC(C)CCN(C)CC(C)(C)O 2230a_100000755907_100000210312 [0,1,0,0,0,1|1,0,0]=3 2600 B11R0.34 CC(C)CCN(C)CC(C)(C)O 269982a_100000755907_100000210312 [0,1,0,0,0,1|1,0,0]=3 2601 B11R0.34 CC(C)CNC(=O)CC(C)(C)O 527a_100000210953_100000693243 [0,1,0,0,0,1|1,0,1]=4 2602 B11R0.34 CC(C)CN[C@@H](C)CC(C)(C)C 2230a_106358413534_100000210760 [0,1,0,0,0,1|2,0,0]=4 2603 B11R0.34 CC(C)CN[C@@H](C)CC(C)(C)C 270004a_106358413534_100000210432 [0,1,0,0,0,1|2,0,0]=4 2604 B11R0.34 CC(C)COC(C)CC(C)(C)C 7a_200011218616_100000210760 [0,1,0,0,0,1|2,0,0]=4 2605 B11R0.34 CC(C)OCN(C)CC(C)(C)O 2230a_100000755907_100000709892 [0,1,0,0,0,1|2,0,0]=4 2606 B11R0.34 CC(C)OCN(C)CC(C)(C)O 269982a_100000755907_100000709892 [0,1,0,0,0,1|2,0,0]=4 2607 B11R0.34 CC(CC(C)(C)C)OC[C@@H](C)O 7a_200011218616_100009817552 [0,1,0,0,0,1|2,0,0]=4 2608 B11R0.34 CC(COC(C)C)CC(C)(C)C 7a_200011215325_100000210206 [0,1,0,0,0,1|2,0,0]=4 2609 B11R0.34 CC(O)CCC(=O)CC(C)(C)C 1458a_100000211214_100012276601 [0,1,0,0,0,1|2,0,0]=4 2610 B11R0.34 CC(O)CCC(=O)CC(C)(C)O 1458a_100000693243_100012276601 [0,1,0,0,0,1|1,0,0]=3 2611 B11R0.34 CC(O)CCN(C)CC(C)(C)C 2230a_100000742839_100012276601 [0,1,0,0,0,1|2,0,0]=4 2612 B11R0.34 CC(O)CCN(C)CC(C)(C)C 269982a_100000742839_100012276601 [0,1,0,0,0,1|2,0,0]=4 2613 B11R0.34 CC(O)CCN(C)CC(C)(C)O 2230a_100000755907_100012276601 [0,1,0,0,0,1|1,0,0]=3 2614 B11R0.34 CC(O)CCN(C)CC(C)(C)O 269982a_100000755907_100012276601 [0,1,0,0,0,1|1,0,0]=3 2615 B11R0.34 CC(O)CNC(=O)CC(C)(C)O 527a_100000210904_100000693243 [0,1,0,0,0,1|1,0,1]=4 2616 B11R0.34 CC(O)CN[C@@H](C)CC(C)(C)C 2230a_106358413534_100011218427 [0,1,0,0,0,1|2,0,0]=4 2617 B11R0.34 CC(O)COC(C)CC(C)(C)C 7a_200011218616_100011218427 [0,1,0,0,0,1|2,0,0]=4 2618 B11R0.34 CN(C)CCN(C)CC(C)(C)O 269982a_100000755907_100000755713 [0,1,0,0,0,1|2,0,0]=4 2619 B11R0.34 CN(CCC(=O)N)CC(C)(C)O 2230a_100000755907_100000744528 [0,1,0,0,0,1|1,0,1]=4 2620 B11R0.34 CN(CCC(=O)N)CC(C)(C)O 269982a_100000755907_100000744528 [0,1,0,0,0,1|1,0,1]=4 2621 B11R0.34 C[C@@H](O)CN[C@@H](C)CC(C)(C)C 2230a_106358413534_100009817552 [0,1,0,0,0,1|2,0,0]=4 2622 B11R0.84 C=C(C)CCN[C@@H](C)C(C)(C)O 2230a_100025708725_100000730704 [0,1,0,0,0,1|1,0,1]=4 2623 B11R0.84 CC(=O)CCCC(=O)C(C)(C)O 1458a_100000242741_100011215641 [0,1,0,0,0,1|1,0,1]=4 2624 B11R0.84 CC(C)(O)C(=O)CCCC(=O)N 1458a_100000242741_100102525003 [0,1,0,0,0,1|1,0,1]=4 2625 B11R0.84 CC(C)CCCC(=O)C(C)(C)C 1458a_106744555173_100011214892 [0,1,0,0,0,1|2,0,0]=4 2626 B11R0.84 CC(C)CCCC(=O)C(C)(C)F 1458a_100000765255_100011214892 [0,1,0,0,0,1|2,0,0]=4 2627 B11R0.84 CC(C)CCCC(=O)C(C)(C)O 1458a_100000242741_100011214892 [0,1,0,0,0,1|1,0,0]=3 2628 B11R0.84 CC(C)CCCN(C)C(C)(C)C 269982a_100011215553_100011214892 [0,1,0,0,0,1|2,0,0]=4 2629 B11R0.84 CC(C)CCNC(=O)C(C)(C)O 240690a_100000210545_100000242741 [0,1,0,0,0,1|1,0,1]=4 2630 B11R0.84 CC(C)CCNC(C)C(C)(C)O 269862a_100000210545_100000747739 [0,1,0,0,0,1|1,0,0]=3 2631 B11R0.84 CC(C)CCN[C@@H](C)C(C)(C)O 2230a_100025708725_100000210312 [0,1,0,0,0,1|1,0,0]=3 2632 B11R0.84 CC(C)CCN[C@@H](C)C(C)(C)O 269862a_100025708725_100000185833 [0,1,0,0,0,1|1,0,0]=3 2633 B11R0.84 CC(C)CCN[C@H](C)C(C)(C)C 2230a_100025703359_100000210312 [0,1,0,0,0,1|2,0,0]=4 2634 B11R0.84 CC(C)CCN[C@H](C)C(C)(C)C 269862a_100025703359_100000185833 [0,1,0,0,0,1|2,0,0]=4 2635 B11R0.84 CC(C)CNC[C@@H](F)C(C)(C)O 270004a_100015379105_100000210432 [0,1,0,0,0,1|1,0,0]=3 2636 B11R0.84 CC(C)OCCC(=O)C(C)(C)O 1458a_100000242741_100000211751 [0,1,0,0,0,1|1,0,1]=4 2637 B11R0.84 CC(C)OCN[C@@H](C)C(C)(C)O 2230a_100025708725_100000709892 [0,1,0,0,0,1|2,0,0]=4 2638 B11R0.84 CC(C)SCCC(=O)C(C)(C)O 1458a_100000242741_100000730970 [0,1,0,0,0,1|1,0,1]=4 2639 B11R0.84 CC(NCCC(=O)N)C(C)(C)O 269862a_100000740010_100000747739 [0,1,0,0,0,1|1,0,1]=4 2640 B11R0.84 CC(NCCN(C)C)C(C)(C)O 269862a_100000210585_100000747739 [0,1,0,0,0,1|2,0,0]=4 2641 B11R0.84 CC(O)CCCC(=O)C(C)(C)C 1458a_106744555173_200000718107 [0,1,0,0,0,1|2,0,0]=4 2642 B11R0.84 CC(O)CCCC(=O)C(C)(C)F 1458a_100000765255_200000718107 [0,1,0,0,0,1|2,0,0]=4 2643 B11R0.84 CC(O)CCCC(=O)C(C)(C)O 1458a_100000242741_200000718107 [0,1,0,0,0,1|1,0,0]=3 2644 B11R0.84 CC(O)CCCN(C)C(C)(C)C 269982a_100011215553_200000718107 [0,1,0,0,0,1|2,0,0]=4 2645 B11R0.84 CC(O)CCNC(=O)C(C)(C)O 240690a_200000755665_100000242741 [0,1,0,0,0,1|1,0,1]=4 2646 B11R0.84 CC(O)CCNC(C)C(C)(C)O 269862a_200000755665_100000747739 [0,1,0,0,0,1|1,0,0]=3 2647 B11R0.84 CC(O)CCN[C@@H](C)C(C)(C)O 2230a_100025708725_100012276601 [0,1,0,0,0,1|1,0,0]=3 2648 B11R0.84 CC(O)CCN[C@H](C)C(C)(C)C 2230a_100025703359_100012276601 [0,1,0,0,0,1|2,0,0]=4 2649 B11R0.84 CN(C)CCCC(=O)C(C)(C)O 1458a_100000242741_100000695564 [0,1,0,0,0,1|2,0,0]=4 2650 B11R0.84 C[C@@H](N)COCC(=O)C(C)(C)C 34a_100000737577_100000229897 [0,1,0,0,0,1|1,0,1]=4 2651 B11R0.84 C[C@H](NCCC(=O)N)C(C)(C)O 2230a_100025708725_100000744528 [0,1,0,0,0,1|1,0,1]=4 2652 B11R0.114 C#CC(C)NCCCC(C)(C)O 2230a_100000707721_100009888830 [0,1,0,0,0,1|1,0,0]=3 2653 B11R0.114 C#CC(C)NCCCC(C)(C)O 34a_100000707721_100009888830 [0,1,0,0,0,1|1,0,0]=3 2654 B11R0.114 C#CC(C)SCCCC(C)(C)O 62a_200000035995_100009888830 [0,1,0,0,0,1|1,0,0]=3 2655 B11R0.114 C#C[C@@H](C)OCCCC(C)(C)O 34a_100009815206_100009888830 [0,1,0,0,0,1|1,0,0]=3 2656 B11R0.114 C#C[C@@H](C)OCCCC(C)(C)O 7a_100009815206_100009888830 [0,1,0,0,0,1|1,0,0]=3 2657 B11R0.114 C=CC(C)COCCC(C)(C)C 34a_100011215527_100000755188 [0,1,0,0,0,1|2,0,0]=4 2658 B11R0.114 C=CC(C)COCCC(C)(C)C 7a_100011215527_100000755188 [0,1,0,0,0,1|2,0,0]=4 2659 B11R0.114 C=CC(C)COCCC(C)(C)O 34a_100011215527_100000702414 [0,1,0,0,0,1|1,0,0]=3 2660 B11R0.114 C=CC(C)COCCC(C)(C)O 7a_100011215527_100000702414 [0,1,0,0,0,1|1,0,0]=3 2661 B11R0.114 C=CC(C)OCCCC(C)(C)O 34a_100000695699_100009888830 [0,1,0,0,0,1|1,0,0]=3 2662 B11R0.114 C=CC(C)SCCCC(C)(C)O 62a_100011215867_100009888830 [0,1,0,0,0,1|1,0,0]=3 2663 B11R0.114 C=CC(O)CSCCC(C)(C)O 62a_100000702414_100000730141 [0,1,0,0,0,1|1,0,1]=4 2664 B11R0.114 C=CC(O)CSCCC(C)(C)O 62a_100000730141_100000702414 [0,1,0,0,0,1|1,0,1]=4 2665 B11R0.114 C=C[C@H](N)COCCC(C)(C)C 34a_100016989147_100000755188 [0,1,0,0,0,1|1,0,1]=4 2666 B11R0.114 C=C[C@H](N)COCCC(C)(C)O 34a_100016989147_100000702414 [0,1,0,0,0,1|0,0,1]=3 2667 B11R0.114 CC(C#N)NCCCC(C)(C)O 2230a_100000737613_100009888830 [0,1,0,0,0,1|0,0,1]=3 2668 B11R0.114 CC(C#N)OCCCC(C)(C)O 34a_100011218135_100009888830 [0,1,0,0,0,1|0,0,1]=3 2669 B11R0.114 CC(C#N)SCCCC(C)(C)O 62a_100000703298_100009888830 [0,1,0,0,0,1|0,0,1]=3 2670 B11R0.114 CC(C#N)SCCCC(C)(C)O 62a_100009888830_100000703298 [0,1,0,0,0,1|0,0,1]=3 2671 B11R0.114 CC(C)(C)CCNCC(O)CO 2230a_100000738805_100011219619 [0,1,0,0,0,1|2,0,0]=4 2672 B11R0.114 CC(C)(C)CCNC[C@@H](F)CO 34a_100015665980_100000755188 [0,1,0,0,0,1|2,0,0]=4 2673 B11R0.114 CC(C)(C)CCNC[C@@H](O)CF 2230a_100000738805_100015614560 [0,1,0,0,0,1|2,0,0]=4 2674 B11R0.114 CC(C)(C)CCNC[C@@H](O)CO 2230a_100000738805_100009815848 [0,1,0,0,0,1|2,0,0]=4 2675 B11R0.114 CC(C)(C)CCNC[C@H](O)CO 2230a_100020644852_100000755188 [0,1,0,0,0,1|2,0,0]=4 2676 B11R0.114 CC(C)(C)CCOCC(Cl)CCl 34a_100000033668_100000755188 [0,1,0,0,0,1|2,0,0]=4 2677 B11R0.114 CC(C)(C)CCOCC(O)CO 7a_100000765024_100011219619 [0,1,0,0,0,1|2,0,0]=4 2678 B11R0.114 CC(C)(C)CCOC[C@@H](O)CF 7a_100000765024_100015614560 [0,1,0,0,0,1|2,0,0]=4 2679 B11R0.114 CC(C)(C)CCOC[C@@H](O)CO 7a_100000765024_100009815848 [0,1,0,0,0,1|2,0,0]=4 2680 B11R0.114 CC(C)(C)CCOC[C@H](F)CN 34a_100015665980_100000755188 [0,1,0,0,0,1|2,0,0]=4 2681 B11R0.114 CC(C)(C)CCSCC(O)CO 62a_100000755188_100011219619 [0,1,0,0,0,1|2,0,0]=4 2682 B11R0.114 CC(C)(C)CCSCC(O)CO 62a_100011219619_100000755188 [0,1,0,0,0,1|2,0,0]=4 2683 B11R0.114 CC(C)(C)CCSC[C@@H](O)CF 62a_100000755188_100015614560 [0,1,0,0,0,1|2,0,0]=4 2684 B11R0.114 CC(C)(C)CCSC[C@@H](O)CF 62a_100015614560_100000755188 [0,1,0,0,0,1|2,0,0]=4 2685 B11R0.114 CC(C)(C)CCSC[C@@H](O)CO 62a_100000755188_100009815848 [0,1,0,0,0,1|2,0,0]=4 2686 B11R0.114 CC(C)(C)CCSC[C@@H](O)CO 62a_100009815848_100000755188 [0,1,0,0,0,1|2,0,0]=4 2687 B11R0.114 CC(C)(F)CCNCC(O)CO 2230a_100016253952_100011219619 [0,1,0,0,0,1|2,0,0]=4 2688 B11R0.114 CC(C)(F)CCNC[C@@H](O)CF 2230a_100016253952_100015614560 [0,1,0,0,0,1|2,0,0]=4 2689 B11R0.114 CC(C)(F)CCNC[C@@H](O)CO 2230a_100016253952_100009815848 [0,1,0,0,0,1|2,0,0]=4 2690 B11R0.114 CC(C)(O)CCCSC(F)C#N 62a_100009888830_200000117898 [0,1,0,0,0,1|1,0,1]=4 2691 B11R0.114 CC(C)(O)CCCSC(F)C#N 62a_200000117898_100009888830 [0,1,0,0,0,1|1,0,1]=4 2692 B11R0.114 CC(C)(O)CCNC[C@@H](F)CO 34a_100015665980_100000702414 [0,1,0,0,0,1|1,0,0]=3 2693 B11R0.114 CC(C)(O)CCNC[C@H](O)CO 2230a_100020644852_100000702414 [0,1,0,0,0,1|1,0,0]=3 2694 B11R0.114 CC(C)(O)CCOCC(Cl)CCl 34a_100000033668_100000702414 [0,1,0,0,0,1|1,0,0]=3 2695 B11R0.114 CC(C)(O)CCOC[C@H](F)CN 34a_100015665980_100000702414 [0,1,0,0,0,1|1,0,0]=3 2696 B11R0.114 CC(C)(O)CCSCC(O)CO 62a_100000702414_100011219619 [0,1,0,0,0,1|1,0,0]=3 2697 B11R0.114 CC(C)(O)CCSCC(O)CO 62a_100011219619_100000702414 [0,1,0,0,0,1|1,0,0]=3 2698 B11R0.114 CC(C)(O)CCSC[C@@H](O)CF 62a_100000702414_100015614560 [0,1,0,0,0,1|1,0,0]=3 2699 B11R0.114 CC(C)(O)CCSC[C@@H](O)CF 62a_100015614560_100000702414 [0,1,0,0,0,1|1,0,0]=3 2700 B11R0.114 CC(C)(O)CCSC[C@@H](O)CO 62a_100000702414_100009815848 [0,1,0,0,0,1|1,0,0]=3 2701 B11R0.114 CC(C)(O)CCSC[C@@H](O)CO 62a_100009815848_100000702414 [0,1,0,0,0,1|1,0,0]=3 2702 B11R0.114 CC(C)(O)COCCC(=NO)N 34a_100000749954_100000764493 [0,1,0,0,0,1|1,0,1]=4 2703 B11R0.114 CC(CF)OCCCC(C)(C)O 34a_100016041109_100009888830 [0,1,0,0,0,1|1,0,0]=3 2704 B11R0.114 CC(CF)OCCCC(C)(C)O 7a_100016041109_100009888830 [0,1,0,0,0,1|1,0,0]=3 2705 B11R0.114 CC(CN)COCCC(C)(C)C 34a_100000744482_100000755188 [0,1,0,0,0,1|1,0,0]=3 2706 B11R0.114 CC(CN)COCCC(C)(C)O 34a_100000744482_100000702414 [0,1,0,0,0,1|0,0,0]=2 2707 B11R0.114 CC(CN)COCC[N+](C)(C)C 34a_100000744482_100000085578 [0,1,0,0,0,1|2,0,0]=4 2708 B11R0.114 CC(CN)COCC[Si](C)(C)C 34a_100000744482_200000733723 [0,1,0,0,0,1|1,1,0]=4 2709 B11R0.114 CC(CN)OCCCC(C)(C)O 34a_100000210904_100009888830 [0,1,0,0,0,1|0,0,0]=2 2710 B11R0.114 CC(CN)OCCC[N+](C)(C)C 34a_100000210904_100016990835 [0,1,0,0,0,1|2,0,0]=4 2711 B11R0.114 CC(CN)OCCC[Si](C)(C)C 34a_100000210904_100011219597 [0,1,0,0,0,1|1,1,0]=4 2712 B11R0.114 CC(CO)CCNCC(C)(C)C 270004a_106354213184_100011204126 [0,1,0,0,0,1|2,0,0]=4 2713 B11R0.114 CC(CO)CCNCC(C)(C)C 34a_106354213184_100011219605 [0,1,0,0,0,1|2,0,0]=4 2714 B11R0.114 CC(CO)CCNCC(C)(C)F 34a_106354213184_100011997219 [0,1,0,0,0,1|2,0,0]=4 2715 B11R0.114 CC(CO)CCNCC(C)(C)O 34a_106354213184_100000764493 [0,1,0,0,0,1|1,0,0]=3 2716 B11R0.114 CC(CO)CNCCC(C)(C)C 34a_100000744482_100000755188 [0,1,0,0,0,1|2,0,0]=4 2717 B11R0.114 CC(CO)CNCCC(C)(C)O 34a_100000744482_100000702414 [0,1,0,0,0,1|1,0,0]=3 2718 B11R0.114 CC(CO)SCCCC(C)(C)O 62a_100012180447_100009888830 [0,1,0,0,0,1|1,0,0]=3 2719 B11R0.114 CCC(=O)COCCC(C)(C)O 34a_100000725409_100000702414 [0,1,0,0,0,1|1,0,1]=4 2720 B11R0.114 CCC(=O)CSCCC(C)(C)O 62a_100000702414_100000747405 [0,1,0,0,0,1|1,0,1]=4 2721 B11R0.114 CCC(=O)CSCCC(C)(C)O 62a_100000747405_100000702414 [0,1,0,0,0,1|1,0,1]=4 2722 B11R0.114 CCC(C)CCNCC(C)(C)C 270004a_100020591266_100011204126 [0,1,0,0,0,1|2,0,0]=4 2723 B11R0.114 CCC(C)CCOCC(C)(C)O 7a_100011215188_100000764493 [0,1,0,0,0,1|1,0,0]=3 2724 B11R0.114 CCC(C)CNCCC(C)(C)C 2230a_100000738805_100000748023 [0,1,0,0,0,1|2,0,0]=4 2725 B11R0.114 CCC(C)CNCCC(C)(C)C 2230a_100020588543_100000755188 [0,1,0,0,0,1|2,0,0]=4 2726 B11R0.114 CCC(C)CNCCC(C)(C)C 270004a_100000738805_100000243153 [0,1,0,0,0,1|2,0,0]=4 2727 B11R0.114 CCC(C)CNCCC(C)(C)F 2230a_100016253952_100000748023 [0,1,0,0,0,1|2,0,0]=4 2728 B11R0.114 CCC(C)CNCCC(C)(C)F 270004a_100016253952_100000243153 [0,1,0,0,0,1|2,0,0]=4 2729 B11R0.114 CCC(C)CNCCC(C)(C)O 2230a_100020588543_100000702414 [0,1,0,0,0,1|1,0,0]=3 2730 B11R0.114 CCC(C)CNCCC(C)(C)O 270004a_100000707701_100000243153 [0,1,0,0,0,1|1,0,0]=3 2731 B11R0.114 CCC(C)COCCC(C)(C)C 7a_100000765024_100000748023 [0,1,0,0,0,1|2,0,0]=4 2732 B11R0.114 CCC(C)CSCCC(C)(C)C 62a_100000748023_100000755188 [0,1,0,0,0,1|2,0,0]=4 2733 B11R0.114 CCC(C)CSCCC(C)(C)C 62a_100000755188_100000748023 [0,1,0,0,0,1|2,0,0]=4 2734 B11R0.114 CCC(C)CSCCC(C)(C)O 62a_100000702414_100000748023 [0,1,0,0,0,1|1,0,0]=3 2735 B11R0.114 CCC(C)CSCCC(C)(C)O 62a_100000748023_100000702414 [0,1,0,0,0,1|1,0,0]=3 2736 B11R0.114 CCC(C)NCCCC(C)(C)O 2230a_100000209981_100009888830 [0,1,0,0,0,1|1,0,0]=3 2737 B11R0.114 CCC(C)OCCCC(C)(C)O 7a_100000210228_100009888830 [0,1,0,0,0,1|1,0,0]=3 2738 B11R0.114 CCC(C)SCCCC(C)(C)O 62a_100000758301_100009888830 [0,1,0,0,0,1|1,0,0]=3 2739 B11R0.114 CCC(C)SCCCC(C)(C)O 62a_100009888830_100000758301 [0,1,0,0,0,1|1,0,0]=3 2740 B11R0.114 CCC(O)CNCCC(C)(C)C 2230a_100000738805_100011218378 [0,1,0,0,0,1|2,0,0]=4 2741 B11R0.114 CCC(O)CNCCC(C)(C)C 2230a_100011218483_100000755188 [0,1,0,0,0,1|2,0,0]=4 2742 B11R0.114 CCC(O)CNCCC(C)(C)F 2230a_100016253952_100011218378 [0,1,0,0,0,1|2,0,0]=4 2743 B11R0.114 CCC(O)CNCCC(C)(C)O 2230a_100011218483_100000702414 [0,1,0,0,0,1|1,0,0]=3 2744 B11R0.114 CCC(O)COCCC(C)(C)C 7a_100000765024_100011218378 [0,1,0,0,0,1|2,0,0]=4 2745 B11R0.114 CCC(O)CSCCC(C)(C)C 62a_100000755188_100011218378 [0,1,0,0,0,1|2,0,0]=4 2746 B11R0.114 CCC(O)CSCCC(C)(C)C 62a_100011218378_100000755188 [0,1,0,0,0,1|2,0,0]=4 2747 B11R0.114 CCC(O)CSCCC(C)(C)O 62a_100000702414_100011218378 [0,1,0,0,0,1|1,0,0]=3 2748 B11R0.114 CCC(O)CSCCC(C)(C)O 62a_100011218378_100000702414 [0,1,0,0,0,1|1,0,0]=3 2749 B11R0.114 CC[C@H](C)CNCCC(C)(C)C 2230a_100000738805_100009816398 [0,1,0,0,0,1|2,0,0]=4 2750 B11R0.114 CC[C@H](C)CNCCC(C)(C)F 2230a_100016253952_100009816398 [0,1,0,0,0,1|2,0,0]=4 2751 B11R0.114 CC[C@H](C)COCCC(C)(C)C 7a_100000765024_100009816398 [0,1,0,0,0,1|2,0,0]=4 2752 B11R0.114 CC[C@H](C)COCCC(C)(C)C 7a_100009816381_100000755188 [0,1,0,0,0,1|2,0,0]=4 2753 B11R0.114 CC[C@H](C)COCCC(C)(C)O 7a_100009816381_100000702414 [0,1,0,0,0,1|1,0,0]=3 2754 B11R0.114 CC[C@H](C)CSCCC(C)(C)C 62a_100000755188_100009816398 [0,1,0,0,0,1|2,0,0]=4 2755 B11R0.114 CC[C@H](C)CSCCC(C)(C)C 62a_100009816398_100000755188 [0,1,0,0,0,1|2,0,0]=4 2756 B11R0.114 CC[C@H](C)CSCCC(C)(C)O 62a_100000702414_100009816398 [0,1,0,0,0,1|1,0,0]=3 2757 B11R0.114 CC[C@H](C)CSCCC(C)(C)O 62a_100009816398_100000702414 [0,1,0,0,0,1|1,0,0]=3 2758 B11R0.114 CNC(=O)CCNCC(C)(C)O 2230a_100000751335_100000737683 [0,1,0,0,0,1|1,0,1]=4 2759 B11R0.114 CNC(=O)CCNCC(C)(C)O 34a_100000738227_100000764493 [0,1,0,0,0,1|1,0,1]=4 2760 B11R0.114 CNC(=O)CCOCC(C)(C)O 34a_100000754576_100000764493 [0,1,0,0,0,1|1,0,1]=4 2761 B11R0.114 CNC(=O)CCSCC(C)(C)O 62a_100000737683_100000764493 [0,1,0,0,0,1|1,0,1]=4 2762 B11R0.114 CNC(=O)CCSCC(C)(C)O 62a_100000764493_100000737683 [0,1,0,0,0,1|1,0,1]=4 2763 B11R0.114 CNC(=O)CNCCC(C)(C)O 2230a_100000693194_100000702414 [0,1,0,0,0,1|1,0,1]=4 2764 B11R0.114 CNC(=O)COCCC(C)(C)O 34a_100000750040_100000702414 [0,1,0,0,0,1|1,0,1]=4 2765 B11R0.114 CNC(=O)CSCCC(C)(C)O 62a_100000183359_100000702414 [0,1,0,0,0,1|1,0,1]=4 2766 B11R0.114 CNC(=O)CSCCC(C)(C)O 62a_100000702414_100000183359 [0,1,0,0,0,1|1,0,1]=4 2767 B11R0.114 COC(=O)CCNCC(C)(C)O 2230a_100000751335_100000204255 [0,1,0,0,0,1|1,0,1]=4 2768 B11R0.114 COC(=O)CCSCC(C)(C)O 62a_100000204255_100000764493 [0,1,0,0,0,1|1,0,1]=4 2769 B11R0.114 COC(=O)CCSCC(C)(C)O 62a_100000764493_100000204255 [0,1,0,0,0,1|1,0,1]=4 2770 B11R0.114 COC(=O)CSCCC(C)(C)O 62a_100000702414_100000747449 [0,1,0,0,0,1|1,0,1]=4 2771 B11R0.114 COC(=O)CSCCC(C)(C)O 62a_100000747449_100000702414 [0,1,0,0,0,1|1,0,1]=4 2772 B11R0.114 COC(C)CCOCC(C)(C)O 7a_100000764861_100000764493 [0,1,0,0,0,1|1,0,0]=3 2773 B11R0.114 COC(C)COCCC(C)(C)C 34a_100000690652_100000755188 [0,1,0,0,0,1|2,0,0]=4 2774 B11R0.114 COC(C)COCCC(C)(C)O 34a_100000690652_100000702414 [0,1,0,0,0,1|1,0,0]=3 2775 B11R0.114 COC(C)SCCCC(C)(C)O 62a_100009879195_100009888830 [0,1,0,0,0,1|1,0,0]=3 2776 B11R0.114 COC(C)SCCCC(C)(C)O 62a_100009888830_100009879195 [0,1,0,0,0,1|1,0,0]=3 2777 B11R0.114 CO[C@H](C)CNCCC(C)(C)C 2230a_100020591295_100000755188 [0,1,0,0,0,1|2,0,0]=4 2778 B11R0.114 CO[C@H](C)CNCCC(C)(C)O 2230a_100020591295_100000702414 [0,1,0,0,0,1|1,0,0]=3 2779 B11R0.114 C[C@@H](CN)CCCOC(C)(C)C 34a_100160569302_100000210625 [0,1,0,0,0,1|1,0,0]=3 2780 B11R0.114 C[C@@H](CO)CNCCC(C)(C)C 2230a_100000738805_100000059175 [0,1,0,0,0,1|2,0,0]=4 2781 B11R0.114 C[C@@H](CO)CNCCC(C)(C)F 2230a_100016253952_100000059175 [0,1,0,0,0,1|2,0,0]=4 2782 B11R0.114 C[C@@H](CO)COCCC(C)(C)C 7a_100000765024_100000059175 [0,1,0,0,0,1|2,0,0]=4 2783 B11R0.114 C[C@@H](CO)CSCCC(C)(C)C 62a_100000059175_100000755188 [0,1,0,0,0,1|2,0,0]=4 2784 B11R0.114 C[C@@H](CO)CSCCC(C)(C)C 62a_100000755188_100000059175 [0,1,0,0,0,1|2,0,0]=4 2785 B11R0.114 C[C@@H](CO)CSCCC(C)(C)O 62a_100000059175_100000702414 [0,1,0,0,0,1|1,0,0]=3 2786 B11R0.114 C[C@@H](CO)CSCCC(C)(C)O 62a_100000702414_100000059175 [0,1,0,0,0,1|1,0,0]=3 2787 B11R0.114 C[C@H](CO)NCCCC(C)(C)O 2230a_100000737577_100009888830 [0,1,0,0,0,1|1,0,0]=3 2788 B11R0.114 C[C@H](CO)SCCCC(C)(C)O 62a_100009888830_100016084084 [0,1,0,0,0,1|1,0,0]=3 2789 B11R0.114 C[C@H](CO)SCCCC(C)(C)O 62a_100016084084_100009888830 [0,1,0,0,0,1|1,0,0]=3 2790 B11R0.127 C#CC(C)(C)NCCCC(C)C 34a_100000054563_100011214892 [0,1,0,0,0,1|2,0,0]=4 2791 B11R0.127 C#CC(C)(C)NCCCC(C)C 34a_200000737386_100000038118 [0,1,0,0,0,1|2,0,0]=4 2792 B11R0.127 C#CC(C)(C)NCCCC(C)O 34a_100000054563_200000718107 [0,1,0,0,0,1|2,0,0]=4 2793 B11R0.127 C#CC(C)(C)OCCCC(C)C 34a_100000189450_100011214892 [0,1,0,0,0,1|2,0,0]=4 2794 B11R0.127 C#CC(C)(C)OCCCC(C)C 34a_100000210774_100000038118 [0,1,0,0,0,1|2,0,0]=4 2795 B11R0.127 C#CC(C)(C)OCCCC(C)C 7a_100000189450_100011214892 [0,1,0,0,0,1|2,0,0]=4 2796 B11R0.127 C#CC(C)(C)OCCCC(C)O 34a_100000189450_200000718107 [0,1,0,0,0,1|2,0,0]=4 2797 B11R0.127 C#CC(C)(C)OCCCC(C)O 7a_100000189450_200000718107 [0,1,0,0,0,1|2,0,0]=4 2798 B11R0.127 C#CC(C)(C)SCCCC(C)C 62a_100000038118_100011214892 [0,1,0,0,0,1|2,0,0]=4 2799 B11R0.127 C#CC(C)(C)SCCCC(C)C 62a_100011214892_100000038118 [0,1,0,0,0,1|2,0,0]=4 2800 B11R0.127 C#CC(C)(C)SCCCC(C)O 62a_100000038118_200000718107 [0,1,0,0,0,1|2,0,0]=4 2801 B11R0.127 C#CC(C)(C)SCCCC(C)O 62a_200000718107_100000038118 [0,1,0,0,0,1|2,0,0]=4 2802 B11R0.127 C=C(C)CCNCC(C)(C)CO 2230a_100020635058_100000730704 [0,1,0,0,0,1|1,0,1]=4 2803 B11R0.127 C=C(C)CCNCC(C)(C)OC 2230a_100000763424_100000730704 [0,1,0,0,0,1|1,0,1]=4 2804 B11R0.127 C=C(C)CCOCC(C)(C)CO 34a_100000764851_100009813988 [0,1,0,0,0,1|1,0,1]=4 2805 B11R0.127 C=C(C)CCOCC(C)(C)OC 34a_100000764851_100000701081 [0,1,0,0,0,1|1,0,1]=4 2806 B11R0.127 C=C(C)CCSCC(C)(C)CO 62a_100000730704_100009813988 [0,1,0,0,0,1|1,0,1]=4 2807 B11R0.127 C=C(C)CCSCC(C)(C)CO 62a_100009813988_100000730704 [0,1,0,0,0,1|1,0,1]=4 2808 B11R0.127 C=C(C)CCSCC(C)(C)OC 62a_100000701081_100000730704 [0,1,0,0,0,1|1,0,1]=4 2809 B11R0.127 C=C(C)CCSCC(C)(C)OC 62a_100000730704_100000701081 [0,1,0,0,0,1|1,0,1]=4 2810 B11R0.127 C=C(C)COCCC(C)(C)OC 7a_100000699976_100000748629 [0,1,0,0,0,1|1,0,1]=4 2811 B11R0.127 C=CC(C)(C)OCCCC(C)C 34a_100011215311_100011214892 [0,1,0,0,0,1|2,0,0]=4 2812 B11R0.127 C=CC(C)(C)OCCCC(C)C 7a_100011215311_100011214892 [0,1,0,0,0,1|2,0,0]=4 2813 B11R0.127 C=CC(C)(C)OCCCC(C)O 34a_100011215311_200000718107 [0,1,0,0,0,1|2,0,0]=4 2814 B11R0.127 C=CC(C)(C)OCCCC(C)O 7a_100011215311_200000718107 [0,1,0,0,0,1|2,0,0]=4 2815 B11R0.127 CC(=O)CCOCC(C)(C)CO 34a_100000759926_100009813988 [0,1,0,0,0,1|1,0,1]=4 2816 B11R0.127 CC(=O)CCOCC(C)(C)CO 7a_100000759926_100009813988 [0,1,0,0,0,1|1,0,1]=4 2817 B11R0.127 CC(=O)CCSCC(C)(C)CO 62a_100000053229_100009813988 [0,1,0,0,0,1|1,0,1]=4 2818 B11R0.127 CC(=O)CCSCC(C)(C)CO 62a_100009813988_100000053229 [0,1,0,0,0,1|1,0,1]=4 2819 B11R0.127 CC(=O)NCCCC(C)(C)CO 240690a_100000039164_100015343762 [0,1,0,0,0,1|1,0,1]=4 2820 B11R0.127 CC(=O)NCCCC(C)(C)CO 527a_100000039164_100103153847 [0,1,0,0,0,1|1,0,1]=4 2821 B11R0.127 CC(Br)CCOCC(C)(C)CO 34a_100009893172_100009813988 [0,1,0,0,0,1|1,0,0]=3 2822 B11R0.127 CC(C)(CO)CNCCC(=O)N 2230a_100020635058_100000744528 [0,1,0,0,0,1|1,0,1]=4 2823 B11R0.127 CC(C)(CO)COCCC(=O)N 34a_100000757172_100009813988 [0,1,0,0,0,1|1,0,1]=4 2824 B11R0.127 CC(C)(CO)COCCC(=O)N 7a_100000757172_100009813988 [0,1,0,0,0,1|1,0,1]=4 2825 B11R0.127 CC(C)(CO)COCCC(F)F 34a_100103093639_100009813988 [0,1,0,0,0,1|2,0,0]=4 2826 B11R0.127 CC(C)(CO)CSCCC(=O)N 62a_100000744528_100009813988 [0,1,0,0,0,1|1,0,1]=4 2827 B11R0.127 CC(C)(CO)CSCCC(=O)N 62a_100009813988_100000744528 [0,1,0,0,0,1|1,0,1]=4 2828 B11R0.127 CC(C)CCCNC(C)(C)C#N 34a_200000737386_100011162410 [0,1,0,0,0,1|2,0,0]=4 2829 B11R0.127 CC(C)CCCNC(C)(C)CO 2230a_100000210608_100011214892 [0,1,0,0,0,1|1,0,0]=3 2830 B11R0.127 CC(C)CCCOC(C)(C)C#N 34a_100000210774_100011162410 [0,1,0,0,0,1|2,0,0]=4 2831 B11R0.127 CC(C)CCCOC(C)(C)C#N 34a_200015195151_100011214892 [0,1,0,0,0,1|2,0,0]=4 2832 B11R0.127 CC(C)CCCOC(C)(C)C#N 7a_100000210774_100011162410 [0,1,0,0,0,1|2,0,0]=4 2833 B11R0.127 CC(C)CCCOC(C)(C)CCl 7a_100000764493_100011214892 [0,1,0,0,0,1|2,0,0]=4 2834 B11R0.127 CC(C)CCCSC(C)(C)C#N 62a_100011162410_100011214892 [0,1,0,0,0,1|2,0,0]=4 2835 B11R0.127 CC(C)CCCSC(C)(C)C#N 62a_100011214892_100011162410 [0,1,0,0,0,1|2,0,0]=4 2836 B11R0.127 CC(C)CCNCC(C)(C)CO 2230a_100020635058_100000210312 [0,1,0,0,0,1|1,0,0]=3 2837 B11R0.127 CC(C)CCNCC(C)(C)CO 269862a_100020635058_100000185833 [0,1,0,0,0,1|1,0,0]=3 2838 B11R0.127 CC(C)CCOCC(C)(C)CCl 7a_100011217199_100000210626 [0,1,0,0,0,1|2,0,0]=4 2839 B11R0.127 CC(C)CCOCC(C)(C)CO 34a_100000210254_100009813988 [0,1,0,0,0,1|1,0,0]=3 2840 B11R0.127 CC(C)CCOCC(C)(C)CO 7a_100000210254_100009813988 [0,1,0,0,0,1|1,0,0]=3 2841 B11R0.127 CC(C)CCSCC(C)(C)CO 62a_100000210312_100009813988 [0,1,0,0,0,1|1,0,0]=3 2842 B11R0.127 CC(C)CCSCC(C)(C)CO 62a_100009813988_100000210312 [0,1,0,0,0,1|1,0,0]=3 2843 B11R0.127 CC(C)NCCCC(C)(C)C#N 2230a_100138425928_100000759902 [0,1,0,0,0,1|2,0,0]=4 2844 B11R0.127 CC(C)NCCCC(C)(C)C#N 34a_100138425928_100000759902 [0,1,0,0,0,1|2,0,0]=4 2845 B11R0.127 CC(C)NCCCC(C)(C)CO 2230a_100000039164_100000210206 [0,1,0,0,0,1|1,0,0]=3 2846 B11R0.127 CC(C)OCCCC(C)(C)C#N 34a_100000212225_100000759902 [0,1,0,0,0,1|2,0,0]=4 2847 B11R0.127 CC(C)OCCNC(C)(C)CO 2230a_100000210608_100000211751 [0,1,0,0,0,1|2,0,0]=4 2848 B11R0.127 CC(C)OCNCC(C)(C)CO 2230a_100020635058_100000709892 [0,1,0,0,0,1|2,0,0]=4 2849 B11R0.127 CC(C)OCSCC(C)(C)CO 62a_100000709892_100009813988 [0,1,0,0,0,1|2,0,0]=4 2850 B11R0.127 CC(C)OCSCC(C)(C)CO 62a_100009813988_100000709892 [0,1,0,0,0,1|2,0,0]=4 2851 B11R0.127 CC(C)SCCCC(C)(C)C#N 62a_100000210206_100000759902 [0,1,0,0,0,1|2,0,0]=4 2852 B11R0.127 CC(C)SCCCC(C)(C)C#N 62a_100000759902_100000210206 [0,1,0,0,0,1|2,0,0]=4 2853 B11R0.127 CC(C)SCCNC(C)(C)CO 2230a_100000210608_100000730970 [0,1,0,0,0,1|2,0,0]=4 2854 B11R0.127 CC(O)CCCNC(C)(C)CO 2230a_100000210608_200000718107 [0,1,0,0,0,1|1,0,0]=3 2855 B11R0.127 CC(O)CCCOC(C)(C)C#N 34a_200015195151_200000718107 [0,1,0,0,0,1|2,0,0]=4 2856 B11R0.127 CC(O)CCCOC(C)(C)CCl 7a_100000764493_200000718107 [0,1,0,0,0,1|2,0,0]=4 2857 B11R0.127 CC(O)CCCSC(C)(C)C#N 62a_100011162410_200000718107 [0,1,0,0,0,1|2,0,0]=4 2858 B11R0.127 CC(O)CCCSC(C)(C)C#N 62a_200000718107_100011162410 [0,1,0,0,0,1|2,0,0]=4 2859 B11R0.127 CC(O)CCNCC(C)(C)CO 2230a_100020635058_100012276601 [0,1,0,0,0,1|1,0,0]=3 2860 B11R0.127 CC(O)CCOCC(C)(C)CCl 7a_100011217199_100012276601 [0,1,0,0,0,1|2,0,0]=4 2861 B11R0.127 CC(O)CCSCC(C)(C)CO 62a_100009813988_100012276601 [0,1,0,0,0,1|1,0,0]=3 2862 B11R0.127 CC(O)CCSCC(C)(C)CO 62a_100012276601_100009813988 [0,1,0,0,0,1|1,0,0]=3 2863 B11R0.127 CCC(C)(C)COCCC(C)C 7a_100000765029_100000210626 [0,1,0,0,0,1|2,0,0]=4 2864 B11R0.127 CCC(C)(C)COCCC(C)O 7a_100000765029_100012276601 [0,1,0,0,0,1|2,0,0]=4 2865 B11R0.127 CCC(C)(C)NCCCC(C)C 2230a_100000211385_100011214892 [0,1,0,0,0,1|2,0,0]=4 2866 B11R0.127 CCC(C)(C)NCCCC(C)O 2230a_100000211385_200000718107 [0,1,0,0,0,1|2,0,0]=4 2867 B11R0.127 CCC(C)(C)OCCCC(C)C 7a_100000210230_100011214892 [0,1,0,0,0,1|2,0,0]=4 2868 B11R0.127 CCC(C)(C)OCCCC(C)C 7a_100000210774_100000210677 [0,1,0,0,0,1|2,0,0]=4 2869 B11R0.127 CCC(C)(C)OCCCC(C)O 7a_100000210230_200000718107 [0,1,0,0,0,1|2,0,0]=4 2870 B11R0.127 CCC(C)(C)SCCCC(C)C 62a_100000032637_100011214892 [0,1,0,0,0,1|2,0,0]=4 2871 B11R0.127 CCC(C)(C)SCCCC(C)C 62a_100011214892_100000032637 [0,1,0,0,0,1|2,0,0]=4 2872 B11R0.127 CCC(C)(C)SCCCC(C)O 62a_100000032637_200000718107 [0,1,0,0,0,1|2,0,0]=4 2873 B11R0.127 CCC(C)(C)SCCCC(C)O 62a_200000718107_100000032637 [0,1,0,0,0,1|2,0,0]=4 2874 B11R0.127 CN(C)CCSCC(C)(C)CO 62a_100009813988_100000755713 [0,1,0,0,0,1|2,0,0]=4 2875 B11R0.127 COC(C)(C)CCOCC(=O)N 7a_100000699976_100000187820 [0,1,0,0,0,1|1,0,1]=4 2876 B11R0.127 COC(C)(C)CCOCC(C)C 7a_100000699976_100000210760 [0,1,0,0,0,1|1,0,0]=3 2877 B11R0.127 COC(C)(C)CCOCC(C)O 7a_100000699976_100011218427 [0,1,0,0,0,1|1,0,0]=3 2878 B11R0.127 COC(C)(C)CCOCC(F)F 7a_100000699976_100011934356 [0,1,0,0,0,1|2,0,0]=4 2879 B11R0.127 COC(C)(C)CCOC[C@@H](C)O 7a_100000699976_100009817552 [0,1,0,0,0,1|1,0,0]=3 2880 B11R0.127 COC(C)(C)CNCCC(=O)N 2230a_100000763424_100000744528 [0,1,0,0,0,1|1,0,1]=4 2881 B11R0.127 COC(C)(C)CNCCC(C)C 2230a_100000763424_100000210312 [0,1,0,0,0,1|1,0,0]=3 2882 B11R0.127 COC(C)(C)CNCCC(C)C 269862a_100000763424_100000185833 [0,1,0,0,0,1|1,0,0]=3 2883 B11R0.127 COC(C)(C)CNCCC(C)O 2230a_100000763424_100012276601 [0,1,0,0,0,1|1,0,0]=3 2884 B11R0.127 COC(C)(C)CNCOC(C)C 2230a_100000763424_100000709892 [0,1,0,0,0,1|2,0,0]=4 2885 B11R0.127 COC(C)(C)COCCC(=O)C 34a_100000759926_100000701081 [0,1,0,0,0,1|1,0,1]=4 2886 B11R0.127 COC(C)(C)COCCC(=O)N 34a_100000757172_100000701081 [0,1,0,0,0,1|1,0,1]=4 2887 B11R0.127 COC(C)(C)COCCC(C)Br 34a_100009893172_100000701081 [0,1,0,0,0,1|1,0,0]=3 2888 B11R0.127 COC(C)(C)COCCC(C)C 34a_100000210254_100000701081 [0,1,0,0,0,1|1,0,0]=3 2889 B11R0.127 COC(C)(C)COCCC(F)F 34a_100103093639_100000701081 [0,1,0,0,0,1|2,0,0]=4 2890 B11R0.127 COC(C)(C)COCC[C@@H](C)N 34a_100000706166_100000701081 [0,1,0,0,0,1|0,0,0]=2 2891 B11R0.127 COC(C)(C)CSCCC(=O)C 62a_100000053229_100000701081 [0,1,0,0,0,1|1,0,1]=4 2892 B11R0.127 COC(C)(C)CSCCC(=O)C 62a_100000701081_100000053229 [0,1,0,0,0,1|1,0,1]=4 2893 B11R0.127 COC(C)(C)CSCCC(=O)N 62a_100000701081_100000744528 [0,1,0,0,0,1|1,0,1]=4 2894 B11R0.127 COC(C)(C)CSCCC(=O)N 62a_100000744528_100000701081 [0,1,0,0,0,1|1,0,1]=4 2895 B11R0.127 COC(C)(C)CSCCC(C)C 62a_100000210312_100000701081 [0,1,0,0,0,1|1,0,0]=3 2896 B11R0.127 COC(C)(C)CSCCC(C)C 62a_100000701081_100000210312 [0,1,0,0,0,1|1,0,0]=3 2897 B11R0.127 COC(C)(C)CSCCC(C)O 62a_100000701081_100012276601 [0,1,0,0,0,1|1,0,0]=3 2898 B11R0.127 COC(C)(C)CSCCC(C)O 62a_100012276601_100000701081 [0,1,0,0,0,1|1,0,0]=3 2899 B11R0.127 COC(C)(C)CSCCN(C)C 62a_100000701081_100000755713 [0,1,0,0,0,1|2,0,0]=4 2900 B11R0.127 COC(C)(C)CSCOC(C)C 62a_100000701081_100000709892 [0,1,0,0,0,1|2,0,0]=4 2901 B11R0.127 COC(C)(C)CSCOC(C)C 62a_100000709892_100000701081 [0,1,0,0,0,1|2,0,0]=4 2902 B11R0.127 CSC(C)(C)CNCCC(C)C 270004a_100000210545_100009845794 [0,1,0,0,0,1|1,1,0]=4 2903 B11R0.127 CSC(C)(C)CNCCC(C)O 270004a_200000755665_100009845794 [0,1,0,0,0,1|1,1,0]=4 2904 B11R0.127 C[C@@H](N)CCOCC(C)(C)CO 34a_100000706166_100009813988 [0,1,0,0,0,1|0,0,0]=2 2905 B11R0.199 CC(C)(C)CCNCC(C)(C)C 2230a_100000743828_100000755188 [0,1,0,0,0,1|2,0,0]=4 2906 B11R0.199 CC(C)(C)CCNCC(C)(C)C 270004a_100000738805_100011204126 [0,1,0,0,0,1|2,0,0]=4 2907 B11R0.199 CC(C)(C)CCNCC(C)(C)F 2230a_100020643315_100000755188 [0,1,0,0,0,1|2,0,0]=4 2908 B11R0.199 CC(C)(C)CCNCC(C)(C)O 2230a_100000751335_100000755188 [0,1,0,0,0,1|1,0,0]=3 2909 B11R0.199 CC(C)(C)CCOCC(C)(C)F 34a_100000716592_100000755188 [0,1,0,0,0,1|2,0,0]=4 2910 B11R0.199 CC(C)(C)CCOCC(C)(C)O 7a_100000765024_100000764493 [0,1,0,0,0,1|1,0,0]=3 2911 B11R0.199 CC(C)(C)CCOCC(C)(F)F 34a_100000068830_100000755188 [0,1,0,0,0,1|2,0,0]=4 2912 B11R0.199 CC(C)(C)CCSCC(C)(C)C 62a_100000755188_100011219605 [0,1,0,0,0,1|2,0,0]=4 2913 B11R0.199 CC(C)(C)CCSCC(C)(C)C 62a_100011219605_100000755188 [0,1,0,0,0,1|2,0,0]=4 2914 B11R0.199 CC(C)(C)CCSCC(C)(C)F 62a_100000755188_100011997219 [0,1,0,0,0,1|2,0,0]=4 2915 B11R0.199 CC(C)(C)CCSCC(C)(C)F 62a_100011997219_100000755188 [0,1,0,0,0,1|2,0,0]=4 2916 B11R0.199 CC(C)(C)CCSCC(C)(C)O 62a_100000755188_100000764493 [0,1,0,0,0,1|1,0,0]=3 2917 B11R0.199 CC(C)(C)CCSCC(C)(C)O 62a_100000764493_100000755188 [0,1,0,0,0,1|1,0,0]=3 2918 B11R0.199 CC(C)(C)CNCCC(C)(C)F 270004a_100016253952_100011204126 [0,1,0,0,0,1|2,0,0]=4 2919 B11R0.199 CC(C)(C)CNCCC(C)(C)O 2230a_100000743828_100000702414 [0,1,0,0,0,1|1,0,0]=3 2920 B11R0.199 CC(C)(C)CNCCC(C)(C)O 270004a_100000707701_100011204126 [0,1,0,0,0,1|1,0,0]=3 2921 B11R0.199 CC(C)(C)CSCCC(C)(C)O 62a_100000702414_100011219605 [0,1,0,0,0,1|1,0,0]=3 2922 B11R0.199 CC(C)(C)CSCCC(C)(C)O 62a_100011219605_100000702414 [0,1,0,0,0,1|1,0,0]=3 2923 B11R0.199 CC(C)(O)CCCNC(C)(C)C 2230a_100000715429_100009888830 [0,1,0,0,0,1|1,0,0]=3 2924 B11R0.199 CC(C)(O)CCCOC(C)(C)C 34a_100015890283_100009888830 [0,1,0,0,0,1|1,0,0]=3 2925 B11R0.199 CC(C)(O)CCCOC(C)(C)C 7a_100015890283_100009888830 [0,1,0,0,0,1|1,0,0]=3 2926 B11R0.199 CC(C)(O)CCCSC(C)(C)C 62a_100000211941_100009888830 [0,1,0,0,0,1|1,0,0]=3 2927 B11R0.199 CC(C)(O)CCCSC(C)(C)C 62a_100009888830_100000211941 [0,1,0,0,0,1|1,0,0]=3 2928 B11R0.199 CC(C)(O)CCCSC(F)(F)F 62a_100009888830_200103152311 [0,1,0,0,0,1|2,0,0]=4 2929 B11R0.199 CC(C)(O)CCCSC(F)(F)F 62a_200000243211_100009888830 [0,1,0,0,0,1|2,0,0]=4 2930 B11R0.199 CC(C)(O)CCNCC(C)(C)F 2230a_100020643315_100000702414 [0,1,0,0,0,1|1,0,0]=3 2931 B11R0.199 CC(C)(O)CCNCC(C)(C)O 2230a_100000751335_100000702414 [0,1,0,0,0,1|1,0,0]=3 2932 B11R0.199 CC(C)(O)CCNCC(F)(F)F 34a_100000717047_100000702414 [0,1,0,0,0,1|2,0,0]=4 2933 B11R0.199 CC(C)(O)CCOCC(C)(C)F 34a_100000716592_100000702414 [0,1,0,0,0,1|1,0,0]=3 2934 B11R0.199 CC(C)(O)CCOCC(C)(F)F 34a_100000068830_100000702414 [0,1,0,0,0,1|1,0,0]=3 2935 B11R0.199 CC(C)(O)CCOCC(F)(F)Br 34a_100011217949_100000702414 [0,1,0,0,0,1|2,0,0]=4 2936 B11R0.199 CC(C)(O)CCOCC(F)(F)Cl 34a_100000734434_100000702414 [0,1,0,0,0,1|2,0,0]=4 2937 B11R0.199 CC(C)(O)CCOCC(F)(F)F 34a_100000210435_100000702414 [0,1,0,0,0,1|2,0,0]=4 2938 B11R0.199 CC(C)(O)CCSCC(C)(C)F 62a_100000702414_100011997219 [0,1,0,0,0,1|1,0,0]=3 2939 B11R0.199 CC(C)(O)CCSCC(C)(C)F 62a_100011997219_100000702414 [0,1,0,0,0,1|1,0,0]=3 2940 B11R0.199 CC(C)(O)CCSCC(C)(C)O 62a_100000702414_100000764493 [0,1,0,0,0,1|1,0,0]=3 2941 B11R0.199 CC(C)(O)CCSCC(C)(C)O 62a_100000764493_100000702414 [0,1,0,0,0,1|1,0,0]=3 2942 B11R0.199 CC(C)(O)CCSCC(F)(F)F 62a_100000702414_100000763148 [0,1,0,0,0,1|2,0,0]=4 2943 B11R0.199 CC(C)(O)CCSCC(F)(F)F 62a_100000763148_100000702414 [0,1,0,0,0,1|2,0,0]=4 2944 B11R0.199 CC(C)(O)CCSCS(=O)(=O)N 62a_100000702414_100000741382 [0,1,0,0,0,1|2,0,0]=4 2945 B11R0.199 CC(C)(O)CCSCS(=O)(=O)N 62a_100000741382_100000702414 [0,1,0,0,0,1|2,0,0]=4 2946 B11R0.199 CC(C)(O)CCSC[N+](C)(C)C 62a_100000702414_200000036245 [0,1,0,0,0,1|2,0,0]=4 2947 B11R0.199 CC(C)(O)CCSC[N+](C)(C)C 62a_200000036245_100000702414 [0,1,0,0,0,1|2,0,0]=4 2948 B11R0.199 CC(C)(O)CCSC[Si](C)(C)C 62a_100000037933_100000702414 [0,1,0,0,0,1|1,1,0]=4 2949 B11R0.199 CC(C)(O)CCSC[Si](C)(C)C 62a_100000702414_100000037933 [0,1,0,0,0,1|1,1,0]=4 2950 B11R0.199 CC(C)(O)CNCCC(F)(F)F 34a_100000740434_100000764493 [0,1,0,0,0,1|2,0,0]=4 2951 B11R0.199 CC(C)(O)CNCCS(=O)(=O)C 2230a_100000751335_100000731031 [0,1,0,0,0,1|2,0,0]=4 2952 B11R0.199 CC(C)(O)CNCCS(=O)(=O)C 34a_100000740961_100000764493 [0,1,0,0,0,1|2,0,0]=4 2953 B11R0.199 CC(C)(O)CNCCS(=O)(=O)N 34a_100000738205_100000764493 [0,1,0,0,0,1|2,0,0]=4 2954 B11R0.199 CC(C)(O)CNCC[Si](C)(C)C 2230a_100000751335_200000733723 [0,1,0,0,0,1|1,1,0]=4 2955 B11R0.199 CC(C)(O)COCCC(F)(F)F 34a_100000752437_100000764493 [0,1,0,0,0,1|2,0,0]=4 2956 B11R0.199 CC(C)(O)COCCS(=O)(=O)C 34a_100000211924_100000764493 [0,1,0,0,0,1|2,0,0]=4 2957 B11R0.199 CC(C)(O)COCCS(=O)(=O)C 7a_100000211924_100000764493 [0,1,0,0,0,1|2,0,0]=4 2958 B11R0.199 CC(C)(O)COCCS(=O)(=O)N 34a_100012334274_100000764493 [0,1,0,0,0,1|2,0,0]=4 2959 B11R0.199 CC(C)(O)COCC[N+](C)(C)C 7a_200020618287_100000764493 [0,1,0,0,0,1|2,0,0]=4 2960 B11R0.199 CC(C)(O)COCC[Si](C)(C)C 7a_100000039746_100000764493 [0,1,0,0,0,1|1,1,0]=4 2961 B11R0.199 CC(C)(O)CSCCC(F)(F)F 62a_100000764493_100011219754 [0,1,0,0,0,1|2,0,0]=4 2962 B11R0.199 CC(C)(O)CSCCC(F)(F)F 62a_100011219754_100000764493 [0,1,0,0,0,1|2,0,0]=4 2963 B11R0.199 CC(C)(O)CSCCS(=O)(=O)C 62a_100000731031_100000764493 [0,1,0,0,0,1|2,0,0]=4 2964 B11R0.199 CC(C)(O)CSCCS(=O)(=O)C 62a_100000764493_100000230027 [0,1,0,0,0,1|2,0,0]=4 2965 B11R0.199 CC(C)(O)CSCC[N+](C)(C)C 62a_100000085578_100000764493 [0,1,0,0,0,1|2,0,0]=4 2966 B11R0.199 CC(C)(O)CSCC[N+](C)(C)C 62a_100000764493_100000085578 [0,1,0,0,0,1|2,0,0]=4 2967 B11R0.199 CC(C)(O)CSCC[Si](C)(C)C 62a_100000764493_200000733723 [0,1,0,0,0,1|1,1,0]=4 2968 B11R0.199 CC(C)(O)CSCC[Si](C)(C)C 62a_200000733723_100000764493 [0,1,0,0,0,1|1,1,0]=4 2969 B11R0.318 C=C(C)C(C)NCCC(C)(C)O 269862a_100000707701_100011216138 [0,1,0,0,0,1|1,0,1]=4 2970 B11R0.318 CC(=O)C(C)COCC(C)(C)O 34a_100000032740_100000764493 [0,1,0,0,0,1|1,0,1]=4 2971 B11R0.318 CC(=O)C(C)COCC(C)(C)O 7a_100000032740_100000764493 [0,1,0,0,0,1|1,0,1]=4 2972 B11R0.318 CC(=O)C(C)OCCC(C)(C)O 34a_100000212229_100000702414 [0,1,0,0,0,1|1,0,1]=4 2973 B11R0.318 CC(=O)C(C)SCCC(C)(C)O 62a_100000702414_100009814033 [0,1,0,0,0,1|1,0,1]=4 2974 B11R0.318 CC(=O)C(C)SCCC(C)(C)O 62a_100009814033_100000702414 [0,1,0,0,0,1|1,0,1]=4 2975 B11R0.318 CC(C)(O)CCSC(F)C(=O)N 62a_100000702414_100009813875 [0,1,0,0,0,1|1,0,1]=4 2976 B11R0.318 CC(C)(O)CCSC(F)C(=O)N 62a_100009813875_100000702414 [0,1,0,0,0,1|1,0,1]=4 2977 B11R0.318 CC(C)(O)COC[C@H](N)C(=O)N 34a_100000729942_100000764493 [0,1,0,0,0,1|1,0,1]=4 2978 B11R0.318 CC(C)C(=O)CNCC(C)(C)O 2230a_100000751335_100000753385 [0,1,0,0,0,1|1,0,1]=4 2979 B11R0.318 CC(C)C(=O)CSCC(C)(C)O 62a_100000753385_100000764493 [0,1,0,0,0,1|1,0,1]=4 2980 B11R0.318 CC(C)C(=O)CSCC(C)(C)O 62a_100000764493_100000753385 [0,1,0,0,0,1|1,0,1]=4 2981 B11R0.318 CC(C)C(=O)NCCC(C)(C)O 1626a_100000707701_100000210198 [0,1,0,0,0,1|1,0,1]=4 2982 B11R0.318 CC(C)C(=O)NCCC(C)(C)O 527a_100000707701_100000210198 [0,1,0,0,0,1|1,0,1]=4 2983 B11R0.318 CC(C)C(C)NCCC(C)(C)C 2230a_100000211541_100000755188 [0,1,0,0,0,1|2,0,0]=4 2984 B11R0.318 CC(C)C(C)NCCC(C)(C)O 2230a_100000211541_100000702414 [0,1,0,0,0,1|1,0,0]=3 2985 B11R0.318 CC(C)C(C)OCCC(C)(C)C 7a_100000748068_100000755188 [0,1,0,0,0,1|2,0,0]=4 2986 B11R0.318 CC(C)C(C)OCCC(C)(C)O 7a_100000748068_100000702414 [0,1,0,0,0,1|1,0,0]=3 2987 B11R0.318 CC(C)C(N)CCOC(C)(C)C 34a_100161115045_100000210625 [0,1,0,0,0,1|2,0,0]=4 2988 B11R0.318 CC(C)C(O)CNCC(C)(C)C 270004a_100000759067_100011204126 [0,1,0,0,0,1|2,0,0]=4 2989 B11R0.318 CC(C)C(O)CNCC(C)(C)C 34a_100000759067_100011219605 [0,1,0,0,0,1|2,0,0]=4 2990 B11R0.318 CC(C)C(O)CNCC(C)(C)F 34a_100000759067_100011997219 [0,1,0,0,0,1|2,0,0]=4 2991 B11R0.318 CC(C)C(O)CNCC(C)(C)O 34a_100000759067_100000764493 [0,1,0,0,0,1|1,0,0]=3 2992 B11R0.318 CC(C)N(C)CCCC(C)(C)O 269982a_200000211004_100009888830 [0,1,0,0,0,1|1,0,0]=3 2993 B11R0.318 CC(C)[C@@H](N)COCC(C)(C)C 34a_100011830312_100011219605 [0,1,0,0,0,1|2,0,0]=4 2994 B11R0.318 CC(C)[C@@H](N)COCC(C)(C)F 34a_100011830312_100011997219 [0,1,0,0,0,1|2,0,0]=4 2995 B11R0.318 CC(C)[C@@H](N)COCC(C)(C)O 34a_100011830312_100000764493 [0,1,0,0,0,1|1,0,0]=3 2996 B11R0.318 CC(F)C(=O)NCCC(C)(C)O 1626a_100000707701_100000062450 [0,1,0,0,0,1|1,0,1]=4 2997 B11R0.318 CC(F)C(=O)NCCC(C)(C)O 527a_100000707701_100000062450 [0,1,0,0,0,1|1,0,1]=4 2998 B11R0.318 CC(SCCC(C)(C)O)C(=O)N 62a_100000702099_100000702414 [0,1,0,0,0,1|1,0,1]=4 2999 B11R0.318 CC(SCCC(C)(C)O)C(=O)N 62a_100000702414_100000702099 [0,1,0,0,0,1|1,0,1]=4 3000 B11R0.318 C[C@@H](NCCC(C)(C)O)C(=O)N 2230a_100000119354_100000702414 [0,1,0,0,0,1|1,0,1]=4 3001 B11R0.318 C[C@@H](NCCC(C)(C)O)C(=O)N 34a_100000119354_100000702414 [0,1,0,0,0,1|1,0,1]=4 3002 B11R0.318 C[C@@H](OCCC(C)(C)O)C(=O)N 34a_100000731257_100000702414 [0,1,0,0,0,1|1,0,1]=4 3003 B11R0.318 C[C@@H](OCCC(C)(C)O)C(=O)N 7a_100000731257_100000702414 [0,1,0,0,0,1|1,0,1]=4 3004 B11R0.318 C[C@H](O)C(=O)NCCC(C)(C)O 1626a_100000707701_217856618621 [0,1,0,0,0,1|1,0,1]=4 3005 B11R0.337 C=C(C)CN(C)CCC(C)(C)O 2230a_100000225649_100000702414 [0,1,0,0,0,1|1,0,1]=4 3006 B11R0.337 CC(C)CC(=O)CCC(C)(C)C 1458a_100000210554_100000755188 [0,1,0,0,0,1|2,0,0]=4 3007 B11R0.337 CC(C)CC(=O)CCC(C)(C)C 1458a_100000757465_100000210624 [0,1,0,0,0,1|2,0,0]=4 3008 B11R0.337 CC(C)CC(=O)NCC(C)(C)O 1626a_100000751335_100000210554 [0,1,0,0,0,1|1,0,1]=4 3009 B11R0.337 CC(C)CC(=O)NCC(C)(C)O 240690a_100000751335_100000210554 [0,1,0,0,0,1|1,0,1]=4 3010 B11R0.337 CC(C)CC(=O)NCC(C)(C)O 527a_100000751335_100000210554 [0,1,0,0,0,1|1,0,1]=4 3011 B11R0.337 CC(C)CC(C)NCC(C)(C)C 2230a_100000743828_100000731052 [0,1,0,0,0,1|2,0,0]=4 3012 B11R0.337 CC(C)CC(C)NCC(C)(C)C 270004a_100000692259_100011204126 [0,1,0,0,0,1|2,0,0]=4 3013 B11R0.337 CC(C)CC(C)NCC(C)(C)F 2230a_100020643315_100000731052 [0,1,0,0,0,1|2,0,0]=4 3014 B11R0.337 CC(C)CC(C)NCC(C)(C)O 2230a_100000751335_100000731052 [0,1,0,0,0,1|1,0,0]=3 3015 B11R0.337 CC(C)CC(C)OCC(C)(C)C 34a_100000211805_100011219605 [0,1,0,0,0,1|2,0,0]=4 3016 B11R0.337 CC(C)CC(C)OCC(C)(C)F 34a_100000211805_100011997219 [0,1,0,0,0,1|2,0,0]=4 3017 B11R0.337 CC(C)CC(C)OCC(C)(C)F 34a_100000716592_100000731052 [0,1,0,0,0,1|2,0,0]=4 3018 B11R0.337 CC(C)CC(C)OCC(C)(C)O 34a_100000211805_100000764493 [0,1,0,0,0,1|1,0,0]=3 3019 B11R0.337 CC(C)CC(C)OCC(C)(C)O 7a_100000211805_100000764493 [0,1,0,0,0,1|1,0,0]=3 3020 B11R0.337 CC(C)CC(C)SCC(C)(C)C 62a_100000731052_100011219605 [0,1,0,0,0,1|2,0,0]=4 3021 B11R0.337 CC(C)CC(C)SCC(C)(C)C 62a_100011219605_100000731052 [0,1,0,0,0,1|2,0,0]=4 3022 B11R0.337 CC(C)CC(C)SCC(C)(C)F 62a_100000731052_100011997219 [0,1,0,0,0,1|2,0,0]=4 3023 B11R0.337 CC(C)CC(C)SCC(C)(C)F 62a_100011997219_100000731052 [0,1,0,0,0,1|2,0,0]=4 3024 B11R0.337 CC(C)CC(C)SCC(C)(C)O 62a_100000731052_100000764493 [0,1,0,0,0,1|1,0,0]=3 3025 B11R0.337 CC(C)CC(C)SCC(C)(C)O 62a_100000764493_100000731052 [0,1,0,0,0,1|1,0,0]=3 3026 B11R0.337 CC(C)CN(C)CCC(C)(C)C 2230a_100000747067_100000755188 [0,1,0,0,0,1|2,0,0]=4 3027 B11R0.337 CC(C)CN(C)CCC(C)(C)C 269982a_100000747067_100000755188 [0,1,0,0,0,1|2,0,0]=4 3028 B11R0.337 CC(C)CN(C)CCC(C)(C)O 2230a_100000747067_100000702414 [0,1,0,0,0,1|1,0,0]=3 3029 B11R0.337 CC(C)C[C@H](N)COC(C)(C)C 34a_100011830311_100000210625 [0,1,0,0,0,1|2,0,0]=4 3030 B11R0.337 CC(CN(C)C)SCC(C)(C)O 62a_100000764493_100020606517 [0,1,0,0,0,1|2,0,0]=4 3031 B11R0.337 CC(CN(C)C)SCC(C)(C)O 62a_100020606517_100000764493 [0,1,0,0,0,1|2,0,0]=4 3032 B11R0.337 CC(O)CC(=O)CCC(C)(C)C 1458a_100000757465_100011218427 [0,1,0,0,0,1|2,0,0]=4 3033 B11R0.337 CC(O)CN(C)CCC(C)(C)C 2230a_100000227577_100000755188 [0,1,0,0,0,1|2,0,0]=4 3034 B11R0.337 CC(O)CN(C)CCC(C)(C)C 269982a_100000227577_100000755188 [0,1,0,0,0,1|2,0,0]=4 3035 B11R0.337 CC(O)CN(C)CCC(C)(C)O 2230a_100000227577_100000702414 [0,1,0,0,0,1|1,0,0]=3 3036 B11R0.337 CN(CCC(C)(C)O)CC(=O)N 2230a_100000739694_100000702414 [0,1,0,0,0,1|1,0,1]=4 3037 B11R0.337 C[C@@H](O)CC(=O)CCC(C)(C)C 1458a_100011933948_100000755188 [0,1,0,0,0,1|2,0,0]=4 3038 B11R0.337 C[C@@H](O)CC(=O)NCC(C)(C)O 240690a_100000751335_100011933948 [0,1,0,0,0,1|1,0,1]=4 3039 B11R0.51 CC(C)CC(C)C(=O)C(C)(C)O 1458a_100000242741_100000731052 [0,2,0,0,0,0|1,0,1]=4 3040 B11R0.89 CC(CO)CNC(C)C(C)(C)O 269862a_100000744482_100000747739 [0,2,0,0,0,0|2,0,0]=4 3041 B11R0.89 CC(NC[C@@H](F)CO)C(C)(C)O 269862a_100015665980_100000747739 [0,2,0,0,0,0|2,0,0]=4 3042 B11R0.89 CC(NC[C@H](O)CO)C(C)(C)O 269862a_100020644852_100000747739 [0,2,0,0,0,0|2,0,0]=4 3043 B11R0.89 CCC(C)CNC(C)C(C)(C)O 269862a_100020588543_100000747739 [0,2,0,0,0,0|2,0,0]=4 3044 B11R0.89 CCC(C)CN[C@@H](C)C(C)(C)O 2230a_100025708725_100000748023 [0,2,0,0,0,0|2,0,0]=4 3045 B11R0.89 CCC(O)CNC(C)C(C)(C)O 269862a_100011218483_100000747739 [0,2,0,0,0,0|2,0,0]=4 3046 B11R0.89 CCC(O)CN[C@@H](C)C(C)(C)O 2230a_100025708725_100011218378 [0,2,0,0,0,0|2,0,0]=4 3047 B11R0.89 CC[C@H](C)CN[C@@H](C)C(C)(C)O 2230a_100025708725_100009816398 [0,2,0,0,0,0|2,0,0]=4 3048 B11R0.89 CO[C@H](C)CNC(C)C(C)(C)O 269862a_100020591295_100000747739 [0,2,0,0,0,0|2,0,0]=4 3049 B11R0.89 C[C@@H](CO)CN[C@@H](C)C(C)(C)O 2230a_100025708725_100000059175 [0,2,0,0,0,0|2,0,0]=4 3050 B11R0.89 C[C@H](NCC(O)CO)C(C)(C)O 2230a_100025708725_100011219619 [0,2,0,0,0,0|2,0,0]=4 3051 B11R0.89 C[C@H](NC[C@@H](O)CF)C(C)(C)O 2230a_100025708725_100015614560 [0,2,0,0,0,0|2,0,0]=4 3052 B11R0.89 C[C@H](NC[C@@H](O)CO)C(C)(C)O 2230a_100025708725_100009815848 [0,2,0,0,0,0|2,0,0]=4 3053 B11R0.129 CC(C)CCC(=O)C(C)(C)CO 1458a_100000749806_100000210312 [0,2,0,0,0,0|1,0,1]=4 3054 B11R0.129 CC(C)CCN(C)C(C)(C)CO 269982a_100015204102_100000210312 [0,2,0,0,0,0|2,0,0]=4 3055 B11R0.129 CC(O)CCC(=O)C(C)(C)CO 1458a_100000749806_100012276601 [0,2,0,0,0,0|1,0,1]=4 3056 B11R0.129 CC(O)CCN(C)C(C)(C)CO 269982a_100015204102_100012276601 [0,2,0,0,0,0|2,0,0]=4 3057 B11R0.129 CCC(C)(O)C(=O)CCC(C)C 1458a_100011219770_100000210312 [0,2,0,0,0,0|1,0,1]=4 3058 B11R0.129 CCC(C)(O)C(=O)CCC(C)O 1458a_100011219770_100012276601 [0,2,0,0,0,0|1,0,1]=4 3059 B11R0.129 COC(C)(C)C(=O)CCC(C)C 1458a_100000753492_100000210312 [0,2,0,0,0,0|1,0,1]=4 3060 B11R0.129 COC(C)(C)C(=O)CCC(C)O 1458a_100000753492_100012276601 [0,2,0,0,0,0|1,0,1]=4 3061 B11R0.168 CC(C)C(C)NC(C)C(C)(C)O 269862a_100000211541_100000747739 [0,2,0,0,0,0|2,0,0]=4 3062 B11R0.319 CC(C)(C)CCC(=O)C(C)(C)O 1458a_100000242741_100000755188 [0,2,0,0,0,0|1,0,1]=4 3063 B11R0.319 CC(NCC(C)(C)C)C(C)(C)O 269862a_100000743828_100000747739 [0,2,0,0,0,0|2,0,0]=4 3064 B11R0.319 CC(NCC(C)(C)F)C(C)(C)O 269862a_100020643315_100000747739 [0,2,0,0,0,0|2,0,0]=4 3065 B11R0.319 CC(NCC(C)(C)O)C(C)(C)O 269862a_100000751335_100000747739 [0,2,0,0,0,0|2,0,0]=4 3066 B11R0.319 CC(NCC(C)(F)F)C(C)(C)O 269862a_100000731000_100000747739 [0,2,0,0,0,0|2,0,0]=4 3067 B11R0.119 CCC(C)CC(=O)CC(C)(C)O 1458a_100000693243_100000748023 [0,2,0,0,0,0|1,0,1]=4 3068 B11R0.119 CCC(C)CN(C)CC(C)(C)O 2230a_100000755907_100000748023 [0,2,0,0,0,0|2,0,0]=4 3069 B11R0.119 CCC(C)CN(C)CC(C)(C)O 269982a_100000755907_100000748023 [0,2,0,0,0,0|2,0,0]=4 3070 B11R0.119 CCC(C)CN(C)CC(C)(C)O 270004a_100000755907_100000243153 [0,2,0,0,0,0|2,0,0]=4 3071 B11R0.119 CCC(O)CC(=O)CC(C)(C)O 1458a_100000693243_100011218378 [0,2,0,0,0,0|1,0,1]=4 3072 B11R0.119 CCC(O)CN(C)CC(C)(C)O 2230a_100000755907_100011218378 [0,2,0,0,0,0|2,0,0]=4 3073 B11R0.119 CCC(O)CN(C)CC(C)(C)O 269982a_100000755907_100011218378 [0,2,0,0,0,0|2,0,0]=4 3074 B11R0.119 CC[C@H](C)CC(=O)CC(C)(C)O 1458a_100000693243_100009816398 [0,2,0,0,0,0|1,0,1]=4 3075 B11R0.119 CC[C@H](C)CN(C)CC(C)(C)O 2230a_100000755907_100009816398 [0,2,0,0,0,0|2,0,0]=4 3076 B11R0.119 CC[C@H](C)CN(C)CC(C)(C)O 269982a_100000755907_100009816398 [0,2,0,0,0,0|2,0,0]=4 3077 B11R0.119 CN(CC(O)CO)CC(C)(C)O 2230a_100000755907_100011219619 [0,2,0,0,0,0|2,0,0]=4 3078 B11R0.119 CN(C[C@@H](O)CF)CC(C)(C)O 2230a_100000755907_100015614560 [0,2,0,0,0,0|2,0,0]=4 3079 B11R0.119 CN(C[C@@H](O)CO)CC(C)(C)O 2230a_100000755907_100009815848 [0,2,0,0,0,0|2,0,0]=4 3080 B11R0.119 C[C@@H](CO)CC(=O)CC(C)(C)O 1458a_100000693243_100000059175 [0,2,0,0,0,0|1,0,1]=4 3081 B11R0.119 C[C@@H](CO)CN(C)CC(C)(C)O 2230a_100000755907_100000059175 [0,2,0,0,0,0|2,0,0]=4 3082 B11R0.119 C[C@@H](CO)CN(C)CC(C)(C)O 269982a_100000755907_100000059175 [0,2,0,0,0,0|2,0,0]=4 3083 B11R0.274 CCN(CC(C)C)CC(C)(C)O 2230a_100000755687_100000210760 [0,2,0,0,0,0|2,0,0]=4 3084 B11R0.274 CCN(CC(C)C)CC(C)(C)O 269982a_100000755687_100000210624 [0,2,0,0,0,0|2,0,0]=4 3085 B11R0.274 CCN(CC(C)C)CC(C)(C)O 270004a_100000755687_100000210432 [0,2,0,0,0,0|2,0,0]=4 3086 B11R0.274 CCN(CC(C)O)CC(C)(C)O 2230a_100000755687_100011218427 [0,2,0,0,0,0|2,0,0]=4 3087 B11R0.274 CCN(CC(C)O)CC(C)(C)O 269982a_100000755687_100011218427 [0,2,0,0,0,0|2,0,0]=4 3088 B11R0.274 CCN(C[C@@H](C)O)CC(C)(C)O 2230a_100000755687_100009817552 [0,2,0,0,0,0|2,0,0]=4 3089 B11R0.274 CCN(C[C@@H](C)O)CC(C)(C)O 269982a_100000755687_100009817552 [0,2,0,0,0,0|2,0,0]=4 3090 B11R0.300 CC(C)CC(C)NC(C)(C)CO 2230a_100000210608_100000731052 [0,2,0,0,0,0|2,0,0]=4 3091 B11R0.300 CC(C)CN(C)CC(C)(C)CO 2230a_100000732702_100000210760 [0,2,0,0,0,0|2,0,0]=4 3092 B11R0.300 CC(C)CN(C)CC(C)(C)CO 269982a_100000732702_100000210624 [0,2,0,0,0,0|2,0,0]=4 3093 B11R0.300 CC(C)CN(C)CC(C)(C)CO 270004a_100000732702_100000210432 [0,2,0,0,0,0|2,0,0]=4 3094 B11R0.300 CC(O)CN(C)CC(C)(C)CO 2230a_100000732702_100011218427 [0,2,0,0,0,0|2,0,0]=4 3095 B11R0.300 CC(O)CN(C)CC(C)(C)CO 269982a_100000732702_100011218427 [0,2,0,0,0,0|2,0,0]=4 3096 B11R0.300 CCC(C)(O)CC(=O)CC(C)C 1458a_200011219800_100000210624 [0,2,0,0,0,0|1,0,1]=4 3097 B11R0.300 CCC(C)(O)CC(=O)CC(C)O 1458a_200011219800_100011218427 [0,2,0,0,0,0|1,0,1]=4 3098 B11R0.300 COC(C)(C)CC(C)OC(C)C 7a_200011252547_100000210206 [0,2,0,0,0,0|2,0,0]=4 3099 B11R0.300 COC(C)(C)CN(C)CC(C)C 269982a_100000747067_100000701081 [0,2,0,0,0,0|2,0,0]=4 3100 B11R0.300 COC(C)(C)CN(C)CC(C)O 269982a_100000227577_100000701081 [0,2,0,0,0,0|2,0,0]=4 3101 B11R0.300 C[C@@H](O)CN(C)CC(C)(C)CO 2230a_100000732702_100009817552 [0,2,0,0,0,0|2,0,0]=4 3102 B11R0.300 C[C@@H](O)CN(C)CC(C)(C)CO 269982a_100000732702_100009817552 [0,2,0,0,0,0|2,0,0]=4 3103 B11R0.359 CC(C)(O)CN([13CH3])CC(C)(C)O 2230a_100011965587_200025704644 [0,2,0,0,0,0|2,0,0]=4 3104 B11R0.359 CC(C)(O)CN([13CH3])CC(C)(C)O 269982a_100011965587_200025704644 [0,2,0,0,0,0|2,0,0]=4 3105 B11R0.359 CN(CC(C)(C)C)CC(C)(C)O 270004a_100000755907_100011204126 [0,2,0,0,0,0|2,0,0]=4 3106 B11R0.359 CN(CC(C)(C)O)CC(C)(C)O 2230a_100011965587_200000210301 [0,2,0,0,0,0|2,0,0]=4 3107 B11R0.359 CN(CC(C)(C)O)CC(C)(C)O 269982a_100011965587_200000210301 [0,2,0,0,0,0|2,0,0]=4 3108 B11R0.24 C#CC(CC)OCCC(C)(C)O 34a_100000758843_100000702414 [0,2,0,0,0,0|2,0,0]=4 3109 B11R0.24 C#CC(CC)OCCC(C)(C)O 7a_100000758843_100000702414 [0,2,0,0,0,0|2,0,0]=4 3110 B11R0.24 C=CC(CC)OCCC(C)(C)O 34a_100000766422_100000702414 [0,2,0,0,0,0|2,0,0]=4 3111 B11R0.24 C=CC(CC)OCCC(C)(C)O 7a_100000766422_100000702414 [0,2,0,0,0,0|2,0,0]=4 3112 B11R0.24 C=C[C@@H](CO)NCCC(C)(C)O 2230a_100016989147_100000702414 [0,2,0,0,0,0|2,0,0]=4 3113 B11R0.24 C=C[C@@H](CO)NCCC(C)(C)O 34a_100016989147_100000702414 [0,2,0,0,0,0|2,0,0]=4 3114 B11R0.24 CC(C)(C)CCOC(CN)CN 34a_100000031598_100000755188 [0,2,0,0,0,0|2,0,0]=4 3115 B11R0.24 CC(C)(O)CCNC(CO)CO 2230a_100000759517_100000702414 [0,2,0,0,0,0|2,0,0]=4 3116 B11R0.24 CC(C)(O)CCOC(CCl)CCl 7a_100000737055_100000702414 [0,2,0,0,0,0|2,0,0]=4 3117 B11R0.24 CC(C)(O)CCOC(CF)CF 34a_100000032261_100000702414 [0,2,0,0,0,0|2,0,0]=4 3118 B11R0.24 CC(C)(O)CCOC(CF)CF 7a_100000032261_100000702414 [0,2,0,0,0,0|2,0,0]=4 3119 B11R0.24 CC(C)(O)CCOC(CN)CN 34a_100000031598_100000702414 [0,2,0,0,0,0|1,0,0]=3 3120 B11R0.24 CC(C)(O)CCO[C@@H](CF)CCl 34a_100015614560_100000702414 [0,2,0,0,0,0|2,0,0]=4 3121 B11R0.24 CC(C)(O)CCO[C@@H](CF)CCl 7a_100015614560_100000702414 [0,2,0,0,0,0|2,0,0]=4 3122 B11R0.24 CCC(CC)CNCC(C)(C)O 2230a_100000751335_100011215472 [0,2,0,0,0,0|2,0,0]=4 3123 B11R0.24 CCC(CC)CNCC(C)(C)O 269862a_100000751335_100000211137 [0,2,0,0,0,0|2,0,0]=4 3124 B11R0.24 CCC(CC)CNCC(C)(C)O 270004a_100000751335_100000211137 [0,2,0,0,0,0|2,0,0]=4 3125 B11R0.24 CCC(CC)COCC(C)(C)O 7a_100000703878_100000764493 [0,2,0,0,0,0|2,0,0]=4 3126 B11R0.24 CCC(CC)CSCC(C)(C)O 62a_100000764493_100011215472 [0,2,0,0,0,0|2,0,0]=4 3127 B11R0.24 CCC(CC)CSCC(C)(C)O 62a_100011215472_100000764493 [0,2,0,0,0,0|2,0,0]=4 3128 B11R0.24 CCC(CC)NCCC(C)(C)O 2230a_100000199018_100000702414 [0,2,0,0,0,0|2,0,0]=4 3129 B11R0.24 CCC(CC)NCCC(C)(C)O 270004a_100000707701_100000210860 [0,2,0,0,0,0|2,0,0]=4 3130 B11R0.24 CCC(CC)OCCC(C)(C)O 7a_100000688536_100000702414 [0,2,0,0,0,0|2,0,0]=4 3131 B11R0.24 CCC(CC)SCCC(C)(C)O 62a_100000210505_100000702414 [0,2,0,0,0,0|2,0,0]=4 3132 B11R0.24 CCC(CC)SCCC(C)(C)O 62a_100000702414_100000210505 [0,2,0,0,0,0|2,0,0]=4 3133 B11R0.24 CCC(COCC(C)(C)O)OC 34a_100011934954_100000764493 [0,2,0,0,0,0|2,0,0]=4 3134 B11R0.24 CCC(COCC(C)(C)O)OC 7a_100011934954_100000764493 [0,2,0,0,0,0|2,0,0]=4 3135 B11R0.24 CCN(CC)CCCC(C)(C)O 2230a_100000724800_100009888830 [0,2,0,0,0,0|2,0,0]=4 3136 B11R0.24 CCN(CC)CCCC(C)(C)O 269956a_100000042499_100009888830 [0,2,0,0,0,0|2,0,0]=4 3137 B11R0.24 CCN(CC)CCCC(C)(C)O 269982a_100000724800_100009888830 [0,2,0,0,0,0|2,0,0]=4 3138 B11R0.24 CC[C@@H](CO)NCCC(C)(C)O 2230a_100000709445_100000702414 [0,2,0,0,0,0|2,0,0]=4 3139 B11R0.24 COC(CNCC(C)(C)O)OC 2230a_100000751335_100000751394 [0,2,0,0,0,0|2,0,0]=4 3140 B11R0.24 COC(CNCC(C)(C)O)OC 270004a_100000751335_100000752162 [0,2,0,0,0,0|2,0,0]=4 3141 B11R0.24 COC(COCC(C)(C)O)OC 34a_100011216393_100000764493 [0,2,0,0,0,0|2,0,0]=4 3142 B11R0.24 COC(CSCC(C)(C)O)OC 62a_100000751394_100000764493 [0,2,0,0,0,0|2,0,0]=4 3143 B11R0.24 COC(CSCC(C)(C)O)OC 62a_100000764493_100000751394 [0,2,0,0,0,0|2,0,0]=4 3144 B11R0.131 C#CC(C)(C)NCCC(C)(C)O 34a_100000054563_100000702414 [0,2,0,0,0,0|2,0,0]=4 3145 B11R0.131 C#CC(C)(C)OCCC(C)(C)O 34a_100000189450_100000702414 [0,2,0,0,0,0|2,0,0]=4 3146 B11R0.131 C#CC(C)(C)OCCC(C)(C)O 7a_100000189450_100000702414 [0,2,0,0,0,0|2,0,0]=4 3147 B11R0.131 C#CC(C)(C)SCCC(C)(C)O 62a_100000038118_100000702414 [0,2,0,0,0,0|2,0,0]=4 3148 B11R0.131 C#CC(C)(C)SCCC(C)(C)O 62a_100000702414_100000038118 [0,2,0,0,0,0|2,0,0]=4 3149 B11R0.131 C=CC(C)(C)OCCC(C)(C)O 34a_100011215311_100000702414 [0,2,0,0,0,0|2,0,0]=4 3150 B11R0.131 C=CC(C)(C)OCCC(C)(C)O 7a_100011215311_100000702414 [0,2,0,0,0,0|2,0,0]=4 3151 B11R0.131 CC(C)(C)CCNC(C)(C)CO 2230a_100000210608_100000755188 [0,2,0,0,0,0|2,0,0]=4 3152 B11R0.131 CC(C)(C)CNCC(C)(C)CO 270004a_100020635058_100011204126 [0,2,0,0,0,0|2,0,0]=4 3153 B11R0.131 CC(C)(C)CSCC(C)(C)CO 62a_100009813988_100011219605 [0,2,0,0,0,0|2,0,0]=4 3154 B11R0.131 CC(C)(C)CSCC(C)(C)CO 62a_100011219605_100009813988 [0,2,0,0,0,0|2,0,0]=4 3155 B11R0.131 CC(C)(F)COCC(C)(C)CO 34a_100000716592_100009813988 [0,2,0,0,0,0|2,0,0]=4 3156 B11R0.131 CC(C)(F)CSCC(C)(C)CO 62a_100009813988_100011997219 [0,2,0,0,0,0|2,0,0]=4 3157 B11R0.131 CC(C)(F)CSCC(C)(C)CO 62a_100011997219_100009813988 [0,2,0,0,0,0|2,0,0]=4 3158 B11R0.131 CC(C)(O)CCNC(C)(C)CO 2230a_100000210608_100000702414 [0,2,0,0,0,0|2,0,0]=4 3159 B11R0.131 CC(C)(O)CCOC(C)(C)C#N 34a_200015195151_100000702414 [0,2,0,0,0,0|1,0,1]=4 3160 B11R0.131 CC(C)(O)CCOC(C)(C)CCl 7a_100000764493_100000702414 [0,2,0,0,0,0|2,0,0]=4 3161 B11R0.131 CC(C)(O)CCSC(C)(C)C#N 62a_100000702414_100011162410 [0,2,0,0,0,0|1,0,1]=4 3162 B11R0.131 CC(C)(O)CCSC(C)(C)C#N 62a_100011162410_100000702414 [0,2,0,0,0,0|1,0,1]=4 3163 B11R0.131 CC(C)(O)CCSC(F)(F)CO 62a_100000702414_100011217949 [0,2,0,0,0,0|2,0,0]=4 3164 B11R0.131 CC(C)(O)CCSC(F)(F)CO 62a_100011217949_100000702414 [0,2,0,0,0,0|2,0,0]=4 3165 B11R0.131 CC(C)(O)COCC(C)(C)CCl 7a_100011217199_100000764493 [0,2,0,0,0,0|2,0,0]=4 3166 B11R0.131 CC(C)(O)COCC(F)(F)CN 34a_100000703232_100000764493 [0,2,0,0,0,0|2,0,0]=4 3167 B11R0.131 CC(C)(O)CSCC(C)(C)CO 62a_100000764493_100009813988 [0,2,0,0,0,0|2,0,0]=4 3168 B11R0.131 CC(C)(O)CSCC(C)(C)CO 62a_100009813988_100000764493 [0,2,0,0,0,0|2,0,0]=4 3169 B11R0.131 CC(F)(F)COCC(C)(C)CO 34a_100000068830_100009813988 [0,2,0,0,0,0|2,0,0]=4 3170 B11R0.131 CCC(C)(C)COCC(C)(C)O 7a_100000765029_100000764493 [0,2,0,0,0,0|2,0,0]=4 3171 B11R0.131 CCC(C)(C)NCCC(C)(C)O 2230a_100000211385_100000702414 [0,2,0,0,0,0|2,0,0]=4 3172 B11R0.131 CCC(C)(C)OCCC(C)(C)O 7a_100000210230_100000702414 [0,2,0,0,0,0|2,0,0]=4 3173 B11R0.131 CCC(C)(C)SCCC(C)(C)O 62a_100000032637_100000702414 [0,2,0,0,0,0|2,0,0]=4 3174 B11R0.131 CCC(C)(C)SCCC(C)(C)O 62a_100000702414_100000032637 [0,2,0,0,0,0|2,0,0]=4 3175 B11R0.131 COC(C)(C)CNCC(C)(C)C 270004a_100000763424_100011204126 [0,2,0,0,0,0|2,0,0]=4 3176 B11R0.131 COC(C)(C)COCC(C)(C)F 34a_100000716592_100000701081 [0,2,0,0,0,0|2,0,0]=4 3177 B11R0.131 COC(C)(C)COCC(C)(F)F 34a_100000068830_100000701081 [0,2,0,0,0,0|2,0,0]=4 3178 B11R0.131 COC(C)(C)CSCC(C)(C)C 62a_100000701081_100011219605 [0,2,0,0,0,0|2,0,0]=4 3179 B11R0.131 COC(C)(C)CSCC(C)(C)C 62a_100011219605_100000701081 [0,2,0,0,0,0|2,0,0]=4 3180 B11R0.131 COC(C)(C)CSCC(C)(C)F 62a_100000701081_100011997219 [0,2,0,0,0,0|2,0,0]=4 3181 B11R0.131 COC(C)(C)CSCC(C)(C)F 62a_100011997219_100000701081 [0,2,0,0,0,0|2,0,0]=4 3182 B11R0.131 COC(C)(C)CSCC(C)(C)O 62a_100000701081_100000764493 [0,2,0,0,0,0|2,0,0]=4 3183 B11R0.131 COC(C)(C)CSCC(C)(C)O 62a_100000764493_100000701081 [0,2,0,0,0,0|2,0,0]=4 3184 B11R0.131 CSC(C)(C)CNCC(C)(C)O 270004a_100000751335_100009845794 [0,2,0,0,0,0|2,0,0]=4 3185 B11R0.180 C#CCC(C)OCCC(C)(C)O 34a_100000685586_100000702414 [0,2,0,0,0,0|2,0,0]=4 3186 B11R0.180 C#CCC(C)OCCC(C)(C)O 7a_100000685586_100000702414 [0,2,0,0,0,0|2,0,0]=4 3187 B11R0.180 C#CCN(C)CCCC(C)(C)O 2230a_100000225692_100009888830 [0,2,0,0,0,0|2,0,0]=4 3188 B11R0.180 C#CCN(C)CCCC(C)(C)O 34a_100000225692_100009888830 [0,2,0,0,0,0|2,0,0]=4 3189 B11R0.180 C/C=C/C(C)OCCC(C)(C)O 34a_200102604097_100000702414 [0,2,0,0,0,0|2,0,0]=4 3190 B11R0.180 C=CCC(C)COCC(C)(C)O 34a_100009832082_100000764493 [0,2,0,0,0,0|2,0,0]=4 3191 B11R0.180 C=CCC(C)COCC(C)(C)O 7a_100009832082_100000764493 [0,2,0,0,0,0|2,0,0]=4 3192 B11R0.180 C=CCN(C)CCCC(C)(C)O 2230a_100000225617_100009888830 [0,2,0,0,0,0|2,0,0]=4 3193 B11R0.180 C=CCN(C)CCCC(C)(C)O 269982a_100000225617_100009888830 [0,2,0,0,0,0|2,0,0]=4 3194 B11R0.180 C=CC[C@@H](C)OCCC(C)(C)O 34a_100000731007_100000702414 [0,2,0,0,0,0|2,0,0]=4 3195 B11R0.180 C=CC[C@@H](C)OCCC(C)(C)O 7a_100000731007_100000702414 [0,2,0,0,0,0|2,0,0]=4 3196 B11R0.180 C=CC[C@@H](N)COCC(C)(C)C 34a_100020615467_100011219605 [0,2,0,0,0,0|2,0,0]=4 3197 B11R0.180 C=CC[C@@H](N)COCC(C)(C)F 34a_100020615467_100011997219 [0,2,0,0,0,0|2,0,0]=4 3198 B11R0.180 C=CC[C@@H](N)COCC(C)(C)O 34a_100020615467_100000764493 [0,2,0,0,0,0|1,0,0]=3 3199 B11R0.180 CC#CC(C)OCCC(C)(C)O 34a_100011216543_100000702414 [0,2,0,0,0,0|2,0,0]=4 3200 B11R0.180 CC(C)(O)CNC[C@@H](O)CC#N 2230a_100000751335_100000001066 [0,2,0,0,0,0|2,0,0]=4 3201 B11R0.180 CC(C)(O)CSC[C@@H](O)CC#N 62a_100000001066_100000764493 [0,2,0,0,0,0|2,0,0]=4 3202 B11R0.180 CC(C)(O)CSC[C@@H](O)CC#N 62a_100000764493_100000001066 [0,2,0,0,0,0|2,0,0]=4 3203 B11R0.180 CC(CC#N)SCCC(C)(C)O 62a_100000702414_100009813641 [0,2,0,0,0,0|1,0,1]=4 3204 B11R0.180 CC(CC#N)SCCC(C)(C)O 62a_100009813641_100000702414 [0,2,0,0,0,0|1,0,1]=4 3205 B11R0.180 CC(CCBr)OCCC(C)(C)O 34a_100012276601_100000702414 [0,2,0,0,0,0|2,0,0]=4 3206 B11R0.180 CC(CCN)COCC(C)(C)C 34a_106354213184_100011219605 [0,2,0,0,0,0|2,0,0]=4 3207 B11R0.180 CC(CCN)COCC(C)(C)F 34a_106354213184_100011997219 [0,2,0,0,0,0|2,0,0]=4 3208 B11R0.180 CC(CCN)COCC(C)(C)O 34a_106354213184_100000764493 [0,2,0,0,0,0|1,0,0]=3 3209 B11R0.180 CC(CCO)SCCC(C)(C)O 62a_100000702414_100009893172 [0,2,0,0,0,0|2,0,0]=4 3210 B11R0.180 CC(CCO)SCCC(C)(C)O 62a_100009893172_100000702414 [0,2,0,0,0,0|2,0,0]=4 3211 B11R0.180 CCCC(C)CNCC(C)(C)O 2230a_100000751335_100011216630 [0,2,0,0,0,0|2,0,0]=4 3212 B11R0.180 CCCC(C)CNCC(C)(C)O 270004a_100000751335_100000243154 [0,2,0,0,0,0|2,0,0]=4 3213 B11R0.180 CCCC(C)COCC(C)(C)O 34a_100000688023_100000764493 [0,2,0,0,0,0|2,0,0]=4 3214 B11R0.180 CCCC(C)COCC(C)(C)O 7a_100000688023_100000764493 [0,2,0,0,0,0|2,0,0]=4 3215 B11R0.180 CCCC(C)CSCC(C)(C)O 62a_100000764493_100011216630 [0,2,0,0,0,0|2,0,0]=4 3216 B11R0.180 CCCC(C)CSCC(C)(C)O 62a_100011216630_100000764493 [0,2,0,0,0,0|2,0,0]=4 3217 B11R0.180 CCCC(C)NCCC(C)(C)O 2230a_100000741246_100000702414 [0,2,0,0,0,0|2,0,0]=4 3218 B11R0.180 CCCC(C)NCCC(C)(C)O 270004a_100000707701_100000211909 [0,2,0,0,0,0|2,0,0]=4 3219 B11R0.180 CCCC(C)OCCC(C)(C)O 34a_100000764384_100000702414 [0,2,0,0,0,0|2,0,0]=4 3220 B11R0.180 CCCC(C)OCCC(C)(C)O 7a_100000764384_100000702414 [0,2,0,0,0,0|2,0,0]=4 3221 B11R0.180 CCCC(C)SCCC(C)(C)O 62a_100000702414_100000766640 [0,2,0,0,0,0|2,0,0]=4 3222 B11R0.180 CCCC(C)SCCC(C)(C)O 62a_100000766640_100000702414 [0,2,0,0,0,0|2,0,0]=4 3223 B11R0.180 CCCN(C)CCCC(C)(C)O 2230a_100000747261_100009888830 [0,2,0,0,0,0|2,0,0]=4 3224 B11R0.180 CCCN(C)CCCC(C)(C)O 269982a_100000747261_100009888830 [0,2,0,0,0,0|2,0,0]=4 3225 B11R0.180 CCC[C@H](N)CCOC(C)(C)C 34a_100015193777_100000210625 [0,2,0,0,0,0|2,0,0]=4 3226 B11R0.180 CCC[C@H](N)COCC(C)(C)C 34a_100000732646_100011219605 [0,2,0,0,0,0|2,0,0]=4 3227 B11R0.180 CCC[C@H](N)COCC(C)(C)F 34a_100000732646_100011997219 [0,2,0,0,0,0|2,0,0]=4 3228 B11R0.180 CCC[C@H](N)COCC(C)(C)O 34a_100000732646_100000764493 [0,2,0,0,0,0|1,0,0]=3 3229 B11R0.180 CN(CC#N)CCCC(C)(C)O 2230a_100000748184_100009888830 [0,2,0,0,0,0|1,0,1]=4 3230 B11R0.180 CN(CCO)CCCC(C)(C)O 2230a_100000210263_100009888830 [0,2,0,0,0,0|2,0,0]=4 3231 B11R0.180 CN(CCO)CCCC(C)(C)O 269982a_100000210263_100009888830 [0,2,0,0,0,0|2,0,0]=4 3232 B11R0.180 COCC(C)NCCC(C)(C)O 270004a_100000707701_100000749346 [0,2,0,0,0,0|2,0,0]=4 3233 B11R0.180 COCC(C)SCCC(C)(C)O 62a_100000702414_100000765312 [0,2,0,0,0,0|2,0,0]=4 3234 B11R0.180 COCC(C)SCCC(C)(C)O 62a_100000765312_100000702414 [0,2,0,0,0,0|2,0,0]=4 3235 B11R0.180 COCC(N)COCC(C)(C)C 34a_100000724102_100011219605 [0,2,0,0,0,0|2,0,0]=4 3236 B11R0.180 COCC(N)COCC(C)(C)F 34a_100000724102_100011997219 [0,2,0,0,0,0|2,0,0]=4 3237 B11R0.180 COCC(N)COCC(C)(C)O 34a_100000724102_100000764493 [0,2,0,0,0,0|1,0,0]=3 3238 B11R0.180 COCC(O)CNCC(C)(C)O 34a_100000756049_100000764493 [0,2,0,0,0,0|2,0,0]=4 3239 B11R0.180 COCC(O)CSCC(C)(C)O 62a_100000764493_100011215053 [0,2,0,0,0,0|2,0,0]=4 3240 B11R0.180 COCC(O)CSCC(C)(C)O 62a_100011215053_100000764493 [0,2,0,0,0,0|2,0,0]=4 3241 B11R0.180 COC[C@@H](C)NCCC(C)(C)O 2230a_100000764878_100000702414 [0,2,0,0,0,0|2,0,0]=4 3242 B11R0.180 COC[C@@H](C)OCCC(C)(C)O 34a_100011934205_100000702414 [0,2,0,0,0,0|2,0,0]=4 3243 B11R0.180 CSCC(C)NCCC(C)(C)O 270004a_100000707701_100011216314 [0,2,0,0,0,0|2,0,0]=4 3244 B11R0.180 C[C@@H](CC#N)NCCC(C)(C)O 2230a_100016994482_100000702414 [0,2,0,0,0,0|1,0,1]=4 3245 B11R0.180 C[C@H](CCO)NCCC(C)(C)O 2230a_100000706166_100000702414 [0,2,0,0,0,0|2,0,0]=4 3246 B11R0.180 C[C@H](CCO)NCCC(C)(C)O 34a_100000706166_100000702414 [0,2,0,0,0,0|2,0,0]=4 3247 B11R0.290 C=C[C@@H](C)[C@@H](C)OCC(C)(C)O 34a_100015455354_100000764493 [0,2,0,0,0,0|2,0,0]=4 3248 B11R0.290 C=C[C@@H](C)[C@@H](C)OCC(C)(C)O 7a_100015455354_100000764493 [0,2,0,0,0,0|2,0,0]=4 3249 B11R0.290 CC(CO)N(C)CCC(C)(C)O 2230a_100000693034_100000702414 [0,2,0,0,0,0|2,0,0]=4 3250 B11R0.290 CCC(C)C(C)NCC(C)(C)O 269862a_100000751335_100000210599 [0,2,0,0,0,0|2,0,0]=4 3251 B11R0.290 CCC(C)C(C)NCC(C)(C)O 270004a_100000751335_100000210599 [0,2,0,0,0,0|2,0,0]=4 3252 B11R0.290 CCC(C)C(C)OCC(C)(C)O 7a_100011215189_100000764493 [0,2,0,0,0,0|2,0,0]=4 3253 B11R0.290 CCC(C)N(C)CCC(C)(C)O 2230a_100000741768_100000702414 [0,2,0,0,0,0|2,0,0]=4 3254 B11R0.320 C=CC(C)CCCC(C)(C)OC 7a_100000032255_200000210301 [0,2,0,0,0,0|1,0,0]=3 3255 B11R0.320 C=CC(C)CCCC(C)(C)O[13CH3] 7a_100000032255_200025704644 [0,2,0,0,0,0|1,0,0]=3 3256 B11R0.320 C=CC(C)COCC(C)(C)CO 34a_100011215527_100009813988 [0,2,0,0,0,0|2,0,0]=4 3257 B11R0.320 C=CC(C)COCC(C)(C)CO 7a_100011215527_100009813988 [0,2,0,0,0,0|2,0,0]=4 3258 B11R0.320 C=CC(C)COCC(C)(C)OC 34a_100011215527_100000701081 [0,2,0,0,0,0|2,0,0]=4 3259 B11R0.320 C=C[C@H](N)COCC(C)(C)CO 34a_100016989147_100009813988 [0,2,0,0,0,0|1,0,1]=4 3260 B11R0.320 C=C[C@H](N)COCC(C)(C)OC 34a_100016989147_100000701081 [0,2,0,0,0,0|1,0,1]=4 3261 B11R0.320 CC(C)(CO)CNCC(O)CO 2230a_100020635058_100011219619 [0,2,0,0,0,0|2,0,0]=4 3262 B11R0.320 CC(C)(CO)CNC[C@@H](F)CO 34a_100015665980_100009813988 [0,2,0,0,0,0|2,0,0]=4 3263 B11R0.320 CC(C)(CO)CNC[C@@H](O)CF 2230a_100020635058_100015614560 [0,2,0,0,0,0|2,0,0]=4 3264 B11R0.320 CC(C)(CO)CNC[C@@H](O)CO 2230a_100020635058_100009815848 [0,2,0,0,0,0|2,0,0]=4 3265 B11R0.320 CC(C)(CO)COCC(Cl)CCl 34a_100000033668_100009813988 [0,2,0,0,0,0|2,0,0]=4 3266 B11R0.320 CC(C)(CO)COC[C@H](F)CN 34a_100015665980_100009813988 [0,2,0,0,0,0|2,0,0]=4 3267 B11R0.320 CC(C)(CO)CSCC(O)CO 62a_100009813988_100011219619 [0,2,0,0,0,0|2,0,0]=4 3268 B11R0.320 CC(C)(CO)CSCC(O)CO 62a_100011219619_100009813988 [0,2,0,0,0,0|2,0,0]=4 3269 B11R0.320 CC(C)(CO)CSC[C@@H](O)CF 62a_100009813988_100015614560 [0,2,0,0,0,0|2,0,0]=4 3270 B11R0.320 CC(C)(CO)CSC[C@@H](O)CF 62a_100015614560_100009813988 [0,2,0,0,0,0|2,0,0]=4 3271 B11R0.320 CC(C)(CO)CSC[C@@H](O)CO 62a_100009813988_100009815848 [0,2,0,0,0,0|2,0,0]=4 3272 B11R0.320 CC(C)(CO)CSC[C@@H](O)CO 62a_100009815848_100009813988 [0,2,0,0,0,0|2,0,0]=4 3273 B11R0.320 CC(CN)COCC(C)(C)CO 34a_100000744482_100009813988 [0,2,0,0,0,0|1,0,0]=3 3274 B11R0.320 CC(CO)CNCC(C)(C)CO 34a_100000744482_100009813988 [0,2,0,0,0,0|2,0,0]=4 3275 B11R0.320 CCC(C)CNCC(C)(C)CO 2230a_100020635058_100000748023 [0,2,0,0,0,0|2,0,0]=4 3276 B11R0.320 CCC(C)CNCC(C)(C)CO 270004a_100020635058_100000243153 [0,2,0,0,0,0|2,0,0]=4 3277 B11R0.320 CCC(C)CNCC(C)(C)OC 2230a_100000763424_100000748023 [0,2,0,0,0,0|2,0,0]=4 3278 B11R0.320 CCC(C)CNCC(C)(C)OC 270004a_100000763424_100000243153 [0,2,0,0,0,0|2,0,0]=4 3279 B11R0.320 CCC(C)CSCC(C)(C)CO 62a_100000748023_100009813988 [0,2,0,0,0,0|2,0,0]=4 3280 B11R0.320 CCC(C)CSCC(C)(C)CO 62a_100009813988_100000748023 [0,2,0,0,0,0|2,0,0]=4 3281 B11R0.320 CCC(C)CSCC(C)(C)OC 62a_100000701081_100000748023 [0,2,0,0,0,0|2,0,0]=4 3282 B11R0.320 CCC(C)CSCC(C)(C)OC 62a_100000748023_100000701081 [0,2,0,0,0,0|2,0,0]=4 3283 B11R0.320 CCC(C)OCCC(C)(C)OC 7a_100000699976_100000758301 [0,2,0,0,0,0|2,0,0]=4 3284 B11R0.320 CCC(O)CNCC(C)(C)CO 2230a_100020635058_100011218378 [0,2,0,0,0,0|2,0,0]=4 3285 B11R0.320 CCC(O)CNCC(C)(C)OC 2230a_100000763424_100011218378 [0,2,0,0,0,0|2,0,0]=4 3286 B11R0.320 CCC(O)CSCC(C)(C)CO 62a_100009813988_100011218378 [0,2,0,0,0,0|2,0,0]=4 3287 B11R0.320 CCC(O)CSCC(C)(C)CO 62a_100011218378_100009813988 [0,2,0,0,0,0|2,0,0]=4 3288 B11R0.320 CCC(O)CSCC(C)(C)OC 62a_100000701081_100011218378 [0,2,0,0,0,0|2,0,0]=4 3289 B11R0.320 CCC(O)CSCC(C)(C)OC 62a_100011218378_100000701081 [0,2,0,0,0,0|2,0,0]=4 3290 B11R0.320 CC[C@H](C)CNCC(C)(C)CO 2230a_100020635058_100009816398 [0,2,0,0,0,0|2,0,0]=4 3291 B11R0.320 CC[C@H](C)CNCC(C)(C)OC 2230a_100000763424_100009816398 [0,2,0,0,0,0|2,0,0]=4 3292 B11R0.320 CC[C@H](C)COCC(C)(C)CO 7a_100009816381_100009813988 [0,2,0,0,0,0|2,0,0]=4 3293 B11R0.320 CC[C@H](C)CSCC(C)(C)CO 62a_100009813988_100009816398 [0,2,0,0,0,0|2,0,0]=4 3294 B11R0.320 CC[C@H](C)CSCC(C)(C)CO 62a_100009816398_100009813988 [0,2,0,0,0,0|2,0,0]=4 3295 B11R0.320 CC[C@H](C)CSCC(C)(C)OC 62a_100000701081_100009816398 [0,2,0,0,0,0|2,0,0]=4 3296 B11R0.320 CC[C@H](C)CSCC(C)(C)OC 62a_100009816398_100000701081 [0,2,0,0,0,0|2,0,0]=4 3297 B11R0.320 COC(C)(C)CCOC(C)C#N 7a_100000699976_100000703298 [0,2,0,0,0,0|1,0,1]=4 3298 B11R0.320 COC(C)(C)CCOC(C)CO 7a_100000699976_100012180447 [0,2,0,0,0,0|2,0,0]=4 3299 B11R0.320 COC(C)(C)CNCC(C)CO 34a_100000744482_100000701081 [0,2,0,0,0,0|2,0,0]=4 3300 B11R0.320 COC(C)(C)CNCC(O)CO 2230a_100000763424_100011219619 [0,2,0,0,0,0|2,0,0]=4 3301 B11R0.320 COC(C)(C)CNC[C@@H](C)CO 2230a_100000763424_100000059175 [0,2,0,0,0,0|2,0,0]=4 3302 B11R0.320 COC(C)(C)CNC[C@@H](F)CO 34a_100015665980_100000701081 [0,2,0,0,0,0|2,0,0]=4 3303 B11R0.320 COC(C)(C)CNC[C@@H](O)CF 2230a_100000763424_100015614560 [0,2,0,0,0,0|2,0,0]=4 3304 B11R0.320 COC(C)(C)CNC[C@@H](O)CO 2230a_100000763424_100009815848 [0,2,0,0,0,0|2,0,0]=4 3305 B11R0.320 COC(C)(C)COCC(C)CN 34a_100000744482_100000701081 [0,2,0,0,0,0|1,0,0]=3 3306 B11R0.320 COC(C)(C)COCC(Cl)CCl 34a_100000033668_100000701081 [0,2,0,0,0,0|2,0,0]=4 3307 B11R0.320 COC(C)(C)COC[C@H](F)CN 34a_100015665980_100000701081 [0,2,0,0,0,0|2,0,0]=4 3308 B11R0.320 COC(C)(C)CSCC(O)CO 62a_100000701081_100011219619 [0,2,0,0,0,0|2,0,0]=4 3309 B11R0.320 COC(C)(C)CSCC(O)CO 62a_100011219619_100000701081 [0,2,0,0,0,0|2,0,0]=4 3310 B11R0.320 COC(C)(C)CSC[C@@H](C)CO 62a_100000059175_100000701081 [0,2,0,0,0,0|2,0,0]=4 3311 B11R0.320 COC(C)(C)CSC[C@@H](C)CO 62a_100000701081_100000059175 [0,2,0,0,0,0|2,0,0]=4 3312 B11R0.320 COC(C)(C)CSC[C@@H](O)CF 62a_100000701081_100015614560 [0,2,0,0,0,0|2,0,0]=4 3313 B11R0.320 COC(C)(C)CSC[C@@H](O)CF 62a_100015614560_100000701081 [0,2,0,0,0,0|2,0,0]=4 3314 B11R0.320 COC(C)(C)CSC[C@@H](O)CO 62a_100000701081_100009815848 [0,2,0,0,0,0|2,0,0]=4 3315 B11R0.320 COC(C)(C)CSC[C@@H](O)CO 62a_100009815848_100000701081 [0,2,0,0,0,0|2,0,0]=4 3316 B11R0.320 COC(C)COCC(C)(C)CO 34a_100000690652_100009813988 [0,2,0,0,0,0|2,0,0]=4 3317 B11R0.320 COC(C)COCC(C)(C)OC 34a_100000690652_100000701081 [0,2,0,0,0,0|2,0,0]=4 3318 B11R0.320 C[C@@H](CO)CNCC(C)(C)CO 2230a_100020635058_100000059175 [0,2,0,0,0,0|2,0,0]=4 3319 B11R0.320 C[C@@H](CO)CSCC(C)(C)CO 62a_100000059175_100009813988 [0,2,0,0,0,0|2,0,0]=4 3320 B11R0.320 C[C@@H](CO)CSCC(C)(C)CO 62a_100009813988_100000059175 [0,2,0,0,0,0|2,0,0]=4 3321 B11R0.104 CC(C)CCCC(C)(C)OCF 7a_100011215742_100015361967 [0,2,0,0,0,0|1,0,0]=3 3322 B11R0.104 CCOC(C)(C)CCCC(C)C 7a_100011215742_100000210202 [0,2,0,0,0,0|1,0,0]=3 3323 B11R0.104 COCC(C)(C)CNCC(C)C 2230a_100000734190_100000210760 [0,2,0,0,0,0|2,0,0]=4 3324 B11R0.104 COCC(C)(C)CNCC(C)C 270004a_100000734190_100000210432 [0,2,0,0,0,0|2,0,0]=4 3325 B11R0.104 COCC(C)(C)CNCC(C)O 2230a_100000734190_100011218427 [0,2,0,0,0,0|2,0,0]=4 3326 B11R0.104 COCC(C)(C)CNC[C@@H](C)O 2230a_100000734190_100009817552 [0,2,0,0,0,0|2,0,0]=4 3327 B11R0.104 COCC(C)(C)NCCC(C)C 2230a_100000752728_100000210312 [0,2,0,0,0,0|2,0,0]=4 3328 B11R0.104 COCC(C)(C)NCCC(C)O 2230a_100000752728_100012276601 [0,2,0,0,0,0|2,0,0]=4 3329 B11R0.202 CC(C)CNCC(C)(C)C(=O)O 269956a_100000693527_100000210760 [0,2,0,0,0,0|2,0,0]=4 3330 B11R0.202 CC(O)CNCC(C)(C)C(=O)O 269956a_100000693527_100011218427 [0,2,0,0,0,0|2,0,0]=4 3331 B11R0.202 C[C@@H](N)CCOC(C)(C)C(=O)N 34a_100000706166_100000702505 [0,2,0,0,0,0|1,0,1]=4 3332 B11R0.202 C[C@@H](N)COCC(C)(C)C(=O)N 34a_100000737577_200009895572 [0,2,0,0,0,0|1,0,1]=4 3333 B11R0.202 C[C@@H](O)CNCC(C)(C)C(=O)O 269956a_100000693527_100009817552 [0,2,0,0,0,0|2,0,0]=4 3334 B11R0.213 C=CC(C)(CCCC(C)C)OC 34a_200000067283_200000210301 [0,2,0,0,0,0|1,0,1]=4 3335 B11R0.213 C=CC(C)(CCCC(C)C)OC 7a_200000067283_200000210301 [0,2,0,0,0,0|1,0,1]=4 3336 B11R0.213 C=CC(C)(CCCC(C)C)O[13CH3] 34a_200000067283_200025704644 [0,2,0,0,0,0|1,0,1]=4 3337 B11R0.213 C=CC(C)(CCCC(C)C)O[13CH3] 7a_200000067283_200025704644 [0,2,0,0,0,0|1,0,1]=4 3338 B11R0.213 CCC(C)(CCCC(C)C)OC 7a_100011215589_200000210301 [0,2,0,0,0,0|1,0,0]=3 3339 B11R0.213 CCC(C)(CCCC(C)C)O[13CH3] 7a_100011215589_200025704644 [0,2,0,0,0,0|1,0,0]=3 3340 B11R0.213 COC(C)(CNCC(C)C)OC 2230a_100000210953_100000064154 [0,2,0,0,0,0|2,0,0]=4 3341 B11R0.213 COC(C)(CNCC(C)C)OC 2230a_100000732740_100000210760 [0,2,0,0,0,0|2,0,0]=4 3342 B11R0.213 COC(C)(CNCC(C)C)OC 34a_100000210953_100000766008 [0,2,0,0,0,0|2,0,0]=4 3343 B11R0.213 COC(C)(CNCC(C)O)OC 2230a_100000210904_100000064154 [0,2,0,0,0,0|2,0,0]=4 3344 B11R0.213 COC(C)(CNCC(C)O)OC 2230a_100000732740_100011218427 [0,2,0,0,0,0|2,0,0]=4 3345 B11R0.213 COC(C)(CNCC(C)O)OC 34a_100000210904_100000766008 [0,2,0,0,0,0|2,0,0]=4 3346 B11R0.213 COC(C)(CNC[C@@H](C)O)OC 2230a_100000732740_100009817552 [0,2,0,0,0,0|2,0,0]=4 3347 B11R0.213 COC(C)(COCC(C)Br)OC 34a_100012180447_100000766008 [0,2,0,0,0,0|2,0,0]=4 3348 B11R0.213 COC(C)(COCC(C)C)OC 34a_100000210257_100000766008 [0,2,0,0,0,0|2,0,0]=4 3349 B11R0.213 COC(C)(COCC(C)F)OC 34a_100015925927_100000766008 [0,2,0,0,0,0|2,0,0]=4 3350 B11R0.213 COC(C)(COC[C@@H](C)Cl)OC 34a_100016084084_100000766008 [0,2,0,0,0,0|2,0,0]=4 3351 B11R0.213 COC(C)(COC[C@@H](C)N)OC 34a_100000737577_100000766008 [0,2,0,0,0,0|1,0,0]=3 3352 B11R0.213 COC(C)(CSCC(C)C)OC 62a_100000210624_100000766008 [0,2,0,0,0,0|2,0,0]=4 3353 B11R0.213 COC(C)(CSCC(C)C)OC 62a_100000766008_100000210760 [0,2,0,0,0,0|2,0,0]=4 3354 B11R0.213 COC(C)(CSCC(C)O)OC 62a_100000766008_100011218427 [0,2,0,0,0,0|2,0,0]=4 3355 B11R0.213 COC(C)(CSCC(C)O)OC 62a_100011218427_100000766008 [0,2,0,0,0,0|2,0,0]=4 3356 B11R0.213 COC(C)(CSC[C@@H](C)O)OC 62a_100000766008_100009817552 [0,2,0,0,0,0|2,0,0]=4 3357 B11R0.213 COC(C)(CSC[C@@H](C)O)OC 62a_100009817552_100000766008 [0,2,0,0,0,0|2,0,0]=4 3358 B11R0.302 CC(C)C(C)OCC(C)(C)CO 7a_100000748068_100009813988 [0,2,0,0,0,0|2,0,0]=4 3359 B11R0.313 C#CC(OCC(C)(C)O)C(C)C 34a_100011217124_100000764493 [0,2,0,0,0,0|2,0,0]=4 3360 B11R0.313 C#CC(OCC(C)(C)O)C(C)C 7a_100011217124_100000764493 [0,2,0,0,0,0|2,0,0]=4 3361 B11R0.313 C=CC(OCC(C)(C)O)C(C)C 34a_100000732651_100000764493 [0,2,0,0,0,0|2,0,0]=4 3362 B11R0.313 C=CC(OCC(C)(C)O)C(C)C 7a_100000732651_100000764493 [0,2,0,0,0,0|2,0,0]=4 3363 B11R0.313 CC(C)C(C#N)OCC(C)(C)O 34a_100000748901_100000764493 [0,2,0,0,0,0|2,0,0]=4 3364 B11R0.313 CC(C)C(C#N)OCC(C)(C)O 7a_100000748901_100000764493 [0,2,0,0,0,0|2,0,0]=4 3365 B11R0.313 CC(C)C(CN)OCC(C)(C)O 34a_100000759067_100000764493 [0,2,0,0,0,0|2,0,0]=4 3366 B11R0.313 CC(C)[C@H](CO)NCC(C)(C)O 34a_100011830312_100000764493 [0,2,0,0,0,0|2,0,0]=4 3367 B11R0.313 CCC(NCC(C)(C)O)C(C)C 270004a_100000751335_100000210600 [0,2,0,0,0,0|2,0,0]=4 3368 B11R0.313 CCC(OCC(C)(C)O)C(C)C 34a_100011218073_100000764493 [0,2,0,0,0,0|2,0,0]=4 3369 B11R0.313 CCC(OCC(C)(C)O)C(C)C 7a_100011218073_100000764493 [0,2,0,0,0,0|2,0,0]=4 3370 B11R0.313 CCN(CCC(C)(C)O)C(C)C 2230a_100000223864_100000702414 [0,2,0,0,0,0|2,0,0]=4 3371 B11R0.313 CC[C@H](NCC(C)(C)O)[C@@H](C)O 34a_100161114882_100000764493 [0,2,0,0,0,0|2,0,0]=4 3372 B11R0.313 C[C@@H](O)[C@@H](CO)NCC(C)(C)O 34a_100015196842_100000764493 [0,2,0,0,0,0|2,0,0]=4 3373 B11R0.429 CC(C)C(C)(C)OCC(C)(C)O 7a_100011215261_100000764493 [0,2,0,0,0,0|2,0,0]=4 3374 B9R1.19 CC(C)(C)N1CCCC1 269982a_100000188435_100000210625 [1,0,0,1,0,0|2,0,0]=4 3375 B9R1.66 CC1(CCCN(C1)[13CH3])C 2230a_100000716857_200025704644 [1,0,0,1,0,0|2,0,0]=4 3376 B9R1.66 CC1(CCCN(C1)[13CH3])C 269982a_100000716857_200025704644 [1,0,0,1,0,0|2,0,0]=4 3377 B9R1.66 CC1(CCCN(C1)[13CH3])C 34a_100000716857_200025704644 [1,0,0,1,0,0|2,0,0]=4 3378 B9R1.66 CC1(CCCN(C1)[13CH3])O 2230a_100000695535_200025704644 [1,0,0,1,0,0|1,0,0]=3 3379 B9R1.66 CC1(CCCN(C1)[13CH3])O 269982a_100000695535_200025704644 [1,0,0,1,0,0|1,0,0]=3 3380 B9R1.66 CN1CCCC(C1)(C)C 2230a_100000716857_200000210301 [1,0,0,1,0,0|2,0,0]=4 3381 B9R1.66 CN1CCCC(C1)(C)C 269982a_100000716857_200000210301 [1,0,0,1,0,0|2,0,0]=4 3382 B9R1.66 CN1CCCC(C1)(C)C 34a_100000716857_200000210301 [1,0,0,1,0,0|2,0,0]=4 3383 B9R1.66 CN1CCCC(C1)(C)O 2230a_100000695535_200000210301 [1,0,0,1,0,0|1,0,0]=3 3384 B9R1.66 CN1CCCC(C1)(C)O 269982a_100000695535_200000210301 [1,0,0,1,0,0|1,0,0]=3 3385 B9R1.68 CC1CCN1C(C)(C)C 269982a_100000755817_100000210625 [1,0,0,1,0,0|2,0,0]=4 3386 B9R1.68 CC1CCN1C(C)(C)C 34a_100000755817_100000210625 [1,0,0,1,0,0|2,0,0]=4 3387 B9R1.77 CC1(OC1COCF)C 34a_200010283642_100015361967 [1,0,0,1,0,0|2,0,0]=4 3388 B9R1.77 CC1(OC1COCF)C 7a_200010283642_100015361967 [1,0,0,1,0,0|2,0,0]=4 3389 B9R1.77 CCOCC1CC1(C)C 34a_100000728257_100000210202 [1,0,0,1,0,0|2,0,0]=4 3390 B9R1.77 CCOCC1CC1(C)C 7a_100000728257_100000210202 [1,0,0,1,0,0|2,0,0]=4 3391 B9R1.77 CCOCC1OC1(C)C 34a_200010283642_100000210202 [1,0,0,1,0,0|1,0,0]=3 3392 B9R1.77 CCOCC1OC1(C)C 7a_200010283642_100000210202 [1,0,0,1,0,0|1,0,0]=3 3393 B9R1.99 CC1(CO1)CNCCF 34a_100000724931_100000760498 [1,0,0,1,0,0|2,0,0]=4 3394 B9R1.99 CC1(CO1)CNCCO 34a_100016990907_100000760498 [1,0,0,1,0,0|2,0,0]=4 3395 B9R1.99 CC1(CO1)COCCBr 34a_100000211926_100000760498 [1,0,0,1,0,0|2,0,0]=4 3396 B9R1.99 CC1(CO1)COCCN 34a_100000210304_100000760498 [1,0,0,1,0,0|1,0,0]=3 3397 B9R1.99 CC1(CO1)CSCCF 62a_100000760498_100011217306 [1,0,0,1,0,0|2,0,0]=4 3398 B9R1.99 CC1(CO1)CSCCF 62a_100011217306_100000760498 [1,0,0,1,0,0|2,0,0]=4 3399 B9R1.99 CC1(CO1)CSCCO 62a_100000211926_100000760498 [1,0,0,1,0,0|2,0,0]=4 3400 B9R1.99 CC1(CO1)CSCCO 62a_100000760498_100000211926 [1,0,0,1,0,0|2,0,0]=4 3401 B9R1.99 CCCCNC1(CC1)C 2230a_100000757604_100000210211 [1,0,0,1,0,0|2,0,0]=4 3402 B9R1.99 CCCCOC1(CC1)C 7a_100011725673_100000210211 [1,0,0,1,0,0|2,0,0]=4 3403 B9R1.99 CCCNCC1(CC1)C 2230a_100000766693_100000210303 [1,0,0,1,0,0|2,0,0]=4 3404 B9R1.99 CCCNCC1(CC1)O 2230a_100011936951_100000210303 [1,0,0,1,0,0|1,0,0]=3 3405 B9R1.99 CCCOCC1(CC1)C 7a_100000698024_100000210303 [1,0,0,1,0,0|2,0,0]=4 3406 B9R1.99 CCCOCC1(CC1)F 34a_200000703853_100000210303 [1,0,0,1,0,0|2,0,0]=4 3407 B9R1.99 CCCOCC1(CC1)F 7a_200000703853_100000210303 [1,0,0,1,0,0|2,0,0]=4 3408 B9R1.99 CCCOCC1(CO1)C 34a_100000210258_100000760498 [1,0,0,1,0,0|1,0,0]=3 3409 B9R1.99 CCCSCC1(CO1)C 62a_100000210303_100000760498 [1,0,0,1,0,0|1,0,0]=3 3410 B9R1.99 CCCSCC1(CO1)C 62a_100000760498_100000210303 [1,0,0,1,0,0|1,0,0]=3 3411 B9R1.99 COCNCC1(CC1)O 2230a_100011936951_100000766300 [1,0,0,1,0,0|2,0,0]=4 3412 B9R1.99 COCSCC1(CO1)C 62a_100000760498_100000766300 [1,0,0,1,0,0|2,0,0]=4 3413 B9R1.99 COCSCC1(CO1)C 62a_100000766300_100000760498 [1,0,0,1,0,0|2,0,0]=4 3414 B9R1.99 CSCNCC1(CC1)O 2230a_100011936951_100011218213 [1,0,0,1,0,0|2,0,0]=4 3415 B9R1.99 CSCSCC1(CO1)C 62a_100000760498_100011218213 [1,0,0,1,0,0|2,0,0]=4 3416 B9R1.99 CSCSCC1(CO1)C 62a_100011218213_100000760498 [1,0,0,1,0,0|2,0,0]=4 3417 B9R1.99 OC1(CC1)CNCCF 2230a_100011936951_100011217306 [1,0,0,1,0,0|2,0,0]=4 3418 B9R1.99 OCCNCC1(CC1)O 2230a_100011936951_100000211926 [1,0,0,1,0,0|2,0,0]=4 3419 B9R1.114 CC(C)(C)NC1CCC1 34a_100000749019_100000210625 [1,0,0,1,0,0|2,0,0]=4 3420 B9R1.114 CC(C)(C)OC1CCC1 34a_100000748187_100000210625 [1,0,0,1,0,0|2,0,0]=4 3421 B9R1.114 CC(C)(C)OC1CCC1 34a_100015890283_100000749161 [1,0,0,1,0,0|2,0,0]=4 3422 B9R1.114 CC(C)(C)SC1CCC1 62a_100000211941_100000749161 [1,0,0,1,0,0|2,0,0]=4 3423 B9R1.115 CC(C)(C)CNC1CC1 34a_100000212008_100011219605 [1,0,0,1,0,0|2,0,0]=4 3424 B9R1.115 CC(C)(C)CSC1CC1 62a_100011219605_100000211595 [1,0,0,1,0,0|2,0,0]=4 3425 B9R1.115 CC(C)(C)NCC1CC1 2230a_100000715429_100000742324 [1,0,0,1,0,0|2,0,0]=4 3426 B9R1.115 CC(C)(C)NCC1CC1 34a_100000735609_100000210625 [1,0,0,1,0,0|2,0,0]=4 3427 B9R1.115 CC(C)(C)OCC1CC1 34a_100000211283_100000210625 [1,0,0,1,0,0|2,0,0]=4 3428 B9R1.115 CC(C)(C)OCC1CC1 34a_100015890283_100000742324 [1,0,0,1,0,0|2,0,0]=4 3429 B9R1.115 CC(C)(C)OCC1CC1 7a_100015890283_100000742324 [1,0,0,1,0,0|2,0,0]=4 3430 B9R1.115 CC(C)(C)SCC1CC1 62a_100000211941_100000742324 [1,0,0,1,0,0|2,0,0]=4 3431 B9R1.115 CC(C)(C)SCC1CC1 62a_100000756562_100000211941 [1,0,0,1,0,0|2,0,0]=4 3432 B9R1.115 CC(C)(F)CNC1CC1 34a_100000212008_100011997219 [1,0,0,1,0,0|2,0,0]=4 3433 B9R1.115 CC(C)(F)COC1CC1 34a_100000716592_100000211595 [1,0,0,1,0,0|2,0,0]=4 3434 B9R1.115 CC(C)(F)CSC1CC1 62a_100011997219_100000211595 [1,0,0,1,0,0|2,0,0]=4 3435 B9R1.115 CC(C)(O)CNC1CC1 34a_100000212008_100000764493 [1,0,0,1,0,0|1,0,0]=3 3436 B9R1.115 CC(C)(O)CSC1CC1 62a_100000764493_100000211595 [1,0,0,1,0,0|1,0,0]=3 3437 B9R1.133 CC1(CCN(C1)CF)O 269982a_100000718628_100015361967 [1,0,0,1,0,0|2,0,0]=4 3438 B9R1.133 CCN1CCC(C1)(C)C 2230a_100000764714_100000210202 [1,0,0,1,0,0|2,0,0]=4 3439 B9R1.133 CCN1CCC(C1)(C)C 269982a_100000764714_100000204670 [1,0,0,1,0,0|2,0,0]=4 3440 B9R1.133 CCN1CCC(C1)(C)O 2230a_100000718628_100000210202 [1,0,0,1,0,0|1,0,0]=3 3441 B9R1.133 CCN1CCC(C1)(C)O 269982a_100000718628_100000204670 [1,0,0,1,0,0|1,0,0]=3 3442 B9R1.133 CNC1CCC(C1)(C)C 270004a_106832991635_100000759959 [1,0,0,1,0,0|2,0,0]=4 3443 B9R1.136 CC1(CN(C1)CCF)O 2230a_100000718560_100011217306 [1,0,0,1,0,0|2,0,0]=4 3444 B9R1.136 CC1(CN(C1)CCF)O 269982a_100000718560_100011217306 [1,0,0,1,0,0|2,0,0]=4 3445 B9R1.136 CC1(CN(C1)CCO)O 2230a_100000718560_100000211926 [1,0,0,1,0,0|2,0,0]=4 3446 B9R1.136 CC1(CN(C1)CCO)O 269982a_100000718560_100000211926 [1,0,0,1,0,0|2,0,0]=4 3447 B9R1.136 CCCN1CC(C1)(C)C 2230a_100000753659_100000210303 [1,0,0,1,0,0|2,0,0]=4 3448 B9R1.136 CCCN1CC(C1)(C)C 269982a_100000753659_100000210303 [1,0,0,1,0,0|2,0,0]=4 3449 B9R1.136 CCCN1CC(C1)(C)F 2230a_100000696199_100000210303 [1,0,0,1,0,0|2,0,0]=4 3450 B9R1.136 CCCN1CC(C1)(C)F 269982a_100000696199_100000210303 [1,0,0,1,0,0|2,0,0]=4 3451 B9R1.136 CCCN1CC(C1)(C)O 2230a_100000718560_100000210303 [1,0,0,1,0,0|1,0,0]=3 3452 B9R1.136 CCCN1CC(C1)(C)O 269982a_100000718560_100000210303 [1,0,0,1,0,0|1,0,0]=3 3453 B9R1.136 CCN[C@H]1C[C@@](C1)(C)O 2230a_100121572536_100000210202 [1,0,0,1,0,0|1,0,0]=3 3454 B9R1.136 CNC[C@H]1C[C@@](C1)(C)O 2230a_100015257651_200000210301 [1,0,0,1,0,0|1,0,0]=3 3455 B9R1.136 COCN1CC(C1)(C)O 2230a_100000718560_100000766300 [1,0,0,1,0,0|2,0,0]=4 3456 B9R1.136 COCN1CC(C1)(C)O 269982a_100000718560_100000766300 [1,0,0,1,0,0|2,0,0]=4 3457 B9R1.136 CSCN1CC(C1)(C)O 2230a_100000718560_100011218213 [1,0,0,1,0,0|2,0,0]=4 3458 B9R1.136 CSCN1CC(C1)(C)O 269982a_100000718560_100011218213 [1,0,0,1,0,0|2,0,0]=4 3459 B9R1.136 C[C@@]1(C[C@H](C1)CN[13CH3])O 2230a_100015257651_200025704644 [1,0,0,1,0,0|1,0,0]=3 3460 B9R1.35 CC(=O)C1CCC(C1)O 1458a_100000688591_200000210301 [1,0,0,1,0,0|1,0,1]=4 3461 B9R1.35 CC(C)N1CCC(C1)O 2230a_100011215560_100000210206 [1,0,0,1,0,0|2,0,0]=4 3462 B9R1.35 CC(C)N1CCC(C1)O 269982a_100011215560_100000210206 [1,0,0,1,0,0|2,0,0]=4 3463 B9R1.35 CC(C)N1CC[C@@H](C1)F 2230a_100015203821_100000210206 [1,0,0,1,0,0|2,0,0]=4 3464 B9R1.35 CC(C)N1CC[C@@H](C1)F 269982a_100015203821_100000210206 [1,0,0,1,0,0|2,0,0]=4 3465 B9R1.35 CC(C)N1CC[C@@H](C1)F 34a_100015203821_100000210206 [1,0,0,1,0,0|2,0,0]=4 3466 B9R1.35 CC(C)N1CC[C@H](C1)C 2230a_100016987628_100000210206 [1,0,0,1,0,0|2,0,0]=4 3467 B9R1.35 CC(C)N1CC[C@H](C1)C 269982a_100016987628_100000210206 [1,0,0,1,0,0|2,0,0]=4 3468 B9R1.35 CC(C)N1CC[C@H](C1)C 34a_100016987628_100000210206 [1,0,0,1,0,0|2,0,0]=4 3469 B9R1.35 CC1CCC(C1)N(C)C 270004a_100102631434_100011215218 [1,0,0,1,0,0|2,0,0]=4 3470 B9R1.35 CN(C)C1CCC(C1)O 270004a_100102631434_100012614533 [1,0,0,1,0,0|2,0,0]=4 3471 B9R1.35 [13CH3]C(=O)C1CCC(C1)O 1458a_100000688591_200025704644 [1,0,0,1,0,0|1,0,1]=4 3472 B9R1.46 CC(C)CN[C@@H]1C[C@@H]1F 2230a_100015190264_100000210760 [1,0,0,1,0,0|2,0,0]=4 3473 B9R1.46 CC(C)CN[C@@H]1C[C@H]1F 2230a_100025746932_100000210760 [1,0,0,1,0,0|2,0,0]=4 3474 B9R1.46 CC(C)CN[C@@H]1C[C@H]1F 34a_100025746932_100000210624 [1,0,0,1,0,0|2,0,0]=4 3475 B9R1.46 CC(C)OCC1CC1C 34a_100000744939_100000210206 [1,0,0,1,0,0|2,0,0]=4 3476 B9R1.46 CC(C)OCC1CC1C 7a_100000744939_100000210206 [1,0,0,1,0,0|2,0,0]=4 3477 B9R1.46 CC(O)CN[C@@H]1C[C@@H]1F 2230a_100015190264_100011218427 [1,0,0,1,0,0|2,0,0]=4 3478 B9R1.46 CC(O)CN[C@@H]1C[C@H]1F 2230a_100025746932_100011218427 [1,0,0,1,0,0|2,0,0]=4 3479 B9R1.46 CC(O)CN[C@@H]1C[C@H]1F 34a_100025746932_100011218427 [1,0,0,1,0,0|2,0,0]=4 3480 B9R1.46 C[C@@H](O)CN[C@@H]1C[C@@H]1F 2230a_100015190264_100009817552 [1,0,0,1,0,0|2,0,0]=4 3481 B9R1.46 C[C@@H](O)CN[C@@H]1C[C@H]1F 2230a_100025746932_100009817552 [1,0,0,1,0,0|2,0,0]=4 3482 B9R1.46 C[C@@H](O)CN[C@@H]1C[C@H]1F 34a_100025746932_100009817552 [1,0,0,1,0,0|2,0,0]=4 3483 B9R1.49 CC1CCCN(CC1)C 2230a_100025706717_200000210301 [1,0,0,1,0,0|2,0,0]=4 3484 B9R1.49 CC1CCCN(CC1)C 269982a_100025706717_200000210301 [1,0,0,1,0,0|2,0,0]=4 3485 B9R1.49 CC1CCCN(CC1)C 34a_100025706717_200000210301 [1,0,0,1,0,0|2,0,0]=4 3486 B9R1.49 CC1CCCN(CC1)[13CH3] 2230a_100025706717_200025704644 [1,0,0,1,0,0|2,0,0]=4 3487 B9R1.49 CC1CCCN(CC1)[13CH3] 269982a_100025706717_200025704644 [1,0,0,1,0,0|2,0,0]=4 3488 B9R1.49 CC1CCCN(CC1)[13CH3] 34a_100025706717_200025704644 [1,0,0,1,0,0|2,0,0]=4 3489 B9R1.49 CN1CCCC(CC1)O 2230a_100015186869_200000210301 [1,0,0,1,0,0|2,0,0]=4 3490 B9R1.49 CN1CCCC(CC1)O 269982a_100015186869_200000210301 [1,0,0,1,0,0|2,0,0]=4 3491 B9R1.49 [13CH3]N1CCCC(CC1)O 2230a_100015186869_200025704644 [1,0,0,1,0,0|2,0,0]=4 3492 B9R1.49 [13CH3]N1CCCC(CC1)O 269982a_100015186869_200025704644 [1,0,0,1,0,0|2,0,0]=4 3493 B9R1.53 CC(C)CC1CN(C1)C 2230a_214813039686_200000210301 [1,0,0,1,0,0|2,0,0]=4 3494 B9R1.53 CC(C)CC1CN(C1)C 269982a_214813039686_200000210301 [1,0,0,1,0,0|2,0,0]=4 3495 B9R1.53 CC(C)CC1CN(C1)C 34a_214813039686_200000210301 [1,0,0,1,0,0|2,0,0]=4 3496 B9R1.53 CC(C)CC1CN(C1)[13CH3] 2230a_214813039686_200025704644 [1,0,0,1,0,0|2,0,0]=4 3497 B9R1.53 CC(C)CC1CN(C1)[13CH3] 269982a_214813039686_200025704644 [1,0,0,1,0,0|2,0,0]=4 3498 B9R1.53 CC(C)CC1CN(C1)[13CH3] 34a_214813039686_200025704644 [1,0,0,1,0,0|2,0,0]=4 3499 B9R1.53 CC(C)CN1CC(C1)C 2230a_100000702820_100000210760 [1,0,0,1,0,0|2,0,0]=4 3500 B9R1.53 CC(C)CN1CC(C1)C 269982a_100000702820_100000210624 [1,0,0,1,0,0|2,0,0]=4 3501 B9R1.53 CC(C)CN1CC(C1)C 270004a_100000702820_100000210432 [1,0,0,1,0,0|2,0,0]=4 3502 B9R1.53 CC(C)CN1CC(C1)C 34a_100000702820_100000210624 [1,0,0,1,0,0|2,0,0]=4 3503 B9R1.53 CC(C)CN1CC(C1)F 2230a_100000690557_100000210760 [1,0,0,1,0,0|2,0,0]=4 3504 B9R1.53 CC(C)CN1CC(C1)F 269982a_100000690557_100000210624 [1,0,0,1,0,0|2,0,0]=4 3505 B9R1.53 CC(C)CN1CC(C1)F 270004a_100000690557_100000210432 [1,0,0,1,0,0|2,0,0]=4 3506 B9R1.53 CC(C)CN1CC(C1)F 34a_100000690557_100000210624 [1,0,0,1,0,0|2,0,0]=4 3507 B9R1.53 CC(C)CN1CC(C1)O 269982a_100000749847_100000210624 [1,0,0,1,0,0|2,0,0]=4 3508 B9R1.53 CC(C)NC1CC(C1)F 2230a_100016993743_100000210206 [1,0,0,1,0,0|2,0,0]=4 3509 B9R1.53 CC(C)N[C@H]1C[C@@H](C1)O 2230a_100020629032_100000210206 [1,0,0,1,0,0|2,0,0]=4 3510 B9R1.53 CC(O)CN1CC(C1)C 2230a_100000702820_100011218427 [1,0,0,1,0,0|2,0,0]=4 3511 B9R1.53 CC(O)CN1CC(C1)C 269982a_100000702820_100011218427 [1,0,0,1,0,0|2,0,0]=4 3512 B9R1.53 CC(O)CN1CC(C1)C 34a_100000702820_100011218427 [1,0,0,1,0,0|2,0,0]=4 3513 B9R1.53 CC(O)CN1CC(C1)F 2230a_100000690557_100011218427 [1,0,0,1,0,0|2,0,0]=4 3514 B9R1.53 CC(O)CN1CC(C1)F 269982a_100000690557_100011218427 [1,0,0,1,0,0|2,0,0]=4 3515 B9R1.53 CC(O)CN1CC(C1)F 34a_100000690557_100011218427 [1,0,0,1,0,0|2,0,0]=4 3516 B9R1.53 CC(O)CN1CC(C1)O 269982a_100000749847_100011218427 [1,0,0,1,0,0|2,0,0]=4 3517 B9R1.53 CC1CN(C1)C[C@@H](C)O 2230a_100000702820_100009817552 [1,0,0,1,0,0|2,0,0]=4 3518 B9R1.53 CC1CN(C1)C[C@@H](C)O 269982a_100000702820_100009817552 [1,0,0,1,0,0|2,0,0]=4 3519 B9R1.53 CC1CN(C1)C[C@@H](C)O 34a_100000702820_100009817552 [1,0,0,1,0,0|2,0,0]=4 3520 B9R1.53 C[C@@H](O)CN1CC(C1)F 2230a_100000690557_100009817552 [1,0,0,1,0,0|2,0,0]=4 3521 B9R1.53 C[C@@H](O)CN1CC(C1)F 269982a_100000690557_100009817552 [1,0,0,1,0,0|2,0,0]=4 3522 B9R1.53 C[C@@H](O)CN1CC(C1)F 34a_100000690557_100009817552 [1,0,0,1,0,0|2,0,0]=4 3523 B9R1.53 C[C@@H](O)CN1CC(C1)O 269982a_100000749847_100009817552 [1,0,0,1,0,0|2,0,0]=4 3524 B9R1.85 CC(=O)CCCC1CO1 1458a_100000070787_100000733510 [1,0,0,1,0,0|1,0,1]=4 3525 B9R1.85 CC(Br)CCOC1CC1 34a_100009893172_100000211595 [1,0,0,1,0,0|2,0,0]=4 3526 B9R1.85 CC(Br)COCC1CC1 34a_100012180447_100000742324 [1,0,0,1,0,0|2,0,0]=4 3527 B9R1.85 CC(Br)COCC1CO1 34a_100012180447_102125554688 [1,0,0,1,0,0|2,0,0]=4 3528 B9R1.85 CC(C)CCNC1CC1 34a_100000212008_100000210312 [1,0,0,1,0,0|2,0,0]=4 3529 B9R1.85 CC(C)CCOC1CC1 34a_100000210254_100000211595 [1,0,0,1,0,0|2,0,0]=4 3530 B9R1.85 CC(C)CCSC1CC1 62a_100000210312_100000211595 [1,0,0,1,0,0|2,0,0]=4 3531 B9R1.85 CC(C)CNCC1CC1 2230a_100000210953_100000742324 [1,0,0,1,0,0|2,0,0]=4 3532 B9R1.85 CC(C)CNCC1CC1 2230a_100000735609_100000210760 [1,0,0,1,0,0|2,0,0]=4 3533 B9R1.85 CC(C)CNCC1CC1 269862a_100000210953_100000741477 [1,0,0,1,0,0|2,0,0]=4 3534 B9R1.85 CC(C)CNCC1CC1 270004a_100000735609_100000210432 [1,0,0,1,0,0|2,0,0]=4 3535 B9R1.85 CC(C)CNCC1CC1 34a_100000210953_100000742324 [1,0,0,1,0,0|2,0,0]=4 3536 B9R1.85 CC(C)CNCC1CC1 34a_100000735609_100000210624 [1,0,0,1,0,0|2,0,0]=4 3537 B9R1.85 CC(C)CNCC1CO1 2230a_100000210953_100011216344 [1,0,0,1,0,0|2,0,0]=4 3538 B9R1.85 CC(C)CNCC1CO1 34a_100000210953_102125554688 [1,0,0,1,0,0|2,0,0]=4 3539 B9R1.85 CC(C)COCC1CC1 34a_100000210257_100000742324 [1,0,0,1,0,0|2,0,0]=4 3540 B9R1.85 CC(C)COCC1CC1 34a_100000211283_100000210624 [1,0,0,1,0,0|2,0,0]=4 3541 B9R1.85 CC(C)COCC1CO1 34a_100000210257_102125554688 [1,0,0,1,0,0|2,0,0]=4 3542 B9R1.85 CC(C)COC[C@@H]1CO1 34a_100000757423_100000210624 [1,0,0,1,0,0|2,0,0]=4 3543 B9R1.85 CC(C)CSCC1CC1 62a_100000210624_100000742324 [1,0,0,1,0,0|2,0,0]=4 3544 B9R1.85 CC(C)CSCC1CC1 62a_100000756562_100000210760 [1,0,0,1,0,0|2,0,0]=4 3545 B9R1.85 CC(C)CSCC1CO1 62a_100000210624_102125554688 [1,0,0,1,0,0|2,0,0]=4 3546 B9R1.85 CC(C)CSCC1CO1 62a_102125554688_100000210760 [1,0,0,1,0,0|2,0,0]=4 3547 B9R1.85 CC(C)CSCC1CS1 62a_100000031435_100000210760 [1,0,0,1,0,0|2,0,0]=4 3548 B9R1.85 CC(C)CSCC1CS1 62a_100000210624_100000031435 [1,0,0,1,0,0|2,0,0]=4 3549 B9R1.85 CC(C)CSC[C@@H]1CO1 62a_100000210624_100000745022 [1,0,0,1,0,0|2,0,0]=4 3550 B9R1.85 CC(C)CSC[C@@H]1CO1 62a_100000745022_100000210760 [1,0,0,1,0,0|2,0,0]=4 3551 B9R1.85 CC(C)NCCC1CC1 2230a_100138425928_100000694398 [1,0,0,1,0,0|2,0,0]=4 3552 B9R1.85 CC(C)NCCC1CC1 34a_100000764129_100000210206 [1,0,0,1,0,0|2,0,0]=4 3553 B9R1.85 CC(C)NCCC1CC1 34a_100138425928_100000694398 [1,0,0,1,0,0|2,0,0]=4 3554 B9R1.85 CC(C)NCCC1CO1 2230a_100138425928_100000732470 [1,0,0,1,0,0|2,0,0]=4 3555 B9R1.85 CC(C)NCCC1CO1 34a_100138425928_100000732470 [1,0,0,1,0,0|2,0,0]=4 3556 B9R1.85 CC(C)OCCC1CC1 34a_100000212225_100000694398 [1,0,0,1,0,0|2,0,0]=4 3557 B9R1.85 CC(C)OCCC1CC1 34a_100000754188_100000210206 [1,0,0,1,0,0|2,0,0]=4 3558 B9R1.85 CC(C)OCCC1CC1 7a_100000754188_100000210206 [1,0,0,1,0,0|2,0,0]=4 3559 B9R1.85 CC(C)OCCC1CO1 34a_100000212225_100000732470 [1,0,0,1,0,0|2,0,0]=4 3560 B9R1.85 CC(C)OCC[C@@H]1CO1 34a_100009820653_100000210206 [1,0,0,1,0,0|2,0,0]=4 3561 B9R1.85 CC(C)SCCC1CC1 62a_100000210206_100000764125 [1,0,0,1,0,0|2,0,0]=4 3562 B9R1.85 CC(C)SCCC1CC1 62a_100000764125_100000210206 [1,0,0,1,0,0|2,0,0]=4 3563 B9R1.85 CC(C)SCCC1CO1 62a_100000210206_100000732470 [1,0,0,1,0,0|2,0,0]=4 3564 B9R1.85 CC(C)SCCC1CO1 62a_100000732470_100000210206 [1,0,0,1,0,0|2,0,0]=4 3565 B9R1.85 CC(F)COCC1CC1 34a_100015925927_100000742324 [1,0,0,1,0,0|2,0,0]=4 3566 B9R1.85 CC(F)COCC1CO1 34a_100015925927_102125554688 [1,0,0,1,0,0|2,0,0]=4 3567 B9R1.85 CC(O)CCNC1CC1 34a_100000212008_100012276601 [1,0,0,1,0,0|2,0,0]=4 3568 B9R1.85 CC(O)CCSC1CC1 62a_100012276601_100000211595 [1,0,0,1,0,0|2,0,0]=4 3569 B9R1.85 CC(O)CNCC1CC1 2230a_100000210904_100000742324 [1,0,0,1,0,0|2,0,0]=4 3570 B9R1.85 CC(O)CNCC1CC1 2230a_100000735609_100011218427 [1,0,0,1,0,0|2,0,0]=4 3571 B9R1.85 CC(O)CNCC1CC1 269862a_100000210904_100000741477 [1,0,0,1,0,0|2,0,0]=4 3572 B9R1.85 CC(O)CNCC1CC1 34a_100000210904_100000742324 [1,0,0,1,0,0|2,0,0]=4 3573 B9R1.85 CC(O)CNCC1CC1 34a_100000735609_100011218427 [1,0,0,1,0,0|2,0,0]=4 3574 B9R1.85 CC(O)CNCC1CO1 2230a_100000210904_100011216344 [1,0,0,1,0,0|2,0,0]=4 3575 B9R1.85 CC(O)CNCC1CO1 34a_100000210904_102125554688 [1,0,0,1,0,0|2,0,0]=4 3576 B9R1.85 CC(O)COCC1CC1 34a_100000211283_100011218427 [1,0,0,1,0,0|2,0,0]=4 3577 B9R1.85 CC(O)COC[C@@H]1CO1 34a_100000757423_100011218427 [1,0,0,1,0,0|2,0,0]=4 3578 B9R1.85 CC(O)CSCC1CC1 62a_100000756562_100011218427 [1,0,0,1,0,0|2,0,0]=4 3579 B9R1.85 CC(O)CSCC1CC1 62a_100011218427_100000742324 [1,0,0,1,0,0|2,0,0]=4 3580 B9R1.85 CC(O)CSCC1CO1 62a_100011218427_102125554688 [1,0,0,1,0,0|2,0,0]=4 3581 B9R1.85 CC(O)CSCC1CO1 62a_102125554688_100011218427 [1,0,0,1,0,0|2,0,0]=4 3582 B9R1.85 CC(O)CSCC1CS1 62a_100000031435_100011218427 [1,0,0,1,0,0|2,0,0]=4 3583 B9R1.85 CC(O)CSCC1CS1 62a_100011218427_100000031435 [1,0,0,1,0,0|2,0,0]=4 3584 B9R1.85 CC(O)CSC[C@@H]1CO1 62a_100000745022_100011218427 [1,0,0,1,0,0|2,0,0]=4 3585 B9R1.85 CC(O)CSC[C@@H]1CO1 62a_100011218427_100000745022 [1,0,0,1,0,0|2,0,0]=4 3586 B9R1.85 CN(C)CCCC1CO1 2230a_100102631434_100000733510 [1,0,0,1,0,0|2,0,0]=4 3587 B9R1.85 CN(C)CCCC1CO1 269982a_100102631434_100000733510 [1,0,0,1,0,0|2,0,0]=4 3588 B9R1.85 C[C@@H](Cl)COCC1CC1 34a_100016084084_100000742324 [1,0,0,1,0,0|2,0,0]=4 3589 B9R1.85 C[C@@H](Cl)COCC1CO1 34a_100016084084_102125554688 [1,0,0,1,0,0|2,0,0]=4 3590 B9R1.85 C[C@@H](N)CCOC1CC1 34a_100000706166_100000211595 [1,0,0,1,0,0|1,0,0]=3 3591 B9R1.85 C[C@@H](N)COCC1CC1 34a_100000737577_100000742324 [1,0,0,1,0,0|1,0,0]=3 3592 B9R1.85 C[C@@H](N)COCC1CO1 34a_100000737577_102125554688 [1,0,0,1,0,0|1,0,0]=3 3593 B9R1.85 C[C@@H](O)CNCC1CC1 2230a_100000735609_100009817552 [1,0,0,1,0,0|2,0,0]=4 3594 B9R1.85 C[C@@H](O)CNCC1CC1 34a_100000735609_100009817552 [1,0,0,1,0,0|2,0,0]=4 3595 B9R1.85 C[C@@H](O)COCC1CC1 34a_100000211283_100009817552 [1,0,0,1,0,0|2,0,0]=4 3596 B9R1.85 C[C@@H](O)COC[C@@H]1CO1 34a_100000757423_100009817552 [1,0,0,1,0,0|2,0,0]=4 3597 B9R1.85 C[C@@H](O)CSCC1CC1 62a_100000756562_100009817552 [1,0,0,1,0,0|2,0,0]=4 3598 B9R1.85 C[C@@H](O)CSCC1CC1 62a_100009817552_100000742324 [1,0,0,1,0,0|2,0,0]=4 3599 B9R1.85 C[C@@H](O)CSCC1CO1 62a_100009817552_102125554688 [1,0,0,1,0,0|2,0,0]=4 3600 B9R1.85 C[C@@H](O)CSCC1CO1 62a_102125554688_100009817552 [1,0,0,1,0,0|2,0,0]=4 3601 B9R1.85 C[C@@H](O)CSCC1CS1 62a_100000031435_100009817552 [1,0,0,1,0,0|2,0,0]=4 3602 B9R1.85 C[C@@H](O)CSCC1CS1 62a_100009817552_100000031435 [1,0,0,1,0,0|2,0,0]=4 3603 B9R1.85 C[C@@H](O)CSC[C@@H]1CO1 62a_100000745022_100009817552 [1,0,0,1,0,0|2,0,0]=4 3604 B9R1.85 C[C@@H](O)CSC[C@@H]1CO1 62a_100009817552_100000745022 [1,0,0,1,0,0|2,0,0]=4 3605 B9R1.10 CC1(CCN(CC1)[13CH3])O 2230a_100000690209_200025704644 [0,0,0,1,1,0|2,0,0]=4 3606 B9R1.10 CC1(CCN(CC1)[13CH3])O 269982a_100000690209_200025704644 [0,0,0,1,1,0|2,0,0]=4 3607 B9R1.10 CN1CCC(CC1)(C)O 2230a_100000690209_200000210301 [0,0,0,1,1,0|2,0,0]=4 3608 B9R1.10 CN1CCC(CC1)(C)O 269982a_100000690209_200000210301 [0,0,0,1,1,0|2,0,0]=4 3609 B9R1.51 CC(C)(O)C1CN(C1)[13CH3] 269982a_100000708124_200025704644 [0,0,0,1,1,0|2,0,0]=4 3610 B9R1.51 CC(C)(O)C1CN(C1)[13CH3] 34a_100000708124_200025704644 [0,0,0,1,1,0|2,0,0]=4 3611 B9R1.51 CN1CC(C1)C(C)(C)O 269982a_100000708124_200000210301 [0,0,0,1,1,0|2,0,0]=4 3612 B9R1.51 CN1CC(C1)C(C)(C)O 34a_100000708124_200000210301 [0,0,0,1,1,0|2,0,0]=4 3613 B9R1.147 CC(C)NCC1(CC1)O 2230a_100011936951_100000210206 [0,0,0,1,1,0|2,0,0]=4 3614 B9R1.147 CC(C)NCC1(CO1)C 34a_100138425928_100000760498 [0,0,0,1,1,0|2,0,0]=4 3615 B9R1.147 CC(C)OCC1(CO1)C 34a_100000212225_100000760498 [0,0,0,1,1,0|2,0,0]=4 3616 B9R1.147 CC(C)SCC1(CO1)C 62a_100000210206_100000760498 [0,0,0,1,1,0|2,0,0]=4 3617 B9R1.147 CC(C)SCC1(CO1)C 62a_100000760498_100000210206 [0,0,0,1,1,0|2,0,0]=4 3618 B9R1.164 CC(=O)[C@H]1C[C@@](C1)(C)O 1458a_100010742821_200000210301 [0,0,0,1,1,0|1,0,1]=4 3619 B9R1.164 CC(C)N1CC(C1)(C)O 2230a_100000718560_100000210206 [0,0,0,1,1,0|2,0,0]=4 3620 B9R1.164 CC(C)N1CC(C1)(C)O 269982a_100000718560_100000210206 [0,0,0,1,1,0|2,0,0]=4 3621 B9R1.164 C[C@@]1(C[C@H](C1)C(=O)[13CH3])O 1458a_100010742821_200025704644 [0,0,0,1,1,0|1,0,1]=4 3622 B11R1.76 CC(C)(C)CN1CCC(C1)O 270004a_100011215560_100011204126 [0,0,0,1,0,1|2,0,0]=4 3623 B11R1.76 CC(C)(C)CN1CC[C@@H](C1)F 270004a_100015203821_100011204126 [0,0,0,1,0,1|2,0,0]=4 3624 B11R1.76 CC(C)(C)CN1CC[C@@H](C1)F 34a_100015203821_100011219605 [0,0,0,1,0,1|2,0,0]=4 3625 B11R1.76 CC(C)(F)CN1CC[C@@H](C1)F 34a_100015203821_100011997219 [0,0,0,1,0,1|2,0,0]=4 3626 B11R1.76 CC(C)(O)CN1CC[C@@H](C1)F 34a_100015203821_100000764493 [0,0,0,1,0,1|1,0,0]=3 3627 B11R1.76 CC1CCC(C1)OC(C)(C)C 34a_100000698185_100000210625 [0,0,0,1,0,1|2,0,0]=4 3628 B11R1.76 C[C@@H]1CCN(C1)CC(C)(C)C 270004a_100016987628_100011204126 [0,0,0,1,0,1|2,0,0]=4 3629 B11R1.76 C[C@@H]1CCN(C1)CC(C)(C)C 34a_100016987628_100011219605 [0,0,0,1,0,1|2,0,0]=4 3630 B11R1.76 C[C@@H]1CCN(C1)CC(C)(C)F 34a_100016987628_100011997219 [0,0,0,1,0,1|2,0,0]=4 3631 B11R1.76 C[C@@H]1CCN(C1)CC(C)(C)O 34a_100016987628_100000764493 [0,0,0,1,0,1|1,0,0]=3 3632 B11R1.148 CC(C)(C)CCN[C@@H]1C[C@@H]1F 2230a_100015190264_100000755188 [0,0,0,1,0,1|2,0,0]=4 3633 B11R1.148 CC(C)(C)CCN[C@@H]1C[C@H]1F 2230a_100025746932_100000755188 [0,0,0,1,0,1|2,0,0]=4 3634 B11R1.148 CC(C)(C)CCN[C@@H]1C[C@H]1F 34a_100025746932_100000755188 [0,0,0,1,0,1|2,0,0]=4 3635 B11R1.148 CC(C)(O)CCN[C@@H]1C[C@@H]1F 2230a_100015190264_100000702414 [0,0,0,1,0,1|1,0,0]=3 3636 B11R1.148 CC(C)(O)CCN[C@@H]1C[C@H]1F 2230a_100025746932_100000702414 [0,0,0,1,0,1|1,0,0]=3 3637 B11R1.148 CC(C)(O)CCN[C@@H]1C[C@H]1F 34a_100025746932_100000702414 [0,0,0,1,0,1|1,0,0]=3 3638 B11R1.148 CC1CC1COCC(C)(C)C 34a_100000744939_100011219605 [0,0,0,1,0,1|2,0,0]=4 3639 B11R1.148 CC1CC1COCC(C)(C)F 34a_100000744939_100011997219 [0,0,0,1,0,1|2,0,0]=4 3640 B11R1.148 CC1CC1COCC(C)(C)O 34a_100000744939_100000764493 [0,0,0,1,0,1|1,0,0]=3 3641 B11R1.148 CC1CC1COCC(C)(C)O 7a_100000744939_100000764493 [0,0,0,1,0,1|1,0,0]=3 3642 B11R1.155 CC(C)(C)N1CCCC(C1)F 269982a_100000697950_100000210625 [0,0,0,1,0,1|2,0,0]=4 3643 B11R1.155 CC(C)(C)N1CCCC(C1)F 34a_100000697950_100000210625 [0,0,0,1,0,1|2,0,0]=4 3644 B11R1.155 CC(C)(C)N1CCCC(C1)O 269982a_100000211013_100000210625 [0,0,0,1,0,1|2,0,0]=4 3645 B11R1.155 C[C@H]1CCCN(C1)C(C)(C)C 269982a_100000717927_100000210625 [0,0,0,1,0,1|2,0,0]=4 3646 B11R1.155 C[C@H]1CCCN(C1)C(C)(C)C 34a_100000717927_100000210625 [0,0,0,1,0,1|2,0,0]=4 3647 B11R1.343 CC(C)(C)CCNCC1CC1 2230a_100000735609_100000755188 [0,0,0,1,0,1|2,0,0]=4 3648 B11R1.343 CC(C)(C)CCNCC1CC1 2230a_100000738805_100000742324 [0,0,0,1,0,1|2,0,0]=4 3649 B11R1.343 CC(C)(C)CCNCC1CC1 269862a_100000738805_100000741477 [0,0,0,1,0,1|2,0,0]=4 3650 B11R1.343 CC(C)(C)CCNCC1CC1 34a_100000735609_100000755188 [0,0,0,1,0,1|2,0,0]=4 3651 B11R1.343 CC(C)(C)CCNCC1CO1 2230a_100000738805_100011216344 [0,0,0,1,0,1|2,0,0]=4 3652 B11R1.343 CC(C)(C)CCOCC1CC1 34a_100000211283_100000755188 [0,0,0,1,0,1|2,0,0]=4 3653 B11R1.343 CC(C)(C)CCOCC1CC1 7a_100000765024_100000742324 [0,0,0,1,0,1|2,0,0]=4 3654 B11R1.343 CC(C)(C)CCOCC1CO1 7a_100000765024_102125554688 [0,0,0,1,0,1|2,0,0]=4 3655 B11R1.343 CC(C)(C)CCOCC1CS1 7a_100000765024_100000031435 [0,0,0,1,0,1|2,0,0]=4 3656 B11R1.343 CC(C)(C)CCOC[C@@H]1CO1 34a_100000757423_100000755188 [0,0,0,1,0,1|2,0,0]=4 3657 B11R1.343 CC(C)(C)CCOC[C@@H]1CO1 7a_100000765024_100000745022 [0,0,0,1,0,1|2,0,0]=4 3658 B11R1.343 CC(C)(C)CCSCC1CC1 62a_100000755188_100000742324 [0,0,0,1,0,1|2,0,0]=4 3659 B11R1.343 CC(C)(C)CCSCC1CC1 62a_100000756562_100000755188 [0,0,0,1,0,1|2,0,0]=4 3660 B11R1.343 CC(C)(C)CCSCC1CO1 62a_100000755188_102125554688 [0,0,0,1,0,1|2,0,0]=4 3661 B11R1.343 CC(C)(C)CCSCC1CO1 62a_102125554688_100000755188 [0,0,0,1,0,1|2,0,0]=4 3662 B11R1.343 CC(C)(C)CCSCC1CS1 62a_100000031435_100000755188 [0,0,0,1,0,1|2,0,0]=4 3663 B11R1.343 CC(C)(C)CCSCC1CS1 62a_100000755188_100000031435 [0,0,0,1,0,1|2,0,0]=4 3664 B11R1.343 CC(C)(C)CCSC[C@@H]1CO1 62a_100000745022_100000755188 [0,0,0,1,0,1|2,0,0]=4 3665 B11R1.343 CC(C)(C)CCSC[C@@H]1CO1 62a_100000755188_100000745022 [0,0,0,1,0,1|2,0,0]=4 3666 B11R1.343 CC(C)(C)CNCCC1CC1 2230a_100000743828_100000694398 [0,0,0,1,0,1|2,0,0]=4 3667 B11R1.343 CC(C)(C)CNCCC1CC1 270004a_100000764129_100011204126 [0,0,0,1,0,1|2,0,0]=4 3668 B11R1.343 CC(C)(C)CNCCC1CC1 34a_100000764129_100011219605 [0,0,0,1,0,1|2,0,0]=4 3669 B11R1.343 CC(C)(C)CNCCC1CO1 2230a_100000743828_100000732470 [0,0,0,1,0,1|2,0,0]=4 3670 B11R1.343 CC(C)(C)COCCC1CC1 34a_100000754188_100011219605 [0,0,0,1,0,1|2,0,0]=4 3671 B11R1.343 CC(C)(C)COCC[C@@H]1CO1 34a_100009820653_100011219605 [0,0,0,1,0,1|2,0,0]=4 3672 B11R1.343 CC(C)(C)CSCCC1CC1 62a_100000764125_100011219605 [0,0,0,1,0,1|2,0,0]=4 3673 B11R1.343 CC(C)(C)CSCCC1CC1 62a_100011219605_100000764125 [0,0,0,1,0,1|2,0,0]=4 3674 B11R1.343 CC(C)(C)CSCCC1CO1 62a_100000732470_100011219605 [0,0,0,1,0,1|2,0,0]=4 3675 B11R1.343 CC(C)(C)CSCCC1CO1 62a_100011219605_100000732470 [0,0,0,1,0,1|2,0,0]=4 3676 B11R1.343 CC(C)(C)NCCCC1CO1 2230a_100000715429_100000733510 [0,0,0,1,0,1|2,0,0]=4 3677 B11R1.343 CC(C)(C)OCCCC1CO1 34a_100015890283_100000733510 [0,0,0,1,0,1|2,0,0]=4 3678 B11R1.343 CC(C)(C)OCCCC1CO1 7a_100015890283_100000733510 [0,0,0,1,0,1|2,0,0]=4 3679 B11R1.343 CC(C)(C)SCCCC1CO1 62a_100000211941_100000733510 [0,0,0,1,0,1|2,0,0]=4 3680 B11R1.343 CC(C)(C)SCCCC1CO1 62a_100000733510_100000211941 [0,0,0,1,0,1|2,0,0]=4 3681 B11R1.343 CC(C)(F)CCNCC1CC1 2230a_100016253952_100000742324 [0,0,0,1,0,1|2,0,0]=4 3682 B11R1.343 CC(C)(F)CCNCC1CC1 269862a_100016253952_100000741477 [0,0,0,1,0,1|2,0,0]=4 3683 B11R1.343 CC(C)(F)CCNCC1CO1 2230a_100016253952_100011216344 [0,0,0,1,0,1|2,0,0]=4 3684 B11R1.343 CC(C)(F)CNCCC1CC1 2230a_100020643315_100000694398 [0,0,0,1,0,1|2,0,0]=4 3685 B11R1.343 CC(C)(F)CNCCC1CC1 34a_100000764129_100011997219 [0,0,0,1,0,1|2,0,0]=4 3686 B11R1.343 CC(C)(F)CNCCC1CO1 2230a_100020643315_100000732470 [0,0,0,1,0,1|2,0,0]=4 3687 B11R1.343 CC(C)(F)COCCC1CC1 34a_100000716592_100000694398 [0,0,0,1,0,1|2,0,0]=4 3688 B11R1.343 CC(C)(F)COCCC1CC1 34a_100000754188_100011997219 [0,0,0,1,0,1|2,0,0]=4 3689 B11R1.343 CC(C)(F)COCCC1CO1 34a_100000716592_100000732470 [0,0,0,1,0,1|2,0,0]=4 3690 B11R1.343 CC(C)(F)COCC[C@@H]1CO1 34a_100009820653_100011997219 [0,0,0,1,0,1|2,0,0]=4 3691 B11R1.343 CC(C)(F)CSCCC1CC1 62a_100000764125_100011997219 [0,0,0,1,0,1|2,0,0]=4 3692 B11R1.343 CC(C)(F)CSCCC1CC1 62a_100011997219_100000764125 [0,0,0,1,0,1|2,0,0]=4 3693 B11R1.343 CC(C)(F)CSCCC1CO1 62a_100000732470_100011997219 [0,0,0,1,0,1|2,0,0]=4 3694 B11R1.343 CC(C)(F)CSCCC1CO1 62a_100011997219_100000732470 [0,0,0,1,0,1|2,0,0]=4 3695 B11R1.343 CC(C)(O)CCCNC1CC1 34a_100000212008_100009888830 [0,0,0,1,0,1|1,0,0]=3 3696 B11R1.343 CC(C)(O)CCCSC1CC1 62a_100009888830_100000211595 [0,0,0,1,0,1|1,0,0]=3 3697 B11R1.343 CC(C)(O)CCNCC1CC1 2230a_100000735609_100000702414 [0,0,0,1,0,1|1,0,0]=3 3698 B11R1.343 CC(C)(O)CCNCC1CC1 269862a_100000707701_100000741477 [0,0,0,1,0,1|1,0,0]=3 3699 B11R1.343 CC(C)(O)CCNCC1CC1 34a_100000735609_100000702414 [0,0,0,1,0,1|1,0,0]=3 3700 B11R1.343 CC(C)(O)CCOCC1CC1 34a_100000211283_100000702414 [0,0,0,1,0,1|1,0,0]=3 3701 B11R1.343 CC(C)(O)CCOC[C@@H]1CO1 34a_100000757423_100000702414 [0,0,0,1,0,1|1,0,0]=3 3702 B11R1.343 CC(C)(O)CCSCC1CC1 62a_100000702414_100000742324 [0,0,0,1,0,1|1,0,0]=3 3703 B11R1.343 CC(C)(O)CCSCC1CC1 62a_100000756562_100000702414 [0,0,0,1,0,1|1,0,0]=3 3704 B11R1.343 CC(C)(O)CCSCC1CO1 62a_100000702414_102125554688 [0,0,0,1,0,1|1,0,0]=3 3705 B11R1.343 CC(C)(O)CCSCC1CO1 62a_102125554688_100000702414 [0,0,0,1,0,1|1,0,0]=3 3706 B11R1.343 CC(C)(O)CCSCC1CS1 62a_100000031435_100000702414 [0,0,0,1,0,1|1,0,0]=3 3707 B11R1.343 CC(C)(O)CCSCC1CS1 62a_100000702414_100000031435 [0,0,0,1,0,1|1,0,0]=3 3708 B11R1.343 CC(C)(O)CCSC[C@@H]1CO1 62a_100000702414_100000745022 [0,0,0,1,0,1|1,0,0]=3 3709 B11R1.343 CC(C)(O)CCSC[C@@H]1CO1 62a_100000745022_100000702414 [0,0,0,1,0,1|1,0,0]=3 3710 B11R1.343 CC(C)(O)CNCCC1CC1 2230a_100000751335_100000694398 [0,0,0,1,0,1|1,0,0]=3 3711 B11R1.343 CC(C)(O)CNCCC1CC1 34a_100000764129_100000764493 [0,0,0,1,0,1|1,0,0]=3 3712 B11R1.343 CC(C)(O)CNCCC1CO1 2230a_100000751335_100000732470 [0,0,0,1,0,1|1,0,0]=3 3713 B11R1.343 CC(C)(O)COCCC1CC1 34a_100000754188_100000764493 [0,0,0,1,0,1|1,0,0]=3 3714 B11R1.343 CC(C)(O)COCCC1CC1 7a_100000754188_100000764493 [0,0,0,1,0,1|1,0,0]=3 3715 B11R1.343 CC(C)(O)COCC[C@@H]1CO1 34a_100009820653_100000764493 [0,0,0,1,0,1|1,0,0]=3 3716 B11R1.343 CC(C)(O)CSCCC1CC1 62a_100000764125_100000764493 [0,0,0,1,0,1|1,0,0]=3 3717 B11R1.343 CC(C)(O)CSCCC1CC1 62a_100000764493_100000764125 [0,0,0,1,0,1|1,0,0]=3 3718 B11R1.343 CC(C)(O)CSCCC1CO1 62a_100000732470_100000764493 [0,0,0,1,0,1|1,0,0]=3 3719 B11R1.343 CC(C)(O)CSCCC1CO1 62a_100000764493_100000732470 [0,0,0,1,0,1|1,0,0]=3 3720 B11R1.544 CC(C)(C)N1CCCC1(C)C 269982a_100000761399_100000210625 [0,0,0,1,0,1|2,0,0]=4 3721 B11R1.544 CC(C)(C)N1CCCC1(C)C 34a_100000761399_100000210625 [0,0,0,1,0,1|2,0,0]=4 3722 B11R1.570 CC(C)(C)OCC1CC1(C)C 34a_100000728257_100000210625 [0,0,0,1,0,1|2,0,0]=4 3723 B11R1.570 CC(C)(O)CNC1CC1(F)F 34a_100020610826_100000764493 [0,0,0,1,0,1|2,0,0]=4 3724 B11R1.577 CC(C)(C)CCN1CC(C1)F 2230a_100000690557_100000755188 [0,0,0,1,0,1|2,0,0]=4 3725 B11R1.577 CC(C)(C)CCN1CC(C1)F 269982a_100000690557_100000755188 [0,0,0,1,0,1|2,0,0]=4 3726 B11R1.577 CC(C)(C)CCN1CC(C1)F 34a_100000690557_100000755188 [0,0,0,1,0,1|2,0,0]=4 3727 B11R1.577 CC(C)(C)CCN1CC(C1)O 269982a_100000749847_100000755188 [0,0,0,1,0,1|2,0,0]=4 3728 B11R1.577 CC(C)(C)CNC1CC(C1)F 270004a_100016993743_100011204126 [0,0,0,1,0,1|2,0,0]=4 3729 B11R1.577 CC(C)(C)CN[C@H]1C[C@@H](C1)O 270004a_100020629032_100011204126 [0,0,0,1,0,1|2,0,0]=4 3730 B11R1.577 CC(C)(C)OCC1CC(C1)Cl 34a_100009874164_100000210625 [0,0,0,1,0,1|2,0,0]=4 3731 B11R1.577 CC(C)(O)CCN1CC(C1)F 2230a_100000690557_100000702414 [0,0,0,1,0,1|1,0,0]=3 3732 B11R1.577 CC(C)(O)CCN1CC(C1)F 34a_100000690557_100000702414 [0,0,0,1,0,1|1,0,0]=3 3733 B11R1.577 CC(C)(O)CSC1CC(=O)C1 62a_100009894365_100000764493 [0,0,0,1,0,1|1,0,1]=4 3734 B11R1.577 CC1CN(C1)CCC(C)(C)C 2230a_100000702820_100000755188 [0,0,0,1,0,1|2,0,0]=4 3735 B11R1.577 CC1CN(C1)CCC(C)(C)C 269982a_100000702820_100000755188 [0,0,0,1,0,1|2,0,0]=4 3736 B11R1.577 CC1CN(C1)CCC(C)(C)C 34a_100000702820_100000755188 [0,0,0,1,0,1|2,0,0]=4 3737 B11R1.577 CC1CN(C1)CCC(C)(C)O 2230a_100000702820_100000702414 [0,0,0,1,0,1|1,0,0]=3 3738 B11R1.577 CC1CN(C1)CCC(C)(C)O 34a_100000702820_100000702414 [0,0,0,1,0,1|1,0,0]=3 3739 B11R1.710 C=C(C)CN1CCC(C1)(C)O 2230a_100000718628_100000748629 [0,0,0,1,0,1|1,0,1]=4 3740 B11R1.710 C=C(C)CN1CCC(C1)(C)O 269982a_100000718628_100000748629 [0,0,0,1,0,1|1,0,1]=4 3741 B11R1.710 CC(=O)CC1COC(O1)(C)C 1458a_100000070787_100000198056 [0,0,0,1,0,1|1,0,1]=4 3742 B11R1.710 CC(=O)C[C@H]1COC(O1)(C)C 1458a_100000070787_100015422573 [0,0,0,1,0,1|1,0,1]=4 3743 B11R1.710 CC(C)CN1CCC(C1)(C)C 2230a_100000764714_100000210760 [0,0,0,1,0,1|2,0,0]=4 3744 B11R1.710 CC(C)CN1CCC(C1)(C)C 269982a_100000764714_100000210624 [0,0,0,1,0,1|2,0,0]=4 3745 B11R1.710 CC(C)CN1CCC(C1)(C)C 270004a_100000764714_100000210432 [0,0,0,1,0,1|2,0,0]=4 3746 B11R1.710 CC(C)CN1CCC(C1)(C)O 2230a_100000718628_100000210760 [0,0,0,1,0,1|1,0,0]=3 3747 B11R1.710 CC(C)CN1CCC(C1)(C)O 269982a_100000718628_100000210624 [0,0,0,1,0,1|1,0,0]=3 3748 B11R1.710 CC(C)CN1CCC(C1)(C)O 270004a_100000718628_100000210432 [0,0,0,1,0,1|1,0,0]=3 3749 B11R1.710 CC(O)CN1CCC(C1)(C)C 2230a_100000764714_100011218427 [0,0,0,1,0,1|2,0,0]=4 3750 B11R1.710 CC(O)CN1CCC(C1)(C)C 269982a_100000764714_100011218427 [0,0,0,1,0,1|2,0,0]=4 3751 B11R1.710 CC(O)CN1CCC(C1)(C)O 2230a_100000718628_100011218427 [0,0,0,1,0,1|1,0,0]=3 3752 B11R1.710 CC(O)CN1CCC(C1)(C)O 269982a_100000718628_100011218427 [0,0,0,1,0,1|1,0,0]=3 3753 B11R1.710 CC1(CCN(C1)CC(=O)N)O 2230a_100000718628_100000747473 [0,0,0,1,0,1|1,0,1]=4 3754 B11R1.710 CC1(CCN(C1)CC(=O)N)O 269982a_100000718628_100000187820 [0,0,0,1,0,1|1,0,1]=4 3755 B11R1.710 CC1(CCN(C1)CC(F)F)O 2230a_100000718628_100011934356 [0,0,0,1,0,1|2,0,0]=4 3756 B11R1.710 CC1(CCN(C1)CC(F)F)O 269982a_100000718628_100011934356 [0,0,0,1,0,1|2,0,0]=4 3757 B11R1.710 CN(C)CC1COC(O1)(C)C 2230a_100102631434_100009884615 [0,0,0,1,0,1|2,0,0]=4 3758 B11R1.710 CN(C)CC1COC(O1)(C)C 269982a_100102631434_100000198056 [0,0,0,1,0,1|2,0,0]=4 3759 B11R1.710 CN(C)C[C@H]1COC(O1)(C)C 2230a_100102631434_100015422573 [0,0,0,1,0,1|2,0,0]=4 3760 B11R1.710 CN(C)C[C@H]1COC(O1)(C)C 269982a_100102631434_100015422573 [0,0,0,1,0,1|2,0,0]=4 3761 B11R1.710 CN(C)C[C@H]1COC(O1)(C)C 270004a_100102631434_100009815026 [0,0,0,1,0,1|2,0,0]=4 3762 B11R1.710 C[C@@H](O)CN1CCC(C1)(C)C 2230a_100000764714_100009817552 [0,0,0,1,0,1|2,0,0]=4 3763 B11R1.710 C[C@@H](O)CN1CCC(C1)(C)C 269982a_100000764714_100009817552 [0,0,0,1,0,1|2,0,0]=4 3764 B11R1.710 C[C@@H](O)CN1CCC(C1)(C)O 2230a_100000718628_100009817552 [0,0,0,1,0,1|1,0,0]=3 3765 B11R1.710 C[C@@H](O)CN1CCC(C1)(C)O 269982a_100000718628_100009817552 [0,0,0,1,0,1|1,0,0]=3 3766 B11R1.714 C=C(C)CCN1CC(C1)(C)O 2230a_100000718560_100000730704 [0,0,0,1,0,1|1,0,1]=4 3767 B11R1.714 C=C(C)CCN1CC(C1)(C)O 269982a_100000718560_100000730704 [0,0,0,1,0,1|1,0,1]=4 3768 B11R1.714 C=C(C)CN[C@H]1C[C@@](C1)(C)O 2230a_100121572536_100000748629 [0,0,0,1,0,1|1,0,1]=4 3769 B11R1.714 CC(=O)CCN1CC(C1)(C)O 269982a_100000718560_100000053229 [0,0,0,1,0,1|1,0,1]=4 3770 B11R1.714 CC(=O)NC[C@H]1C[C@@](C1)(C)O 11a_100015257651_100015343762 [0,0,0,1,0,1|1,0,1]=4 3771 B11R1.714 CC(=O)NC[C@H]1C[C@@](C1)(C)O 240690a_100015257651_100015343762 [0,0,0,1,0,1|1,0,1]=4 3772 B11R1.714 CC(=O)NC[C@H]1C[C@@](C1)(C)O 527a_100015257651_100103153847 [0,0,0,1,0,1|1,0,1]=4 3773 B11R1.714 CC(C)CCN1CC(C1)(C)C 2230a_100000753659_100000210312 [0,0,0,1,0,1|2,0,0]=4 3774 B11R1.714 CC(C)CCN1CC(C1)(C)C 269982a_100000753659_100000210312 [0,0,0,1,0,1|2,0,0]=4 3775 B11R1.714 CC(C)CCN1CC(C1)(C)F 2230a_100000696199_100000210312 [0,0,0,1,0,1|2,0,0]=4 3776 B11R1.714 CC(C)CCN1CC(C1)(C)F 269982a_100000696199_100000210312 [0,0,0,1,0,1|2,0,0]=4 3777 B11R1.714 CC(C)CCN1CC(C1)(C)O 2230a_100000718560_100000210312 [0,0,0,1,0,1|1,0,0]=3 3778 B11R1.714 CC(C)CCN1CC(C1)(C)O 269982a_100000718560_100000210312 [0,0,0,1,0,1|1,0,0]=3 3779 B11R1.714 CC(C)CN[C@H]1C[C@@](C1)(C)O 2230a_100121572536_100000210760 [0,0,0,1,0,1|1,0,0]=3 3780 B11R1.714 CC(C)CN[C@H]1C[C@@](C1)(C)O 270004a_100121572536_100000210432 [0,0,0,1,0,1|1,0,0]=3 3781 B11R1.714 CC(C)NC[C@H]1C[C@@](C1)(C)O 2230a_100015257651_100000210206 [0,0,0,1,0,1|1,0,0]=3 3782 B11R1.714 CC(C)OCN1CC(C1)(C)O 2230a_100000718560_100000709892 [0,0,0,1,0,1|2,0,0]=4 3783 B11R1.714 CC(C)OCN1CC(C1)(C)O 269982a_100000718560_100000709892 [0,0,0,1,0,1|2,0,0]=4 3784 B11R1.714 CC(O)CCN1CC(C1)(C)C 2230a_100000753659_100012276601 [0,0,0,1,0,1|2,0,0]=4 3785 B11R1.714 CC(O)CCN1CC(C1)(C)C 269982a_100000753659_100012276601 [0,0,0,1,0,1|2,0,0]=4 3786 B11R1.714 CC(O)CCN1CC(C1)(C)F 2230a_100000696199_100012276601 [0,0,0,1,0,1|2,0,0]=4 3787 B11R1.714 CC(O)CCN1CC(C1)(C)F 269982a_100000696199_100012276601 [0,0,0,1,0,1|2,0,0]=4 3788 B11R1.714 CC(O)CCN1CC(C1)(C)O 2230a_100000718560_100012276601 [0,0,0,1,0,1|1,0,0]=3 3789 B11R1.714 CC(O)CCN1CC(C1)(C)O 269982a_100000718560_100012276601 [0,0,0,1,0,1|1,0,0]=3 3790 B11R1.714 CC(O)CN[C@H]1C[C@@](C1)(C)O 2230a_100121572536_100011218427 [0,0,0,1,0,1|1,0,0]=3 3791 B11R1.714 CC1(CN(C1)CCC(=O)N)O 2230a_100000718560_100000744528 [0,0,0,1,0,1|1,0,1]=4 3792 B11R1.714 CC1(CN(C1)CCC(=O)N)O 269982a_100000718560_100000744528 [0,0,0,1,0,1|1,0,1]=4 3793 B11R1.714 CN(C)CCN1CC(C1)(C)O 269982a_100000718560_100000755713 [0,0,0,1,0,1|2,0,0]=4 3794 B11R1.714 C[C@@H](N)COC1CC(C1)(F)F 34a_100000737577_100010741680 [0,0,0,1,0,1|2,0,0]=4 3795 B11R1.714 C[C@@H](O)CN[C@H]1C[C@@](C1)(C)O 2230a_100121572536_100009817552 [0,0,0,1,0,1|1,0,0]=3 3796 B11R1.714 C[C@@]1(C[C@H](C1)NCC(=O)N)O 2230a_100121572536_100000747473 [0,0,0,1,0,1|1,0,1]=4 3797 B11R1.714 C[C@@]1(C[C@H](C1)NCC(F)F)O 2230a_100121572536_100011934356 [0,0,0,1,0,1|2,0,0]=4 3798 B11R1.717 C=C(C)CCNCC1(CC1)O 2230a_100011936951_100000730704 [0,0,0,1,0,1|1,0,1]=4 3799 B11R1.717 C=C(C)CCOCC1(CO1)C 34a_100000764851_100000760498 [0,0,0,1,0,1|1,0,1]=4 3800 B11R1.717 C=C(C)CCSCC1(CO1)C 62a_100000730704_100000760498 [0,0,0,1,0,1|1,0,1]=4 3801 B11R1.717 C=C(C)CCSCC1(CO1)C 62a_100000760498_100000730704 [0,0,0,1,0,1|1,0,1]=4 3802 B11R1.717 CC(=O)CCOCC1(CO1)C 34a_100000759926_100000760498 [0,0,0,1,0,1|1,0,1]=4 3803 B11R1.717 CC(=O)CCSCC1(CO1)C 62a_100000053229_100000760498 [0,0,0,1,0,1|1,0,1]=4 3804 B11R1.717 CC(=O)CCSCC1(CO1)C 62a_100000760498_100000053229 [0,0,0,1,0,1|1,0,1]=4 3805 B11R1.717 CC(Br)CCOCC1(CO1)C 34a_100009893172_100000760498 [0,0,0,1,0,1|1,0,0]=3 3806 B11R1.717 CC(C)CCCNC1(CC1)C 2230a_100000757604_100011214892 [0,0,0,1,0,1|2,0,0]=4 3807 B11R1.717 CC(C)CCCOC1(CC1)C 7a_100011725673_100011214892 [0,0,0,1,0,1|2,0,0]=4 3808 B11R1.717 CC(C)CCNCC1(CC1)C 2230a_100000766693_100000210312 [0,0,0,1,0,1|2,0,0]=4 3809 B11R1.717 CC(C)CCNCC1(CC1)C 269862a_100000766693_100000185833 [0,0,0,1,0,1|2,0,0]=4 3810 B11R1.717 CC(C)CCNCC1(CC1)O 2230a_100011936951_100000210312 [0,0,0,1,0,1|1,0,0]=3 3811 B11R1.717 CC(C)CCNCC1(CC1)O 269862a_100011936951_100000185833 [0,0,0,1,0,1|1,0,0]=3 3812 B11R1.717 CC(C)CCOCC1(CC1)C 7a_100000698024_100000210626 [0,0,0,1,0,1|2,0,0]=4 3813 B11R1.717 CC(C)CCOCC1(CC1)F 34a_200000703853_100000210312 [0,0,0,1,0,1|2,0,0]=4 3814 B11R1.717 CC(C)CCOCC1(CC1)F 7a_200000703853_100000210626 [0,0,0,1,0,1|2,0,0]=4 3815 B11R1.717 CC(C)CCOCC1(CO1)C 34a_100000210254_100000760498 [0,0,0,1,0,1|1,0,0]=3 3816 B11R1.717 CC(C)CCSCC1(CO1)C 62a_100000210312_100000760498 [0,0,0,1,0,1|1,0,0]=3 3817 B11R1.717 CC(C)CCSCC1(CO1)C 62a_100000760498_100000210312 [0,0,0,1,0,1|1,0,0]=3 3818 B11R1.717 CC(C)OCNCC1(CC1)O 2230a_100011936951_100000709892 [0,0,0,1,0,1|2,0,0]=4 3819 B11R1.717 CC(C)OCSCC1(CO1)C 62a_100000709892_100000760498 [0,0,0,1,0,1|2,0,0]=4 3820 B11R1.717 CC(C)OCSCC1(CO1)C 62a_100000760498_100000709892 [0,0,0,1,0,1|2,0,0]=4 3821 B11R1.717 CC(O)CCCNC1(CC1)C 2230a_100000757604_200000718107 [0,0,0,1,0,1|2,0,0]=4 3822 B11R1.717 CC(O)CCCOC1(CC1)C 7a_100011725673_200000718107 [0,0,0,1,0,1|2,0,0]=4 3823 B11R1.717 CC(O)CCNCC1(CC1)C 2230a_100000766693_100012276601 [0,0,0,1,0,1|2,0,0]=4 3824 B11R1.717 CC(O)CCNCC1(CC1)O 2230a_100011936951_100012276601 [0,0,0,1,0,1|1,0,0]=3 3825 B11R1.717 CC(O)CCOCC1(CC1)C 7a_100000698024_100012276601 [0,0,0,1,0,1|2,0,0]=4 3826 B11R1.717 CC(O)CCOCC1(CC1)F 34a_200000703853_100012276601 [0,0,0,1,0,1|2,0,0]=4 3827 B11R1.717 CC(O)CCOCC1(CC1)F 7a_200000703853_100012276601 [0,0,0,1,0,1|2,0,0]=4 3828 B11R1.717 CC(O)CCSCC1(CO1)C 62a_100000760498_100012276601 [0,0,0,1,0,1|1,0,0]=3 3829 B11R1.717 CC(O)CCSCC1(CO1)C 62a_100012276601_100000760498 [0,0,0,1,0,1|1,0,0]=3 3830 B11R1.717 CC1(CO1)COCCC(=O)N 34a_100000757172_100000760498 [0,0,0,1,0,1|1,0,1]=4 3831 B11R1.717 CC1(CO1)COCCC(F)F 34a_100103093639_100000760498 [0,0,0,1,0,1|2,0,0]=4 3832 B11R1.717 CC1(CO1)CSCCC(=O)N 62a_100000744528_100000760498 [0,0,0,1,0,1|1,0,1]=4 3833 B11R1.717 CC1(CO1)CSCCC(=O)N 62a_100000760498_100000744528 [0,0,0,1,0,1|1,0,1]=4 3834 B11R1.717 CN(C)CCSCC1(CO1)C 62a_100000760498_100000755713 [0,0,0,1,0,1|2,0,0]=4 3835 B11R1.717 C[C@@H](N)CCOCC1(CO1)C 34a_100000706166_100000760498 [0,0,0,1,0,1|0,0,0]=2 3836 B11R1.717 NC(=O)CCNCC1(CC1)O 2230a_100011936951_100000744528 [0,0,0,1,0,1|1,0,1]=4 3837 B11R1.730 CC(=O)N1CCCC(C1)(C)O 11a_100000695535_100015343762 [0,0,0,1,0,1|1,0,1]=4 3838 B11R1.730 CC(=O)N1CCCC(C1)(C)O 240690a_100000695535_100015343762 [0,0,0,1,0,1|1,0,1]=4 3839 B11R1.730 CC(=O)N1CCCC(C1)(C)O 527a_100000695535_100103153847 [0,0,0,1,0,1|1,0,1]=4 3840 B11R1.730 CC(C)N1CCCC(C1)(C)C 2230a_100000716857_100000210206 [0,0,0,1,0,1|2,0,0]=4 3841 B11R1.730 CC(C)N1CCCC(C1)(C)C 269982a_100000716857_100000210206 [0,0,0,1,0,1|2,0,0]=4 3842 B11R1.730 CC(C)N1CCCC(C1)(C)C 34a_100000716857_100000210206 [0,0,0,1,0,1|2,0,0]=4 3843 B11R1.730 CC(C)N1CCCC(C1)(C)O 2230a_100000695535_100000210206 [0,0,0,1,0,1|1,0,0]=3 3844 B11R1.730 CC(C)N1CCCC(C1)(C)O 269982a_100000695535_100000210206 [0,0,0,1,0,1|1,0,0]=3 3845 B11R1.923 C=C(C)COCC1OC1(C)C 34a_200010283642_100000748629 [0,0,0,1,0,1|1,0,1]=4 3846 B11R1.923 C=C(C)COCC1OC1(C)C 7a_200010283642_100000748629 [0,0,0,1,0,1|1,0,1]=4 3847 B11R1.923 CC(C)COCC1CC1(C)C 34a_100000728257_100000210624 [0,0,0,1,0,1|2,0,0]=4 3848 B11R1.923 CC(C)COCC1CC1(C)C 7a_100000728257_100000210760 [0,0,0,1,0,1|2,0,0]=4 3849 B11R1.923 CC(C)COCC1OC1(C)C 34a_200010283642_100000210624 [0,0,0,1,0,1|1,0,0]=3 3850 B11R1.923 CC(C)COCC1OC1(C)C 7a_200010283642_100000210760 [0,0,0,1,0,1|1,0,0]=3 3851 B11R1.923 CC(O)COCC1CC1(C)C 34a_100000728257_100011218427 [0,0,0,1,0,1|2,0,0]=4 3852 B11R1.923 CC(O)COCC1CC1(C)C 7a_100000728257_100011218427 [0,0,0,1,0,1|2,0,0]=4 3853 B11R1.923 CC(O)COCC1OC1(C)C 34a_200010283642_100011218427 [0,0,0,1,0,1|1,0,0]=3 3854 B11R1.923 CC(O)COCC1OC1(C)C 7a_200010283642_100011218427 [0,0,0,1,0,1|1,0,0]=3 3855 B11R1.923 CC1(OC1COCC(=O)N)C 34a_200010283642_100000187820 [0,0,0,1,0,1|1,0,1]=4 3856 B11R1.923 CC1(OC1COCC(=O)N)C 7a_200010283642_100000187820 [0,0,0,1,0,1|1,0,1]=4 3857 B11R1.923 CC1(OC1COCC(F)F)C 34a_200010283642_100011934356 [0,0,0,1,0,1|2,0,0]=4 3858 B11R1.923 CC1(OC1COCC(F)F)C 7a_200010283642_100011934356 [0,0,0,1,0,1|2,0,0]=4 3859 B11R1.923 C[C@@H](N)COCC1CC1(F)F 34a_100000737577_100009817841 [0,0,0,1,0,1|2,0,0]=4 3860 B11R1.923 C[C@@H](O)COCC1CC1(C)C 34a_100000728257_100009817552 [0,0,0,1,0,1|2,0,0]=4 3861 B11R1.923 C[C@@H](O)COCC1CC1(C)C 7a_100000728257_100009817552 [0,0,0,1,0,1|2,0,0]=4 3862 B11R1.923 C[C@@H](O)COCC1OC1(C)C 34a_200010283642_100009817552 [0,0,0,1,0,1|1,0,0]=3 3863 B11R1.923 C[C@@H](O)COCC1OC1(C)C 7a_200010283642_100009817552 [0,0,0,1,0,1|1,0,0]=3 3864 B11R1.19 CC(C)(O)C1CCN(CC1)[13CH3] 2230a_100025784243_200025704644 [0,1,0,1,0,0|2,0,0]=4 3865 B11R1.19 CC(C)(O)C1CCN(CC1)[13CH3] 269982a_100025784243_200025704644 [0,1,0,1,0,0|2,0,0]=4 3866 B11R1.19 CC(C)(O)C1CCN(CC1)[13CH3] 34a_100025784243_200025704644 [0,1,0,1,0,0|2,0,0]=4 3867 B11R1.19 CN1CCC(CC1)C(C)(C)O 2230a_100025784243_200000210301 [0,1,0,1,0,0|2,0,0]=4 3868 B11R1.19 CN1CCC(CC1)C(C)(C)O 269982a_100025784243_200000210301 [0,1,0,1,0,0|2,0,0]=4 3869 B11R1.19 CN1CCC(CC1)C(C)(C)O 34a_100025784243_200000210301 [0,1,0,1,0,0|2,0,0]=4 3870 B11R1.347 CC(C)CCC(=O)C1(CC1)O 1458a_100000241761_100000210312 [0,1,0,1,0,0|1,0,1]=4 3871 B11R1.347 CC(O)CCC(=O)C1(CC1)O 1458a_100000241761_100012276601 [0,1,0,1,0,0|1,0,1]=4 3872 B11R1.571 CC1(CCN(C1)C(C)(C)C)O 269982a_100000718628_100000210625 [0,1,0,1,0,0|2,0,0]=4 3873 B11R1.707 CC(C)N1CC(C1)C(C)(C)O 269982a_100000708124_100000210206 [0,1,0,1,0,0|2,0,0]=4 3874 B11R1.707 CC(C)N1CC(C1)C(C)(C)O 34a_100000708124_100000210206 [0,1,0,1,0,0|2,0,0]=4 3875 B11R1.749 CC(C)(O)C(=O)CCC1CC1 1458a_100000242741_100000694398 [0,1,0,1,0,0|1,0,1]=4 3876 B11R1.749 CC(C)(O)C(=O)CCC1CO1 1458a_100000242741_100000732470 [0,1,0,1,0,0|1,0,1]=4 3877 B11R1.749 C[C@H](NCC1CC1)C(C)(C)O 2230a_100025708725_100000742324 [0,1,0,1,0,0|2,0,0]=4 3878 B11R1.749 C[C@H](NCC1CC1)C(C)(C)O 269862a_100025708725_100000741477 [0,1,0,1,0,0|2,0,0]=4 3879 B11R1.749 C[C@H](NCC1CO1)C(C)(C)O 2230a_100025708725_100011216344 [0,1,0,1,0,0|2,0,0]=4 3880 B11R1.728 CC(C)CC(=O)CC1(CO1)C 1458a_100000210554_100000760498 [0,1,0,1,0,0|1,0,1]=4 3881 B11R1.728 CC(C)CN(C)CC1(CO1)C 269982a_100000747067_100000760498 [0,1,0,1,0,0|2,0,0]=4 3882 B11R1.728 CC(O)CN(C)CC1(CO1)C 269982a_100000227577_100000760498 [0,1,0,1,0,0|2,0,0]=4 3883 B11R1.728 C[C@@H](O)CC(=O)CC1(CO1)C 1458a_100011933948_100000760498 [0,1,0,1,0,0|1,0,1]=4 3884 B11R1.1127 CC(C)(O)CC(=O)CC1CC1 1458a_100000693243_100000742324 [0,1,0,1,0,0|1,0,1]=4 3885 B11R1.1127 CC(C)(O)CC(=O)CC1CO1 1458a_100000693243_100011216344 [0,1,0,1,0,0|1,0,1]=4 3886 B11R1.1127 CC(C)(O)CC(=O)CC1CS1 1458a_100000693243_100000031435 [0,1,0,1,0,0|1,0,1]=4 3887 B11R1.1127 CC(C)(O)CC(=O)C[C@@H]1CO1 1458a_100000693243_100000745022 [0,1,0,1,0,0|1,0,1]=4 3888 B11R1.1127 CN(CC1CC1)CC(C)(C)O 2230a_100000755907_100000742324 [0,1,0,1,0,0|2,0,0]=4 3889 B11R1.1127 CN(CC1CC1)CC(C)(C)O 269982a_100000755907_100000756562 [0,1,0,1,0,0|2,0,0]=4 3890 B11R1.1127 CN(CC1CO1)CC(C)(C)O 2230a_100000755907_100011216344 [0,1,0,1,0,0|2,0,0]=4 3891 B11R1.1127 CN(CC1CO1)CC(C)(C)O 269982a_100000755907_102125554688 [0,1,0,1,0,0|2,0,0]=4 3892 B11R1.1127 CN(CC1CS1)CC(C)(C)O 269982a_100000755907_100000031435 [0,1,0,1,0,0|2,0,0]=4 3893 B11R1.1127 CN(C[C@@H]1CO1)CC(C)(C)O 269982a_100000755907_100000745022 [0,1,0,1,0,0|2,0,0]=4 3894 B11R1.1314 CC(C)(C)CN1CC(C1)(C)O 270004a_100000718560_100011204126 [0,1,0,1,0,0|2,0,0]=4 3895 B11R1.45 CC(C)(O)[C@@H]1CCN(C1)CF 269982a_100132313854_100015361967 [0,1,0,1,0,0|2,0,0]=4 3896 B11R1.45 CC(C)(O)[C@@H]1CCN(C1)CF 34a_100132313854_100015361967 [0,1,0,1,0,0|2,0,0]=4 3897 B11R1.45 CCN1CC[C@H](C1)C(C)(C)O 2230a_100132313854_100000210202 [0,1,0,1,0,0|2,0,0]=4 3898 B11R1.45 CCN1CC[C@H](C1)C(C)(C)O 269982a_100132313854_100000204670 [0,1,0,1,0,0|2,0,0]=4 3899 B11R1.45 CCN1CC[C@H](C1)C(C)(C)O 34a_100132313854_100000210202 [0,1,0,1,0,0|2,0,0]=4 3900 B11R1.160 CC1CCN1CCC(C)(C)O 34a_100000755817_100000702414 [0,1,0,1,0,0|2,0,0]=4 3901 B11R1.263 CC(C)(O)CN1CC(C1)CF 34a_100010363649_100000764493 [0,1,0,1,0,0|2,0,0]=4 3902 B11R1.263 CC(C)(O)CN1CC(C1)CO 34a_100016987283_100000764493 [0,1,0,1,0,0|2,0,0]=4 3903 B11R1.344 CC(C)(C)COCC1CNC1 34a_100016987283_100011219605 [0,1,0,1,0,0|2,0,0]=4 3904 B11R1.344 CC(C)(F)COCC1CNC1 34a_100016987283_100011997219 [0,1,0,1,0,0|2,0,0]=4 3905 B11R1.344 CC(C)(O)CCCN1CCC1 269982a_100000754969_100009888830 [0,1,0,1,0,0|2,0,0]=4 3906 B11R1.344 CC(C)(O)CCNC1CCC1 2230a_100000749019_100000702414 [0,1,0,1,0,0|2,0,0]=4 3907 B11R1.344 CC(C)(O)CCNC1CCC1 270004a_100000707701_100000241760 [0,1,0,1,0,0|2,0,0]=4 3908 B11R1.344 CC(C)(O)CCNC1CCC1 34a_100000749019_100000702414 [0,1,0,1,0,0|2,0,0]=4 3909 B11R1.344 CC(C)(O)CCNC1COC1 2230a_100016991112_100000702414 [0,1,0,1,0,0|2,0,0]=4 3910 B11R1.344 CC(C)(O)CCOC1CCC1 34a_100000748187_100000702414 [0,1,0,1,0,0|2,0,0]=4 3911 B11R1.344 CC(C)(O)CCOC1CSC1 7a_100000072292_100000702414 [0,1,0,1,0,0|2,0,0]=4 3912 B11R1.344 CC(C)(O)CCSC1CCC1 62a_100000702414_100000749161 [0,1,0,1,0,0|2,0,0]=4 3913 B11R1.344 CC(C)(O)CCSC1COC1 62a_100000702414_100009818527 [0,1,0,1,0,0|2,0,0]=4 3914 B11R1.344 CC(C)(O)CNCC1CCC1 2230a_100000751335_100000763275 [0,1,0,1,0,0|2,0,0]=4 3915 B11R1.344 CC(C)(O)CNCC1CCC1 269862a_100000751335_100000753134 [0,1,0,1,0,0|2,0,0]=4 3916 B11R1.344 CC(C)(O)CNCC1CCC1 34a_100000738700_100000764493 [0,1,0,1,0,0|2,0,0]=4 3917 B11R1.344 CC(C)(O)CNCC1CCO1 2230a_100000751335_100000103362 [0,1,0,1,0,0|2,0,0]=4 3918 B11R1.344 CC(C)(O)CNCC1COC1 2230a_100000751335_100010264016 [0,1,0,1,0,0|2,0,0]=4 3919 B11R1.344 CC(C)(O)CNCC1COC1 34a_100015281925_100000764493 [0,1,0,1,0,0|2,0,0]=4 3920 B11R1.344 CC(C)(O)CNC[C@@H]1CCO1 34a_100020831831_100000764493 [0,1,0,1,0,0|2,0,0]=4 3921 B11R1.344 CC(C)(O)COCC1CCC1 34a_100000760304_100000764493 [0,1,0,1,0,0|2,0,0]=4 3922 B11R1.344 CC(C)(O)COCC1CCO1 34a_100000039022_100000764493 [0,1,0,1,0,0|2,0,0]=4 3923 B11R1.344 CC(C)(O)COCC1CNC1 34a_100016987283_100000764493 [0,1,0,1,0,0|1,0,0]=3 3924 B11R1.344 CC(C)(O)COCC1COC1 34a_100000060846_100000764493 [0,1,0,1,0,0|2,0,0]=4 3925 B11R1.344 CC(C)(O)CSCC1CCC1 62a_100000763275_100000764493 [0,1,0,1,0,0|2,0,0]=4 3926 B11R1.344 CC(C)(O)CSCC1CCC1 62a_100000764493_100000763275 [0,1,0,1,0,0|2,0,0]=4 3927 B11R1.344 CC(C)(O)CSCC1CCO1 62a_100000103362_100000764493 [0,1,0,1,0,0|2,0,0]=4 3928 B11R1.344 CC(C)(O)CSCC1CCO1 62a_100000764493_100000103362 [0,1,0,1,0,0|2,0,0]=4 3929 B11R1.344 CC(C)(O)CSCC1COC1 62a_100000764493_100010264016 [0,1,0,1,0,0|2,0,0]=4 3930 B11R1.344 CC(C)(O)CSCC1COC1 62a_100010264016_100000764493 [0,1,0,1,0,0|2,0,0]=4 3931 B11R1.522 CC(C)(C)CNCC1(CC1)O 270004a_100011936951_100011204126 [0,1,0,1,0,0|2,0,0]=4 3932 B11R1.522 CC(C)(C)CSCC1(CO1)C 62a_100000760498_100011219605 [0,1,0,1,0,0|2,0,0]=4 3933 B11R1.522 CC(C)(C)CSCC1(CO1)C 62a_100011219605_100000760498 [0,1,0,1,0,0|2,0,0]=4 3934 B11R1.522 CC(C)(F)COCC1(CO1)C 34a_100000716592_100000760498 [0,1,0,1,0,0|2,0,0]=4 3935 B11R1.522 CC(C)(F)CSCC1(CO1)C 62a_100000760498_100011997219 [0,1,0,1,0,0|2,0,0]=4 3936 B11R1.522 CC(C)(F)CSCC1(CO1)C 62a_100011997219_100000760498 [0,1,0,1,0,0|2,0,0]=4 3937 B11R1.522 CC(C)(O)CCNC1(CC1)C 2230a_100000757604_100000702414 [0,1,0,1,0,0|2,0,0]=4 3938 B11R1.522 CC(C)(O)CCOC1(CC1)C 7a_100011725673_100000702414 [0,1,0,1,0,0|2,0,0]=4 3939 B11R1.522 CC(C)(O)COCC1(CC1)C 7a_100000698024_100000764493 [0,1,0,1,0,0|2,0,0]=4 3940 B11R1.522 CC(C)(O)COCC1(CC1)F 34a_200000703853_100000764493 [0,1,0,1,0,0|2,0,0]=4 3941 B11R1.522 CC(C)(O)COCC1(CC1)F 7a_200000703853_100000764493 [0,1,0,1,0,0|2,0,0]=4 3942 B11R1.522 CC(C)(O)CSCC1(CO1)C 62a_100000760498_100000764493 [0,1,0,1,0,0|2,0,0]=4 3943 B11R1.522 CC(C)(O)CSCC1(CO1)C 62a_100000764493_100000760498 [0,1,0,1,0,0|2,0,0]=4 3944 B11R1.522 CC(F)(F)COCC1(CO1)C 34a_100000068830_100000760498 [0,1,0,1,0,0|2,0,0]=4 3945 B11R1.858 C#CC(C)OCC1OC1(C)C 34a_200010283642_200000035995 [0,1,0,1,0,0|2,0,0]=4 3946 B11R1.858 CC(C#N)OCC1OC1(C)C 7a_200010283642_100000703298 [0,1,0,1,0,0|1,0,1]=4 3947 B11R1.858 CC(CO)OCC1OC1(C)C 34a_200010283642_100012180447 [0,1,0,1,0,0|2,0,0]=4 3948 B11R1.858 CC(CO)OCC1OC1(C)C 7a_200010283642_100012180447 [0,1,0,1,0,0|2,0,0]=4 3949 B11R1.858 CCC(C)OCC1OC1(C)C 34a_200010283642_100011215416 [0,1,0,1,0,0|2,0,0]=4 3950 B11R1.858 CCC(C)OCC1OC1(C)C 7a_200010283642_100000758301 [0,1,0,1,0,0|2,0,0]=4 3951 B11R1.866 C=CC(C)N1CCC(C1)(C)O 269982a_100000718628_100011215867 [0,1,0,1,0,0|2,0,0]=4 3952 B11R1.866 CC(C#N)N1CCC(C1)(C)O 2230a_100000718628_100000184139 [0,1,0,1,0,0|1,0,1]=4 3953 B11R1.866 CC(C#N)N1CCC(C1)(C)O 269982a_100000718628_100000703298 [0,1,0,1,0,0|1,0,1]=4 3954 B11R1.866 CC(CO)N1CCC(C1)(C)O 2230a_100000718628_100012180447 [0,1,0,1,0,0|2,0,0]=4 3955 B11R1.866 CCC(C)N1CCC(C1)(C)O 2230a_100000718628_100000758301 [0,1,0,1,0,0|2,0,0]=4 3956 B11R1.866 CCC(C)N1CCC(C1)(C)O 269982a_100000718628_100000758301 [0,1,0,1,0,0|2,0,0]=4 3957 B11R1.866 COC(C)N1CCC(C1)(C)O 269982a_100000718628_100009879195 [0,1,0,1,0,0|2,0,0]=4 3958 B11R1.866 C[C@H](CO)N1CCC(C1)(C)O 269982a_100000718628_100016084084 [0,1,0,1,0,0|2,0,0]=4 3959 B11R1.897 CC(C#N)N[C@H]1C[C@@](C1)(C)O 2230a_100121572536_100000184139 [0,1,0,1,0,0|1,0,1]=4 3960 B11R1.897 CC(CO)N[C@H]1C[C@@](C1)(C)O 2230a_100121572536_100012180447 [0,1,0,1,0,0|2,0,0]=4 3961 B11R1.897 CC1(CN(C1)CC(O)CO)O 2230a_100000718560_100011219619 [0,1,0,1,0,0|2,0,0]=4 3962 B11R1.897 CC1(CN(C1)C[C@@H](O)CF)O 2230a_100000718560_100015614560 [0,1,0,1,0,0|2,0,0]=4 3963 B11R1.897 CC1(CN(C1)C[C@@H](O)CO)O 2230a_100000718560_100009815848 [0,1,0,1,0,0|2,0,0]=4 3964 B11R1.897 CCC(C)CN1CC(C1)(C)O 2230a_100000718560_100000748023 [0,1,0,1,0,0|2,0,0]=4 3965 B11R1.897 CCC(C)CN1CC(C1)(C)O 269982a_100000718560_100000748023 [0,1,0,1,0,0|2,0,0]=4 3966 B11R1.897 CCC(C)CN1CC(C1)(C)O 270004a_100000718560_100000243153 [0,1,0,1,0,0|2,0,0]=4 3967 B11R1.897 CCC(C)N[C@H]1C[C@@](C1)(C)O 2230a_100121572536_100000758301 [0,1,0,1,0,0|2,0,0]=4 3968 B11R1.897 CCC(O)CN1CC(C1)(C)O 2230a_100000718560_100011218378 [0,1,0,1,0,0|2,0,0]=4 3969 B11R1.897 CCC(O)CN1CC(C1)(C)O 269982a_100000718560_100011218378 [0,1,0,1,0,0|2,0,0]=4 3970 B11R1.897 CC[C@H](C)CN1CC(C1)(C)O 2230a_100000718560_100009816398 [0,1,0,1,0,0|2,0,0]=4 3971 B11R1.897 CC[C@H](C)CN1CC(C1)(C)O 269982a_100000718560_100009816398 [0,1,0,1,0,0|2,0,0]=4 3972 B11R1.897 C[C@@H](CO)CN1CC(C1)(C)O 2230a_100000718560_100000059175 [0,1,0,1,0,0|2,0,0]=4 3973 B11R1.897 C[C@@H](CO)CN1CC(C1)(C)O 269982a_100000718560_100000059175 [0,1,0,1,0,0|2,0,0]=4 3974 B11R1.950 CC1(CCCN(CC1)CF)O 269982a_100000723723_100015361967 [0,1,0,1,0,0|2,0,0]=4 3975 B11R1.950 CC1(CCCN(CC1)CF)O 34a_100000723723_100015361967 [0,1,0,1,0,0|2,0,0]=4 3976 B11R1.950 CCN1CCCC(CC1)(C)O 2230a_100000723723_100000210202 [0,1,0,1,0,0|2,0,0]=4 3977 B11R1.950 CCN1CCCC(CC1)(C)O 269982a_100000723723_100000204670 [0,1,0,1,0,0|2,0,0]=4 3978 B11R1.950 CCN1CCCC(CC1)(C)O 34a_100000723723_100000210202 [0,1,0,1,0,0|2,0,0]=4 3979 B11R1.1029 C=CC(C)COCC1(CO1)C 34a_100011215527_100000760498 [0,1,0,1,0,0|2,0,0]=4 3980 B11R1.1029 C=C[C@H](N)COCC1(CO1)C 34a_100016989147_100000760498 [0,1,0,1,0,0|1,0,1]=4 3981 B11R1.1029 CC(CN)COCC1(CO1)C 34a_100000744482_100000760498 [0,1,0,1,0,0|1,0,0]=3 3982 B11R1.1029 CC(CO)CNCC1(CO1)C 34a_100000744482_100000760498 [0,1,0,1,0,0|2,0,0]=4 3983 B11R1.1029 CC1(CO1)CNC[C@@H](F)CO 34a_100015665980_100000760498 [0,1,0,1,0,0|2,0,0]=4 3984 B11R1.1029 CC1(CO1)COCC(Cl)CCl 34a_100000033668_100000760498 [0,1,0,1,0,0|2,0,0]=4 3985 B11R1.1029 CC1(CO1)COC[C@H](F)CN 34a_100015665980_100000760498 [0,1,0,1,0,0|2,0,0]=4 3986 B11R1.1029 CC1(CO1)CSCC(O)CO 62a_100000760498_100011219619 [0,1,0,1,0,0|2,0,0]=4 3987 B11R1.1029 CC1(CO1)CSCC(O)CO 62a_100011219619_100000760498 [0,1,0,1,0,0|2,0,0]=4 3988 B11R1.1029 CC1(CO1)CSC[C@@H](O)CF 62a_100000760498_100015614560 [0,1,0,1,0,0|2,0,0]=4 3989 B11R1.1029 CC1(CO1)CSC[C@@H](O)CF 62a_100015614560_100000760498 [0,1,0,1,0,0|2,0,0]=4 3990 B11R1.1029 CC1(CO1)CSC[C@@H](O)CO 62a_100000760498_100009815848 [0,1,0,1,0,0|2,0,0]=4 3991 B11R1.1029 CC1(CO1)CSC[C@@H](O)CO 62a_100009815848_100000760498 [0,1,0,1,0,0|2,0,0]=4 3992 B11R1.1029 CCC(C)CNCC1(CC1)O 2230a_100011936951_100000748023 [0,1,0,1,0,0|2,0,0]=4 3993 B11R1.1029 CCC(C)CNCC1(CC1)O 270004a_100011936951_100000243153 [0,1,0,1,0,0|2,0,0]=4 3994 B11R1.1029 CCC(C)CSCC1(CO1)C 62a_100000748023_100000760498 [0,1,0,1,0,0|2,0,0]=4 3995 B11R1.1029 CCC(C)CSCC1(CO1)C 62a_100000760498_100000748023 [0,1,0,1,0,0|2,0,0]=4 3996 B11R1.1029 CCC(O)CNCC1(CC1)O 2230a_100011936951_100011218378 [0,1,0,1,0,0|2,0,0]=4 3997 B11R1.1029 CCC(O)CSCC1(CO1)C 62a_100000760498_100011218378 [0,1,0,1,0,0|2,0,0]=4 3998 B11R1.1029 CCC(O)CSCC1(CO1)C 62a_100011218378_100000760498 [0,1,0,1,0,0|2,0,0]=4 3999 B11R1.1029 CC[C@H](C)CNCC1(CC1)O 2230a_100011936951_100009816398 [0,1,0,1,0,0|2,0,0]=4 4000 B11R1.1029 CC[C@H](C)CSCC1(CO1)C 62a_100000760498_100009816398 [0,1,0,1,0,0|2,0,0]=4 4001 B11R1.1029 CC[C@H](C)CSCC1(CO1)C 62a_100009816398_100000760498 [0,1,0,1,0,0|2,0,0]=4 4002 B11R1.1029 COC(C)COCC1(CO1)C 34a_100000690652_100000760498 [0,1,0,1,0,0|2,0,0]=4 4003 B11R1.1029 C[C@@H](CO)CNCC1(CC1)O 2230a_100011936951_100000059175 [0,1,0,1,0,0|2,0,0]=4 4004 B11R1.1029 C[C@@H](CO)CSCC1(CO1)C 62a_100000059175_100000760498 [0,1,0,1,0,0|2,0,0]=4 4005 B11R1.1029 C[C@@H](CO)CSCC1(CO1)C 62a_100000760498_100000059175 [0,1,0,1,0,0|2,0,0]=4 4006 B11R1.1029 OCC(O)CNCC1(CC1)O 2230a_100011936951_100011219619 [0,1,0,1,0,0|2,0,0]=4 4007 B11R1.1029 OC[C@H](O)CNCC1(CC1)O 2230a_100011936951_100009815848 [0,1,0,1,0,0|2,0,0]=4 4008 B11R1.1029 O[C@@H](CF)CNCC1(CC1)O 2230a_100011936951_100015614560 [0,1,0,1,0,0|2,0,0]=4 4009 B11R1.138 CC(C)(CO)CN1CC(C1)F 34a_100000690557_100009813988 [0,1,0,1,0,0|2,0,0]=4 4010 B11R1.138 CC1CN(C1)CC(C)(C)CO 34a_100000702820_100009813988 [0,1,0,1,0,0|2,0,0]=4 4011 B11R1.138 COC(C)(C)CN1CC(C1)C 269982a_100000702820_100000701081 [0,1,0,1,0,0|2,0,0]=4 4012 B11R1.138 COC(C)(C)CN1CC(C1)C 34a_100000702820_100000701081 [0,1,0,1,0,0|2,0,0]=4 4013 B11R1.138 COC(C)(C)CN1CC(C1)F 269982a_100000690557_100000701081 [0,1,0,1,0,0|2,0,0]=4 4014 B11R1.138 COC(C)(C)CN1CC(C1)F 34a_100000690557_100000701081 [0,1,0,1,0,0|2,0,0]=4 4015 B11R1.138 COC(C)(C)CN1CC(C1)O 269982a_100000749847_100000701081 [0,1,0,1,0,0|2,0,0]=4 4016 B11R1.140 CC(C)(CO)CNCC1CC1 2230a_100020635058_100000742324 [0,1,0,1,0,0|2,0,0]=4 4017 B11R1.140 CC(C)(CO)CNCC1CC1 269862a_100020635058_100000741477 [0,1,0,1,0,0|2,0,0]=4 4018 B11R1.140 CC(C)(CO)CNCC1CC1 34a_100000735609_100009813988 [0,1,0,1,0,0|2,0,0]=4 4019 B11R1.140 CC(C)(CO)CNCC1CO1 2230a_100020635058_100011216344 [0,1,0,1,0,0|2,0,0]=4 4020 B11R1.140 CC(C)(CO)COCC1CC1 34a_100000211283_100009813988 [0,1,0,1,0,0|2,0,0]=4 4021 B11R1.140 CC(C)(CO)COC[C@@H]1CO1 34a_100000757423_100009813988 [0,1,0,1,0,0|2,0,0]=4 4022 B11R1.140 CC(C)(CO)CSCC1CC1 62a_100000756562_100009813988 [0,1,0,1,0,0|2,0,0]=4 4023 B11R1.140 CC(C)(CO)CSCC1CC1 62a_100009813988_100000742324 [0,1,0,1,0,0|2,0,0]=4 4024 B11R1.140 CC(C)(CO)CSCC1CO1 62a_100009813988_102125554688 [0,1,0,1,0,0|2,0,0]=4 4025 B11R1.140 CC(C)(CO)CSCC1CO1 62a_102125554688_100009813988 [0,1,0,1,0,0|2,0,0]=4 4026 B11R1.140 CC(C)(CO)CSCC1CS1 62a_100000031435_100009813988 [0,1,0,1,0,0|2,0,0]=4 4027 B11R1.140 CC(C)(CO)CSCC1CS1 62a_100009813988_100000031435 [0,1,0,1,0,0|2,0,0]=4 4028 B11R1.140 CC(C)(CO)CSC[C@@H]1CO1 62a_100000745022_100009813988 [0,1,0,1,0,0|2,0,0]=4 4029 B11R1.140 CC(C)(CO)CSC[C@@H]1CO1 62a_100009813988_100000745022 [0,1,0,1,0,0|2,0,0]=4 4030 B11R1.140 CC(C)(CO)NCCC1CC1 2230a_100000210608_100000694398 [0,1,0,1,0,0|2,0,0]=4 4031 B11R1.140 CC(C)(CO)NCCC1CO1 2230a_100000210608_100000732470 [0,1,0,1,0,0|2,0,0]=4 4032 B11R1.140 COC(C)(C)CNCC1CC1 2230a_100000763424_100000742324 [0,1,0,1,0,0|2,0,0]=4 4033 B11R1.140 COC(C)(C)CNCC1CC1 269862a_100000763424_100000741477 [0,1,0,1,0,0|2,0,0]=4 4034 B11R1.140 COC(C)(C)CNCC1CC1 34a_100000735609_100000701081 [0,1,0,1,0,0|2,0,0]=4 4035 B11R1.140 COC(C)(C)CNCC1CO1 2230a_100000763424_100011216344 [0,1,0,1,0,0|2,0,0]=4 4036 B11R1.140 COC(C)(C)COCC1CC1 34a_100000211283_100000701081 [0,1,0,1,0,0|2,0,0]=4 4037 B11R1.140 COC(C)(C)COC[C@@H]1CO1 34a_100000757423_100000701081 [0,1,0,1,0,0|2,0,0]=4 4038 B11R1.140 COC(C)(C)CSCC1CC1 62a_100000701081_100000742324 [0,1,0,1,0,0|2,0,0]=4 4039 B11R1.140 COC(C)(C)CSCC1CC1 62a_100000756562_100000701081 [0,1,0,1,0,0|2,0,0]=4 4040 B11R1.140 COC(C)(C)CSCC1CO1 62a_100000701081_102125554688 [0,1,0,1,0,0|2,0,0]=4 4041 B11R1.140 COC(C)(C)CSCC1CO1 62a_102125554688_100000701081 [0,1,0,1,0,0|2,0,0]=4 4042 B11R1.140 COC(C)(C)CSCC1CS1 62a_100000031435_100000701081 [0,1,0,1,0,0|2,0,0]=4 4043 B11R1.140 COC(C)(C)CSCC1CS1 62a_100000701081_100000031435 [0,1,0,1,0,0|2,0,0]=4 4044 B11R1.140 COC(C)(C)CSC[C@@H]1CO1 62a_100000701081_100000745022 [0,1,0,1,0,0|2,0,0]=4 4045 B11R1.140 COC(C)(C)CSC[C@@H]1CO1 62a_100000745022_100000701081 [0,1,0,1,0,0|2,0,0]=4 4046 B11R1.407 CC(C)CNCC1(CC1)CO 2230a_100000757901_100000210760 [0,1,0,1,0,0|2,0,0]=4 4047 B11R1.407 CC(C)CNCC1(CC1)CO 270004a_100000757901_100000210432 [0,1,0,1,0,0|2,0,0]=4 4048 B11R1.407 CC(O)CNCC1(CC1)CO 2230a_100000757901_100011218427 [0,1,0,1,0,0|2,0,0]=4 4049 B11R1.407 CCC1(CO1)CNCC(C)C 34a_100000210953_200000139556 [0,1,0,1,0,0|2,0,0]=4 4050 B11R1.407 CCC1(CO1)CNCC(C)O 34a_100000210904_200000139556 [0,1,0,1,0,0|2,0,0]=4 4051 B11R1.407 CCC1(CO1)COCC(C)Br 34a_100012180447_200000139556 [0,1,0,1,0,0|2,0,0]=4 4052 B11R1.407 CCC1(CO1)COCC(C)C 34a_100000210257_200000139556 [0,1,0,1,0,0|2,0,0]=4 4053 B11R1.407 CCC1(CO1)COCC(C)F 34a_100015925927_200000139556 [0,1,0,1,0,0|2,0,0]=4 4054 B11R1.407 CCC1(CO1)COC[C@@H](C)Cl 34a_100016084084_200000139556 [0,1,0,1,0,0|2,0,0]=4 4055 B11R1.407 CCC1(CO1)COC[C@@H](C)N 34a_100000737577_200000139556 [0,1,0,1,0,0|1,0,0]=3 4056 B11R1.407 CCC1(CO1)CSCC(C)C 62a_100000210624_200000139556 [0,1,0,1,0,0|2,0,0]=4 4057 B11R1.407 CCC1(CO1)CSCC(C)C 62a_200000139556_100000210760 [0,1,0,1,0,0|2,0,0]=4 4058 B11R1.407 CCC1(CO1)CSCC(C)O 62a_100011218427_200000139556 [0,1,0,1,0,0|2,0,0]=4 4059 B11R1.407 CCC1(CO1)CSCC(C)O 62a_200000139556_100011218427 [0,1,0,1,0,0|2,0,0]=4 4060 B11R1.407 CCC1(CO1)CSC[C@@H](C)O 62a_100009817552_200000139556 [0,1,0,1,0,0|2,0,0]=4 4061 B11R1.407 CCC1(CO1)CSC[C@@H](C)O 62a_200000139556_100009817552 [0,1,0,1,0,0|2,0,0]=4 4062 B11R1.407 C[C@@H](N)CCOC1(CC1)C#N 34a_100000706166_100009889376 [0,1,0,1,0,0|2,0,0]=4 4063 B11R1.407 C[C@@H](N)COCC1(CC1)C#N 34a_100000737577_100000695377 [0,1,0,1,0,0|2,0,0]=4 4064 B11R1.407 C[C@@H](O)CNCC1(CC1)CO 2230a_100000757901_100009817552 [0,1,0,1,0,0|2,0,0]=4 4065 B11R1.413 CC(C)CN1CC(C1)(C)CO 2230a_100015203900_100000210760 [0,1,0,1,0,0|2,0,0]=4 4066 B11R1.413 CC(C)CN1CC(C1)(C)CO 269982a_100015203900_100000210624 [0,1,0,1,0,0|2,0,0]=4 4067 B11R1.413 CC(C)CN1CC(C1)(C)CO 270004a_100015203900_100000210432 [0,1,0,1,0,0|2,0,0]=4 4068 B11R1.413 CC(O)CN1CC(C1)(C)CO 2230a_100015203900_100011218427 [0,1,0,1,0,0|2,0,0]=4 4069 B11R1.413 CC(O)CN1CC(C1)(C)CO 269982a_100015203900_100011218427 [0,1,0,1,0,0|2,0,0]=4 4070 B11R1.413 CCC1(CN(C1)CC(C)C)O 2230a_100015191684_100000210760 [0,1,0,1,0,0|2,0,0]=4 4071 B11R1.413 CCC1(CN(C1)CC(C)C)O 269982a_100015191684_100000210624 [0,1,0,1,0,0|2,0,0]=4 4072 B11R1.413 CCC1(CN(C1)CC(C)O)O 2230a_100015191684_100011218427 [0,1,0,1,0,0|2,0,0]=4 4073 B11R1.413 CCC1(CN(C1)CC(C)O)O 269982a_100015191684_100011218427 [0,1,0,1,0,0|2,0,0]=4 4074 B11R1.413 CCC1(CN(C1)C[C@@H](C)O)O 2230a_100015191684_100009817552 [0,1,0,1,0,0|2,0,0]=4 4075 B11R1.413 CCC1(CN(C1)C[C@@H](C)O)O 269982a_100015191684_100009817552 [0,1,0,1,0,0|2,0,0]=4 4076 B11R1.413 COC1(CN(C1)CC(C)C)C 2230a_100000695453_100000210760 [0,1,0,1,0,0|2,0,0]=4 4077 B11R1.413 COC1(CN(C1)CC(C)C)C 269982a_100000695453_100000210624 [0,1,0,1,0,0|2,0,0]=4 4078 B11R1.413 COC1(CN(C1)CC(C)C)C 270004a_100000695453_100000210432 [0,1,0,1,0,0|2,0,0]=4 4079 B11R1.413 COC1(CN(C1)CC(C)O)C 2230a_100000695453_100011218427 [0,1,0,1,0,0|2,0,0]=4 4080 B11R1.413 COC1(CN(C1)CC(C)O)C 269982a_100000695453_100011218427 [0,1,0,1,0,0|2,0,0]=4 4081 B11R1.413 COC1(CN(C1)C[C@@H](C)O)C 2230a_100000695453_100009817552 [0,1,0,1,0,0|2,0,0]=4 4082 B11R1.413 COC1(CN(C1)C[C@@H](C)O)C 269982a_100000695453_100009817552 [0,1,0,1,0,0|2,0,0]=4 4083 B11R1.413 C[C@@H](O)CN1CC(C1)(C)CO 2230a_100015203900_100009817552 [0,1,0,1,0,0|2,0,0]=4 4084 B11R1.413 C[C@@H](O)CN1CC(C1)(C)CO 269982a_100015203900_100009817552 [0,1,0,1,0,0|2,0,0]=4 4085 B11R1.619 CC(C)(CO)CN[C@@H]1C[C@H]1F 34a_100025746932_100009813988 [0,1,0,1,0,0|2,0,0]=4 4086 B11R1.619 COC(C)(C)CN[C@@H]1C[C@H]1F 34a_100025746932_100000701081 [0,1,0,1,0,0|2,0,0]=4 4087 B11R1.727 CC(C)N1CCC(CC1)(C)O 2230a_100000690209_100000210206 [0,1,0,1,0,0|2,0,0]=4 4088 B11R1.727 CC(C)N1CCC(CC1)(C)O 269982a_100000690209_100000210206 [0,1,0,1,0,0|2,0,0]=4 4089 B11R1.727 CN(C)C1CCC(CC1)(C)O 270004a_100102631434_100012184276 [0,1,0,1,0,0|2,0,0]=4 4090 B11R1.924 CC(Br)COCC1(COC1)C 34a_100012180447_100009817586 [0,1,0,1,0,0|2,0,0]=4 4091 B11R1.924 CC(C)CCNC1(COC1)C 2230a_100000732644_100000210312 [0,1,0,1,0,0|2,0,0]=4 4092 B11R1.924 CC(C)CNCC1(CCC1)O 2230a_100000752638_100000210760 [0,1,0,1,0,0|2,0,0]=4 4093 B11R1.924 CC(C)CNCC1(CCC1)O 270004a_100000752638_100000210432 [0,1,0,1,0,0|2,0,0]=4 4094 B11R1.924 CC(C)CNCC1(COC1)C 2230a_100000210953_100000066812 [0,1,0,1,0,0|2,0,0]=4 4095 B11R1.924 CC(C)CNCC1(COC1)C 2230a_100020631278_100000210760 [0,1,0,1,0,0|2,0,0]=4 4096 B11R1.924 CC(C)CNCC1(COC1)C 269862a_100000210953_100000050806 [0,1,0,1,0,0|2,0,0]=4 4097 B11R1.924 CC(C)CNCC1(COC1)C 270004a_100020631278_100000210432 [0,1,0,1,0,0|2,0,0]=4 4098 B11R1.924 CC(C)CNCC1(COC1)C 34a_100000210953_100009817586 [0,1,0,1,0,0|2,0,0]=4 4099 B11R1.924 CC(C)CNCC1(COC1)O 2230a_100010264505_100000210760 [0,1,0,1,0,0|2,0,0]=4 4100 B11R1.924 CC(C)CNCC1(COC1)O 270004a_100010264505_100000210432 [0,1,0,1,0,0|2,0,0]=4 4101 B11R1.924 CC(C)COCC1(COC1)C 34a_100000210257_100009817586 [0,1,0,1,0,0|2,0,0]=4 4102 B11R1.924 CC(C)CSCC1(COC1)C 62a_100000210624_100009817586 [0,1,0,1,0,0|2,0,0]=4 4103 B11R1.924 CC(C)CSCC1(COC1)C 62a_100009817586_100000210760 [0,1,0,1,0,0|2,0,0]=4 4104 B11R1.924 CC(F)COCC1(COC1)C 34a_100015925927_100009817586 [0,1,0,1,0,0|2,0,0]=4 4105 B11R1.924 CC(O)CCNC1(COC1)C 2230a_100000732644_100012276601 [0,1,0,1,0,0|2,0,0]=4 4106 B11R1.924 CC(O)CNCC1(CCC1)O 2230a_100000752638_100011218427 [0,1,0,1,0,0|2,0,0]=4 4107 B11R1.924 CC(O)CNCC1(COC1)C 2230a_100000210904_100000066812 [0,1,0,1,0,0|2,0,0]=4 4108 B11R1.924 CC(O)CNCC1(COC1)C 2230a_100020631278_100011218427 [0,1,0,1,0,0|2,0,0]=4 4109 B11R1.924 CC(O)CNCC1(COC1)C 269862a_100000210904_100000050806 [0,1,0,1,0,0|2,0,0]=4 4110 B11R1.924 CC(O)CNCC1(COC1)C 34a_100000210904_100009817586 [0,1,0,1,0,0|2,0,0]=4 4111 B11R1.924 CC(O)CNCC1(COC1)O 2230a_100010264505_100011218427 [0,1,0,1,0,0|2,0,0]=4 4112 B11R1.924 CC(O)CSCC1(COC1)C 62a_100009817586_100011218427 [0,1,0,1,0,0|2,0,0]=4 4113 B11R1.924 CC(O)CSCC1(COC1)C 62a_100011218427_100009817586 [0,1,0,1,0,0|2,0,0]=4 4114 B11R1.924 C[C@@H](Cl)COCC1(COC1)C 34a_100016084084_100009817586 [0,1,0,1,0,0|2,0,0]=4 4115 B11R1.924 C[C@@H](N)COCC1(CCC1)C 34a_100000737577_100000726658 [0,1,0,1,0,0|2,0,0]=4 4116 B11R1.924 C[C@@H](N)COCC1(COC1)C 34a_100000737577_100009817586 [0,1,0,1,0,0|1,0,0]=3 4117 B11R1.924 C[C@@H](O)CNCC1(CCC1)O 2230a_100000752638_100009817552 [0,1,0,1,0,0|2,0,0]=4 4118 B11R1.924 C[C@@H](O)CNCC1(COC1)C 2230a_100020631278_100009817552 [0,1,0,1,0,0|2,0,0]=4 4119 B11R1.924 C[C@@H](O)CNCC1(COC1)O 2230a_100010264505_100009817552 [0,1,0,1,0,0|2,0,0]=4 4120 B11R1.924 C[C@@H](O)CSCC1(COC1)C 62a_100009817552_100009817586 [0,1,0,1,0,0|2,0,0]=4 4121 B11R1.924 C[C@@H](O)CSCC1(COC1)C 62a_100009817586_100009817552 [0,1,0,1,0,0|2,0,0]=4 4122 B11R1.1217 CN1CCCC(CC1)(O)CO 2230a_200015185645_200000210301 [0,1,0,1,0,0|2,0,0]=4 4123 B11R1.1217 CN1CCCC(CC1)(O)CO 269982a_200015185645_200000210301 [0,1,0,1,0,0|2,0,0]=4 4124 B11R1.1217 [13CH3]N1CCCC(CC1)(O)CO 2230a_200015185645_200025704644 [0,1,0,1,0,0|2,0,0]=4 4125 B11R1.1217 [13CH3]N1CCCC(CC1)(O)CO 269982a_200015185645_200025704644 [0,1,0,1,0,0|2,0,0]=4 4126 B11R1.1322 CC1(CCCC(N1[13CH3])(C)C)C 269982a_100011193410_200025704644 [0,1,0,1,0,0|2,0,0]=4 4127 B11R1.1322 CC1(CCCC(N1[13CH3])(C)C)C 34a_100011193410_200025704644 [0,1,0,1,0,0|2,0,0]=4 4128 B11R1.1322 CC1(CCCC(N1[13CH3])(C)C)C 7a_100011193410_200025704644 [0,1,0,1,0,0|2,0,0]=4 4129 B11R1.1322 CN1C(CCCC1(C)C)(C)C 269982a_100011193410_200000210301 [0,1,0,1,0,0|2,0,0]=4 4130 B11R1.1322 CN1C(CCCC1(C)C)(C)C 34a_100011193410_200000210301 [0,1,0,1,0,0|2,0,0]=4 4131 B11R1.1322 CN1C(CCCC1(C)C)(C)C 7a_100011193410_200000210301 [0,1,0,1,0,0|2,0,0]=4 4132 B11R1.1106 CC(C)C(=O)[C@H]1C[C@@](C1)(C)O 1458a_100010742821_100000210206 [0,1,0,1,0,0|1,0,1]=4 4133 B11R1.1417 CC(NCC(C)(C)O)C1CC1 269862a_100000751335_100000210639 [0,1,0,1,0,0|2,0,0]=4 4134 B11R1.1417 CC(NCC(C)(C)O)C1CC1 34a_100000700016_100000764493 [0,1,0,1,0,0|2,0,0]=4 4135 B11R1.1417 CC(NCC(C)(C)O)C1CO1 270004a_100000751335_100000031964 [0,1,0,1,0,0|2,0,0]=4 4136 B11R1.1417 CC(OCC(C)(C)O)C1CC1 34a_100000744524_100000764493 [0,1,0,1,0,0|2,0,0]=4 4137 B11R1.1417 CC(OCC(C)(C)O)C1CC1 7a_100000744524_100000764493 [0,1,0,1,0,0|2,0,0]=4 4138 B11R1.1417 CN(CCC(C)(C)O)C1CC1 2230a_100000226674_100000702414 [0,1,0,1,0,0|2,0,0]=4 4139 B11R2.52 CC1(CO1)CN[C@@H]2C[C@H]2F 34a_100025746932_100000760498 [0,0,0,2,0,0|2,0,0]=4 4140 B11R2.137 CC1(CO1)CN2CC(C2)F 269982a_100000690557_100000760498 [0,0,0,2,0,0|2,0,0]=4 4141 B11R2.137 CC1(CO1)CN2CC(C2)F 34a_100000690557_100000760498 [0,0,0,2,0,0|2,0,0]=4 4142 B11R2.137 CC1(CO1)CN2CC(C2)O 269982a_100000749847_100000760498 [0,0,0,2,0,0|2,0,0]=4 4143 B11R2.137 CC1CN(C1)CC2(CO2)C 269982a_100000702820_100000760498 [0,0,0,2,0,0|2,0,0]=4 4144 B11R2.137 CC1CN(C1)CC2(CO2)C 34a_100000702820_100000760498 [0,0,0,2,0,0|2,0,0]=4 4145 B11R2.377 CC1(CN(C1)CC2CC2)O 2230a_100000718560_100000742324 [0,0,0,2,0,0|2,0,0]=4 4146 B11R2.377 CC1(CN(C1)CC2CC2)O 269982a_100000718560_100000756562 [0,0,0,2,0,0|2,0,0]=4 4147 B11R2.377 CC1(CN(C1)CC2CO2)O 2230a_100000718560_100011216344 [0,0,0,2,0,0|2,0,0]=4 4148 B11R2.377 CC1(CN(C1)CC2CO2)O 269982a_100000718560_102125554688 [0,0,0,2,0,0|2,0,0]=4 4149 B11R2.377 CC1(CN(C1)CC2CS2)O 269982a_100000718560_100000031435 [0,0,0,2,0,0|2,0,0]=4 4150 B11R2.377 CC1(CN(C1)C[C@@H]2CO2)O 269982a_100000718560_100000745022 [0,0,0,2,0,0|2,0,0]=4 4151 B11R2.389 CC1(OC1COC2CC2)C 34a_200010283642_100000211595 [0,0,0,2,0,0|2,0,0]=4 4152 B11R2.1538 CC1(CCN(C1)C2CC2)O 269982a_100000718628_100000211595 [0,0,0,2,0,0|2,0,0]=4 4153 B11R2.1550 CC1(CO1)CNCC2CC2 34a_100000735609_100000760498 [0,0,0,2,0,0|2,0,0]=4 4154 B11R2.1550 CC1(CO1)COCC2CC2 34a_100000211283_100000760498 [0,0,0,2,0,0|2,0,0]=4 4155 B11R2.1550 CC1(CO1)COC[C@@H]2CO2 34a_100000757423_100000760498 [0,0,0,2,0,0|2,0,0]=4 4156 B11R2.1550 CC1(CO1)CSCC2CC2 62a_100000756562_100000760498 [0,0,0,2,0,0|2,0,0]=4 4157 B11R2.1550 CC1(CO1)CSCC2CC2 62a_100000760498_100000742324 [0,0,0,2,0,0|2,0,0]=4 4158 B11R2.1550 CC1(CO1)CSCC2CO2 62a_100000760498_102125554688 [0,0,0,2,0,0|2,0,0]=4 4159 B11R2.1550 CC1(CO1)CSCC2CO2 62a_102125554688_100000760498 [0,0,0,2,0,0|2,0,0]=4 4160 B11R2.1550 CC1(CO1)CSCC2CS2 62a_100000031435_100000760498 [0,0,0,2,0,0|2,0,0]=4 4161 B11R2.1550 CC1(CO1)CSCC2CS2 62a_100000760498_100000031435 [0,0,0,2,0,0|2,0,0]=4 4162 B11R2.1550 CC1(CO1)CSC[C@@H]2CO2 62a_100000745022_100000760498 [0,0,0,2,0,0|2,0,0]=4 4163 B11R2.1550 CC1(CO1)CSC[C@@H]2CO2 62a_100000760498_100000745022 [0,0,0,2,0,0|2,0,0]=4 4164 B11R2.1550 OC1(CC1)CNCC2CC2 2230a_100011936951_100000742324 [0,0,0,2,0,0|2,0,0]=4 4165 B11R2.1550 OC1(CC1)CNCC2CC2 269862a_100011936951_100000741477 [0,0,0,2,0,0|2,0,0]=4 4166 B11R2.1550 OC1(CC1)CNCC2CO2 2230a_100011936951_100011216344 [0,0,0,2,0,0|2,0,0]=4 4167 B7R0.6 CC(=O)CCC(C)C 1458a_100000070787_100000210312 [1,0,0,0,1,0|1,0,1]=4 4168 B7R0.6 CC(=O)CCC(C)C 1458a_100000181311_200000210301 [1,0,0,0,1,0|1,0,1]=4 4169 B7R0.6 CC(=O)CCC(C)O 1458a_100000070787_100012276601 [1,0,0,0,1,0|1,0,1]=4 4170 B7R0.6 CC(Br)COC(C)C 34a_100012180447_100000210206 [1,0,0,0,1,0|2,0,0]=4 4171 B7R0.6 CC(C)CCC(=O)[13CH3] 1458a_100000181311_200025704644 [1,0,0,0,1,0|1,0,1]=4 4172 B7R0.6 CC(C)CCN(C)C 2230a_100000742789_200000210301 [1,0,0,0,1,0|2,0,0]=4 4173 B7R0.6 CC(C)CCN(C)C 2230a_100102631434_100000210312 [1,0,0,0,1,0|2,0,0]=4 4174 B7R0.6 CC(C)CCN(C)C 269982a_100000742789_200000210301 [1,0,0,0,1,0|2,0,0]=4 4175 B7R0.6 CC(C)CCN(C)C 269982a_100102631434_100000210312 [1,0,0,0,1,0|2,0,0]=4 4176 B7R0.6 CC(C)CCN(C)[13CH3] 2230a_100000742789_200025704644 [1,0,0,0,1,0|2,0,0]=4 4177 B7R0.6 CC(C)CCN(C)[13CH3] 269982a_100000742789_200025704644 [1,0,0,0,1,0|2,0,0]=4 4178 B7R0.6 CC(C)CNC(C)C 2230a_100000210953_100000210206 [1,0,0,0,1,0|2,0,0]=4 4179 B7R0.6 CC(C)CNC(C)C 2230a_100138425928_100000210760 [1,0,0,0,1,0|2,0,0]=4 4180 B7R0.6 CC(C)CNC(C)C 34a_100000210953_100000210206 [1,0,0,0,1,0|2,0,0]=4 4181 B7R0.6 CC(C)CNC(C)C 34a_100138425928_100000210624 [1,0,0,0,1,0|2,0,0]=4 4182 B7R0.6 CC(C)COC(C)C 34a_100000210257_100000210206 [1,0,0,0,1,0|2,0,0]=4 4183 B7R0.6 CC(C)COC(C)C 34a_100000212225_100000210624 [1,0,0,0,1,0|2,0,0]=4 4184 B7R0.6 CC(C)CSC(C)C 62a_100000210206_100000210760 [1,0,0,0,1,0|2,0,0]=4 4185 B7R0.6 CC(C)CSC(C)C 62a_100000210624_100000210206 [1,0,0,0,1,0|2,0,0]=4 4186 B7R0.6 CC(C)NC[C@@H](C)O 2230a_100138425928_100009817552 [1,0,0,0,1,0|2,0,0]=4 4187 B7R0.6 CC(C)NC[C@@H](C)O 34a_100138425928_100009817552 [1,0,0,0,1,0|2,0,0]=4 4188 B7R0.6 CC(C)OC[C@@H](C)Cl 34a_100016084084_100000210206 [1,0,0,0,1,0|2,0,0]=4 4189 B7R0.6 CC(C)OC[C@@H](C)N 34a_100000737577_100000210206 [1,0,0,0,1,0|1,0,0]=3 4190 B7R0.6 CC(C)OC[C@@H](C)O 34a_100000212225_100009817552 [1,0,0,0,1,0|2,0,0]=4 4191 B7R0.6 CC(C)SC[C@@H](C)O 62a_100000210206_100009817552 [1,0,0,0,1,0|2,0,0]=4 4192 B7R0.6 CC(C)SC[C@@H](C)O 62a_100009817552_100000210206 [1,0,0,0,1,0|2,0,0]=4 4193 B7R0.6 CC(F)COC(C)C 34a_100015925927_100000210206 [1,0,0,0,1,0|2,0,0]=4 4194 B7R0.6 CC(O)CCN(C)C 2230a_100102631434_100012276601 [1,0,0,0,1,0|2,0,0]=4 4195 B7R0.6 CC(O)CCN(C)C 269982a_100102631434_100012276601 [1,0,0,0,1,0|2,0,0]=4 4196 B7R0.6 CC(O)CNC(C)C 2230a_100000210904_100000210206 [1,0,0,0,1,0|2,0,0]=4 4197 B7R0.6 CC(O)CNC(C)C 2230a_100138425928_100011218427 [1,0,0,0,1,0|2,0,0]=4 4198 B7R0.6 CC(O)CNC(C)C 34a_100000210904_100000210206 [1,0,0,0,1,0|2,0,0]=4 4199 B7R0.6 CC(O)CNC(C)C 34a_100138425928_100011218427 [1,0,0,0,1,0|2,0,0]=4 4200 B7R0.6 CC(O)COC(C)C 34a_100000212225_100011218427 [1,0,0,0,1,0|2,0,0]=4 4201 B7R0.6 CC(O)CSC(C)C 62a_100000210206_100011218427 [1,0,0,0,1,0|2,0,0]=4 4202 B7R0.6 CC(O)CSC(C)C 62a_100011218427_100000210206 [1,0,0,0,1,0|2,0,0]=4 4203 B7R0.9 CC(=O)CC(C)(C)O 1458a_100000693243_200000210301 [0,0,0,0,2,0|1,0,1]=4 4204 B7R0.9 CC(C)(O)CC(=O)[13CH3] 1458a_100000693243_200025704644 [0,0,0,0,2,0|1,0,1]=4 4205 B7R0.9 CN(C)CC(C)(C)O 2230a_100000755907_200000210301 [0,0,0,0,2,0|2,0,0]=4 4206 B7R0.9 CN(C)CC(C)(C)O 269982a_100000755907_200000210301 [0,0,0,0,2,0|2,0,0]=4 4207 B7R0.9 CN([13CH3])CC(C)(C)O 2230a_100000755907_200025704644 [0,0,0,0,2,0|2,0,0]=4 4208 B7R0.9 CN([13CH3])CC(C)(C)O 269982a_100000755907_200025704644 [0,0,0,0,2,0|2,0,0]=4 4209 B9R0.55 C=C(C)CCNCC(C)C 2230a_100000210953_100000730704 [1,0,0,0,0,1|1,0,1]=4 4210 B9R0.55 C=C(C)CCNCC(C)C 34a_100000210953_100000730704 [1,0,0,0,0,1|1,0,1]=4 4211 B9R0.55 C=C(C)CCNCC(C)O 2230a_100000210904_100000730704 [1,0,0,0,0,1|1,0,1]=4 4212 B9R0.55 C=C(C)CCNCC(C)O 34a_100000210904_100000730704 [1,0,0,0,0,1|1,0,1]=4 4213 B9R0.55 C=C(C)CCOCC(C)C 34a_100000210257_100000730704 [1,0,0,0,0,1|1,0,1]=4 4214 B9R0.55 C=C(C)CCOCC(C)C 34a_100000764851_100000210624 [1,0,0,0,0,1|1,0,1]=4 4215 B9R0.55 C=C(C)CCOCC(C)O 34a_100000764851_100011218427 [1,0,0,0,0,1|1,0,1]=4 4216 B9R0.55 C=C(C)CCOC[C@@H](C)N 34a_100000737577_100000730704 [1,0,0,0,0,1|0,0,2]=4 4217 B9R0.55 C=C(C)CCOC[C@@H](C)O 34a_100000764851_100009817552 [1,0,0,0,0,1|1,0,1]=4 4218 B9R0.55 C=C(C)CCSCC(C)C 62a_100000210624_100000730704 [1,0,0,0,0,1|1,0,1]=4 4219 B9R0.55 C=C(C)CCSCC(C)C 62a_100000730704_100000210760 [1,0,0,0,0,1|1,0,1]=4 4220 B9R0.55 C=C(C)CCSCC(C)O 62a_100000730704_100011218427 [1,0,0,0,0,1|1,0,1]=4 4221 B9R0.55 C=C(C)CCSCC(C)O 62a_100011218427_100000730704 [1,0,0,0,0,1|1,0,1]=4 4222 B9R0.55 C=C(C)CCSC[C@@H](C)O 62a_100000730704_100009817552 [1,0,0,0,0,1|1,0,1]=4 4223 B9R0.55 C=C(C)CCSC[C@@H](C)O 62a_100009817552_100000730704 [1,0,0,0,0,1|1,0,1]=4 4224 B9R0.55 C=C(C)CNCCC(C)O 2230a_200000755665_100000748629 [1,0,0,0,0,1|1,0,1]=4 4225 B9R0.55 C=C(C)COCCC(C)C 34a_100000210245_100000210312 [1,0,0,0,0,1|1,0,1]=4 4226 B9R0.55 C=C(C)COCCC(C)C 34a_100000210254_100000748629 [1,0,0,0,0,1|1,0,1]=4 4227 B9R0.55 C=C(C)COCCC(C)C 7a_100000210254_100000748629 [1,0,0,0,0,1|1,0,1]=4 4228 B9R0.55 C=C(C)COCCC(C)O 34a_100000210245_100012276601 [1,0,0,0,0,1|1,0,1]=4 4229 B9R0.55 C=C(C)COCC[C@@H](C)N 34a_100000706166_100000748629 [1,0,0,0,0,1|0,0,2]=4 4230 B9R0.55 C=C(C)CSCCC(C)C 62a_100000210312_100000211660 [1,0,0,0,0,1|1,0,1]=4 4231 B9R0.55 C=C(C)CSCCC(C)C 62a_100000748629_100000210312 [1,0,0,0,0,1|1,0,1]=4 4232 B9R0.55 C=C(C)CSCCC(C)O 62a_100000748629_100012276601 [1,0,0,0,0,1|1,0,1]=4 4233 B9R0.55 C=C(C)CSCCC(C)O 62a_100012276601_100000211660 [1,0,0,0,0,1|1,0,1]=4 4234 B9R0.55 CC(=CCOC[C@@H](C)N)C 34a_100000737577_100000761012 [1,0,0,0,0,1|0,0,2]=4 4235 B9R0.55 CC(=O)CCCCC(C)C 1458a_100000070787_100011216152 [1,0,0,0,0,1|1,0,1]=4 4236 B9R0.55 CC(=O)CCCCC(C)C 1458a_100011933920_200000210301 [1,0,0,0,0,1|1,0,1]=4 4237 B9R0.55 CC(=O)CCCNC(C)C 34a_100138425928_100000685027 [1,0,0,0,0,1|1,0,1]=4 4238 B9R0.55 CC(=O)CCCOC(C)C 34a_100000212225_100000685027 [1,0,0,0,0,1|1,0,1]=4 4239 B9R0.55 CC(=O)CCCOC(C)C 34a_100000759063_100000210206 [1,0,0,0,0,1|1,0,1]=4 4240 B9R0.55 CC(=O)CCCOC(C)C 7a_100000759063_100000210206 [1,0,0,0,0,1|1,0,1]=4 4241 B9R0.55 CC(=O)CCCSC(C)C 62a_100000210206_100011215641 [1,0,0,0,0,1|1,0,1]=4 4242 B9R0.55 CC(=O)CCCSC(C)C 62a_100011215641_100000210206 [1,0,0,0,0,1|1,0,1]=4 4243 B9R0.55 CC(=O)CCOCC(C)C 34a_100000759926_100000210624 [1,0,0,0,0,1|1,0,1]=4 4244 B9R0.55 CC(=O)CCOCC(C)C 7a_100000759926_100000210760 [1,0,0,0,0,1|1,0,1]=4 4245 B9R0.55 CC(=O)CCOCC(C)O 34a_100000759926_100011218427 [1,0,0,0,0,1|1,0,1]=4 4246 B9R0.55 CC(=O)CCOCC(C)O 7a_100000759926_100011218427 [1,0,0,0,0,1|1,0,1]=4 4247 B9R0.55 CC(=O)CCOC[C@@H](C)O 34a_100000759926_100009817552 [1,0,0,0,0,1|1,0,1]=4 4248 B9R0.55 CC(=O)CCOC[C@@H](C)O 7a_100000759926_100009817552 [1,0,0,0,0,1|1,0,1]=4 4249 B9R0.55 CC(=O)CCSCC(C)C 62a_100000053229_100000210760 [1,0,0,0,0,1|1,0,1]=4 4250 B9R0.55 CC(=O)CCSCC(C)C 62a_100000210624_100000053229 [1,0,0,0,0,1|1,0,1]=4 4251 B9R0.55 CC(=O)CCSCC(C)O 62a_100000053229_100011218427 [1,0,0,0,0,1|1,0,1]=4 4252 B9R0.55 CC(=O)CCSCC(C)O 62a_100011218427_100000053229 [1,0,0,0,0,1|1,0,1]=4 4253 B9R0.55 CC(=O)CCSC[C@@H](C)O 62a_100000053229_100009817552 [1,0,0,0,0,1|1,0,1]=4 4254 B9R0.55 CC(=O)CCSC[C@@H](C)O 62a_100009817552_100000053229 [1,0,0,0,0,1|1,0,1]=4 4255 B9R0.55 CC(=O)COCCC(C)C 34a_100000211253_100000210312 [1,0,0,0,0,1|1,0,1]=4 4256 B9R0.55 CC(=O)COCCC(C)O 34a_100000211253_100012276601 [1,0,0,0,0,1|1,0,1]=4 4257 B9R0.55 CC(=O)NCCCC(C)C 11a_200000737386_100015343762 [1,0,0,0,0,1|1,0,1]=4 4258 B9R0.55 CC(=O)NCCCC(C)C 1626a_200000737386_100015343762 [1,0,0,0,0,1|1,0,1]=4 4259 B9R0.55 CC(=O)NCCCC(C)C 240690a_200000737386_100015343762 [1,0,0,0,0,1|1,0,1]=4 4260 B9R0.55 CC(=O)NCCCC(C)C 527a_200000737386_100103153847 [1,0,0,0,0,1|1,0,1]=4 4261 B9R0.55 CC(Br)CCOC[C@@H](C)O 34a_100009893172_100009817552 [1,0,0,0,0,1|1,0,0]=3 4262 B9R0.55 CC(Br)COCOC(C)C 34a_100012180447_100000709892 [1,0,0,0,0,1|2,0,0]=4 4263 B9R0.55 CC(C)CCCCC(=O)[13CH3] 1458a_100011933920_200025704644 [1,0,0,0,0,1|1,0,1]=4 4264 B9R0.55 CC(C)CCCCN(C)C 2230a_100102631434_100011216152 [1,0,0,0,0,1|2,0,0]=4 4265 B9R0.55 CC(C)CCCCN(C)C 269982a_100102631434_100011216152 [1,0,0,0,0,1|2,0,0]=4 4266 B9R0.55 CC(C)CCCNC(C)C 2230a_100138425928_100011214892 [1,0,0,0,0,1|1,0,0]=3 4267 B9R0.55 CC(C)CCCNC(C)C 2230a_200000737386_100000210206 [1,0,0,0,0,1|1,0,0]=3 4268 B9R0.55 CC(C)CCCNC(C)C 34a_100138425928_100011214892 [1,0,0,0,0,1|1,0,0]=3 4269 B9R0.55 CC(C)CCCNC(C)C 34a_200000737386_100000210206 [1,0,0,0,0,1|1,0,0]=3 4270 B9R0.55 CC(C)CCCOC(C)C 34a_100000210774_100000210206 [1,0,0,0,0,1|1,0,0]=3 4271 B9R0.55 CC(C)CCCOC(C)C 34a_100000212225_100011214892 [1,0,0,0,0,1|1,0,0]=3 4272 B9R0.55 CC(C)CCCOC(C)C 7a_100000210774_100000210206 [1,0,0,0,0,1|1,0,0]=3 4273 B9R0.55 CC(C)CCCSC(C)C 62a_100000210206_100011214892 [1,0,0,0,0,1|1,0,0]=3 4274 B9R0.55 CC(C)CCCSC(C)C 62a_100011214892_100000210206 [1,0,0,0,0,1|1,0,0]=3 4275 B9R0.55 CC(C)CCNCC(=O)N 2230a_100000711301_100000210312 [1,0,0,0,0,1|1,0,1]=4 4276 B9R0.55 CC(C)CCNCC(C)C 2230a_100000210953_100000210312 [1,0,0,0,0,1|1,0,0]=3 4277 B9R0.55 CC(C)CCNCC(C)C 269862a_100000210953_100000185833 [1,0,0,0,0,1|1,0,0]=3 4278 B9R0.55 CC(C)CCNCC(C)C 270004a_100000210545_100000210432 [1,0,0,0,0,1|1,0,0]=3 4279 B9R0.55 CC(C)CCNCC(C)C 34a_100000210953_100000210312 [1,0,0,0,0,1|1,0,0]=3 4280 B9R0.55 CC(C)CCNCC(C)O 2230a_100000210904_100000210312 [1,0,0,0,0,1|1,0,0]=3 4281 B9R0.55 CC(C)CCNCC(C)O 269862a_100000210904_100000185833 [1,0,0,0,0,1|1,0,0]=3 4282 B9R0.55 CC(C)CCNCC(C)O 34a_100000210904_100000210312 [1,0,0,0,0,1|1,0,0]=3 4283 B9R0.55 CC(C)CCNCC(F)F 34a_100000765723_100000210312 [1,0,0,0,0,1|2,0,0]=4 4284 B9R0.55 CC(C)CCOCC(=O)N 34a_100000210254_100000187820 [1,0,0,0,0,1|1,0,1]=4 4285 B9R0.55 CC(C)CCOCC(=O)N 7a_100000210254_100000187820 [1,0,0,0,0,1|1,0,1]=4 4286 B9R0.55 CC(C)CCOCC(C)Br 34a_100012180447_100000210312 [1,0,0,0,0,1|1,0,0]=3 4287 B9R0.55 CC(C)CCOCC(C)C 34a_100000210254_100000210624 [1,0,0,0,0,1|1,0,0]=3 4288 B9R0.55 CC(C)CCOCC(C)C 34a_100000210257_100000210312 [1,0,0,0,0,1|1,0,0]=3 4289 B9R0.55 CC(C)CCOCC(C)C 7a_100000210254_100000210760 [1,0,0,0,0,1|1,0,0]=3 4290 B9R0.55 CC(C)CCOCC(C)F 34a_100015925927_100000210312 [1,0,0,0,0,1|1,0,0]=3 4291 B9R0.55 CC(C)CCOCC(C)O 34a_100000210254_100011218427 [1,0,0,0,0,1|1,0,0]=3 4292 B9R0.55 CC(C)CCOCC(C)O 7a_100000210254_100011218427 [1,0,0,0,0,1|1,0,0]=3 4293 B9R0.55 CC(C)CCOCC(F)F 34a_100000210254_100011934356 [1,0,0,0,0,1|2,0,0]=4 4294 B9R0.55 CC(C)CCOCC(F)F 34a_100000743014_100000210312 [1,0,0,0,0,1|2,0,0]=4 4295 B9R0.55 CC(C)CCOCC(F)F 7a_100000210254_100011934356 [1,0,0,0,0,1|2,0,0]=4 4296 B9R0.55 CC(C)CCOC[C@@H](C)Cl 34a_100016084084_100000210312 [1,0,0,0,0,1|1,0,0]=3 4297 B9R0.55 CC(C)CCOC[C@@H](C)N 34a_100000737577_100000210312 [1,0,0,0,0,1|0,0,0]=2 4298 B9R0.55 CC(C)CCOC[C@@H](C)O 34a_100000210254_100009817552 [1,0,0,0,0,1|1,0,0]=3 4299 B9R0.55 CC(C)CCOC[C@@H](C)O 7a_100000210254_100009817552 [1,0,0,0,0,1|1,0,0]=3 4300 B9R0.55 CC(C)CCSCC(=O)N 62a_100000210312_100000747473 [1,0,0,0,0,1|1,0,1]=4 4301 B9R0.55 CC(C)CCSCC(=O)N 62a_100000747473_100000210312 [1,0,0,0,0,1|1,0,1]=4 4302 B9R0.55 CC(C)CCSCC(C)C 62a_100000210312_100000210760 [1,0,0,0,0,1|1,0,0]=3 4303 B9R0.55 CC(C)CCSCC(C)C 62a_100000210624_100000210312 [1,0,0,0,0,1|1,0,0]=3 4304 B9R0.55 CC(C)CCSCC(C)O 62a_100000210312_100011218427 [1,0,0,0,0,1|1,0,0]=3 4305 B9R0.55 CC(C)CCSCC(C)O 62a_100011218427_100000210312 [1,0,0,0,0,1|1,0,0]=3 4306 B9R0.55 CC(C)CCSCC(F)F 62a_100000210312_100011934356 [1,0,0,0,0,1|2,0,0]=4 4307 B9R0.55 CC(C)CCSCC(F)F 62a_100011934356_100000210312 [1,0,0,0,0,1|2,0,0]=4 4308 B9R0.55 CC(C)CCSC[C@@H](C)O 62a_100000210312_100009817552 [1,0,0,0,0,1|1,0,0]=3 4309 B9R0.55 CC(C)CCSC[C@@H](C)O 62a_100009817552_100000210312 [1,0,0,0,0,1|1,0,0]=3 4310 B9R0.55 CC(C)CNCCC(=O)N 2230a_100000210953_100000744528 [1,0,0,0,0,1|1,0,1]=4 4311 B9R0.55 CC(C)CNCCC(=O)N 34a_100000210953_100000731001 [1,0,0,0,0,1|1,0,1]=4 4312 B9R0.55 CC(C)CNCCC(C)O 2230a_100000210953_100012276601 [1,0,0,0,0,1|1,0,0]=3 4313 B9R0.55 CC(C)CNCCC(C)O 2230a_200000755665_100000210760 [1,0,0,0,0,1|1,0,0]=3 4314 B9R0.55 CC(C)CNCCC(C)O 270004a_200000755665_100000210432 [1,0,0,0,0,1|1,0,0]=3 4315 B9R0.55 CC(C)CNCCC(C)O 34a_100000210953_100012276601 [1,0,0,0,0,1|1,0,0]=3 4316 B9R0.55 CC(C)CNCCN(C)C 270004a_100000210585_100000210432 [1,0,0,0,0,1|2,0,0]=4 4317 B9R0.55 CC(C)CNCOC(C)C 2230a_100000210953_100000709892 [1,0,0,0,0,1|2,0,0]=4 4318 B9R0.55 CC(C)CNCOC(C)C 34a_100000210953_100000709892 [1,0,0,0,0,1|2,0,0]=4 4319 B9R0.55 CC(C)COCCC(=O)N 34a_100000210257_100000731001 [1,0,0,0,0,1|1,0,1]=4 4320 B9R0.55 CC(C)COCCC(=O)N 34a_100000757172_100000210624 [1,0,0,0,0,1|1,0,1]=4 4321 B9R0.55 CC(C)COCCC(=O)N 7a_100000757172_100000210760 [1,0,0,0,0,1|1,0,1]=4 4322 B9R0.55 CC(C)COCCC(C)Br 34a_100009893172_100000210624 [1,0,0,0,0,1|1,0,0]=3 4323 B9R0.55 CC(C)COCCC(C)O 34a_100000210257_100012276601 [1,0,0,0,0,1|1,0,0]=3 4324 B9R0.55 CC(C)COCCC(F)F 34a_100103093639_100000210624 [1,0,0,0,0,1|2,0,0]=4 4325 B9R0.55 CC(C)COCC[C@@H](C)N 34a_100000706166_100000210624 [1,0,0,0,0,1|0,0,0]=2 4326 B9R0.55 CC(C)COCOC(C)C 34a_100000210257_100000709892 [1,0,0,0,0,1|2,0,0]=4 4327 B9R0.55 CC(C)CSCCC(=O)N 62a_100000210624_100000744528 [1,0,0,0,0,1|1,0,1]=4 4328 B9R0.55 CC(C)CSCCC(=O)N 62a_100000744528_100000210760 [1,0,0,0,0,1|1,0,1]=4 4329 B9R0.55 CC(C)CSCCC(C)O 62a_100000210624_100012276601 [1,0,0,0,0,1|1,0,0]=3 4330 B9R0.55 CC(C)CSCCC(C)O 62a_100012276601_100000210760 [1,0,0,0,0,1|1,0,0]=3 4331 B9R0.55 CC(C)CSCCN(C)C 62a_100000210624_100000755713 [1,0,0,0,0,1|2,0,0]=4 4332 B9R0.55 CC(C)CSCOC(C)C 62a_100000210624_100000709892 [1,0,0,0,0,1|2,0,0]=4 4333 B9R0.55 CC(C)CSCOC(C)C 62a_100000709892_100000210760 [1,0,0,0,0,1|2,0,0]=4 4334 B9R0.55 CC(C)NCCCC(=O)N 34a_100000739312_100000210206 [1,0,0,0,0,1|1,0,1]=4 4335 B9R0.55 CC(C)NCCCC(=O)N 34a_100138425928_100102525003 [1,0,0,0,0,1|1,0,1]=4 4336 B9R0.55 CC(C)NCCCS(=O)C 2230a_200000753449_100000210206 [1,0,0,0,0,1|2,0,0]=4 4337 B9R0.55 CC(C)NCCOC(C)C 2230a_100000701111_100000210206 [1,0,0,0,0,1|2,0,0]=4 4338 B9R0.55 CC(C)NCCOC(C)C 2230a_100138425928_100000211751 [1,0,0,0,0,1|2,0,0]=4 4339 B9R0.55 CC(C)NCCOC(C)C 34a_100000224655_100000210206 [1,0,0,0,0,1|2,0,0]=4 4340 B9R0.55 CC(C)NCCOC(C)C 34a_100000701111_100000210206 [1,0,0,0,0,1|2,0,0]=4 4341 B9R0.55 CC(C)NCCOC(C)C 34a_100138425928_100000211751 [1,0,0,0,0,1|2,0,0]=4 4342 B9R0.55 CC(C)NCCSC(C)C 2230a_100000731138_100000210206 [1,0,0,0,0,1|2,0,0]=4 4343 B9R0.55 CC(C)NCCSC(C)C 2230a_100138425928_100000730970 [1,0,0,0,0,1|2,0,0]=4 4344 B9R0.55 CC(C)NCCSC(C)C 34a_100000731138_100000210206 [1,0,0,0,0,1|2,0,0]=4 4345 B9R0.55 CC(C)NCCSC(C)C 34a_100138425928_100000730970 [1,0,0,0,0,1|2,0,0]=4 4346 B9R0.55 CC(C)OCCCC(=O)N 34a_100000212225_100102525003 [1,0,0,0,0,1|1,0,1]=4 4347 B9R0.55 CC(C)OCCOC(C)C 34a_100000211219_100000210206 [1,0,0,0,0,1|2,0,0]=4 4348 B9R0.55 CC(C)OCCOC(C)C 34a_100000212225_100000211751 [1,0,0,0,0,1|2,0,0]=4 4349 B9R0.55 CC(C)OCCOC(C)C 7a_100000211219_100000210206 [1,0,0,0,0,1|2,0,0]=4 4350 B9R0.55 CC(C)OCCSC(C)C 34a_100000212225_100000730970 [1,0,0,0,0,1|2,0,0]=4 4351 B9R0.55 CC(C)OCCSC(C)C 34a_200011212901_100000210206 [1,0,0,0,0,1|2,0,0]=4 4352 B9R0.55 CC(C)OCCSC(C)C 62a_100000210206_100000211751 [1,0,0,0,0,1|2,0,0]=4 4353 B9R0.55 CC(C)OCCSC(C)C 62a_100000211751_100000210206 [1,0,0,0,0,1|2,0,0]=4 4354 B9R0.55 CC(C)OCCSC(C)C 7a_200011212901_100000210206 [1,0,0,0,0,1|2,0,0]=4 4355 B9R0.55 CC(C)OCOC[C@@H](C)Cl 34a_100016084084_100000709892 [1,0,0,0,0,1|2,0,0]=4 4356 B9R0.55 CC(C)OCOC[C@@H](C)N 34a_100000737577_100000709892 [1,0,0,0,0,1|1,0,0]=3 4357 B9R0.55 CC(C)OCSC[C@@H](C)O 62a_100000709892_100009817552 [1,0,0,0,0,1|2,0,0]=4 4358 B9R0.55 CC(C)OCSC[C@@H](C)O 62a_100009817552_100000709892 [1,0,0,0,0,1|2,0,0]=4 4359 B9R0.55 CC(C)SCCCC(=O)N 62a_100000210206_100102525003 [1,0,0,0,0,1|1,0,1]=4 4360 B9R0.55 CC(C)SCCCC(=O)N 62a_100102525003_100000210206 [1,0,0,0,0,1|1,0,1]=4 4361 B9R0.55 CC(C)SCCCN(C)C 62a_100000210206_100000757444 [1,0,0,0,0,1|2,0,0]=4 4362 B9R0.55 CC(C)SCCSC(C)C 62a_100000210206_100000730970 [1,0,0,0,0,1|2,0,0]=4 4363 B9R0.55 CC(C)SCCSC(C)C 62a_100000730970_100000210206 [1,0,0,0,0,1|2,0,0]=4 4364 B9R0.55 CC(F)COCOC(C)C 34a_100015925927_100000709892 [1,0,0,0,0,1|2,0,0]=4 4365 B9R0.55 CC(O)CCCNC(C)C 2230a_100138425928_200000718107 [1,0,0,0,0,1|1,0,0]=3 4366 B9R0.55 CC(O)CCCNC(C)C 34a_100138425928_200000718107 [1,0,0,0,0,1|1,0,0]=3 4367 B9R0.55 CC(O)CCCOC(C)C 34a_100000212225_200000718107 [1,0,0,0,0,1|1,0,0]=3 4368 B9R0.55 CC(O)CCCSC(C)C 62a_100000210206_200000718107 [1,0,0,0,0,1|1,0,0]=3 4369 B9R0.55 CC(O)CCCSC(C)C 62a_200000718107_100000210206 [1,0,0,0,0,1|1,0,0]=3 4370 B9R0.55 CC(O)CCNCC(=O)N 2230a_100000711301_100012276601 [1,0,0,0,0,1|1,0,1]=4 4371 B9R0.55 CC(O)CCNCC(=O)N 2230a_200000755665_100000747473 [1,0,0,0,0,1|1,0,1]=4 4372 B9R0.55 CC(O)CCNCC(C)O 2230a_100000210904_100012276601 [1,0,0,0,0,1|1,0,0]=3 4373 B9R0.55 CC(O)CCNCC(C)O 2230a_200000755665_100011218427 [1,0,0,0,0,1|1,0,0]=3 4374 B9R0.55 CC(O)CCNCC(C)O 34a_100000210904_100012276601 [1,0,0,0,0,1|1,0,0]=3 4375 B9R0.55 CC(O)CCNCC(F)F 2230a_200000755665_100011934356 [1,0,0,0,0,1|2,0,0]=4 4376 B9R0.55 CC(O)CCNCC(F)F 34a_100000765723_100012276601 [1,0,0,0,0,1|2,0,0]=4 4377 B9R0.55 CC(O)CCNC[C@@H](C)O 2230a_200000755665_100009817552 [1,0,0,0,0,1|1,0,0]=3 4378 B9R0.55 CC(O)CCOCC(C)Br 34a_100012180447_100012276601 [1,0,0,0,0,1|1,0,0]=3 4379 B9R0.55 CC(O)CCOCC(C)F 34a_100015925927_100012276601 [1,0,0,0,0,1|1,0,0]=3 4380 B9R0.55 CC(O)CCOCC(F)F 34a_100000743014_100012276601 [1,0,0,0,0,1|2,0,0]=4 4381 B9R0.55 CC(O)CCOC[C@@H](C)Cl 34a_100016084084_100012276601 [1,0,0,0,0,1|1,0,0]=3 4382 B9R0.55 CC(O)CCOC[C@@H](C)N 34a_100000737577_100012276601 [1,0,0,0,0,1|0,0,0]=2 4383 B9R0.55 CC(O)CCSCC(=O)N 62a_100000747473_100012276601 [1,0,0,0,0,1|1,0,1]=4 4384 B9R0.55 CC(O)CCSCC(=O)N 62a_100012276601_100000747473 [1,0,0,0,0,1|1,0,1]=4 4385 B9R0.55 CC(O)CCSCC(C)O 62a_100011218427_100012276601 [1,0,0,0,0,1|1,0,0]=3 4386 B9R0.55 CC(O)CCSCC(C)O 62a_100012276601_100011218427 [1,0,0,0,0,1|1,0,0]=3 4387 B9R0.55 CC(O)CCSCC(F)F 62a_100011934356_100012276601 [1,0,0,0,0,1|2,0,0]=4 4388 B9R0.55 CC(O)CCSCC(F)F 62a_100012276601_100011934356 [1,0,0,0,0,1|2,0,0]=4 4389 B9R0.55 CC(O)CCSC[C@@H](C)O 62a_100009817552_100012276601 [1,0,0,0,0,1|1,0,0]=3 4390 B9R0.55 CC(O)CCSC[C@@H](C)O 62a_100012276601_100009817552 [1,0,0,0,0,1|1,0,0]=3 4391 B9R0.55 CC(O)CNCCC(=O)N 2230a_100000210904_100000744528 [1,0,0,0,0,1|1,0,1]=4 4392 B9R0.55 CC(O)CNCCC(=O)N 34a_100000210904_100000731001 [1,0,0,0,0,1|1,0,1]=4 4393 B9R0.55 CC(O)CNCOC(C)C 2230a_100000210904_100000709892 [1,0,0,0,0,1|2,0,0]=4 4394 B9R0.55 CC(O)CNCOC(C)C 34a_100000210904_100000709892 [1,0,0,0,0,1|2,0,0]=4 4395 B9R0.55 CC(O)COCCC(=O)N 34a_100000757172_100011218427 [1,0,0,0,0,1|1,0,1]=4 4396 B9R0.55 CC(O)COCCC(=O)N 7a_100000757172_100011218427 [1,0,0,0,0,1|1,0,1]=4 4397 B9R0.55 CC(O)COCCC(C)Br 34a_100009893172_100011218427 [1,0,0,0,0,1|1,0,0]=3 4398 B9R0.55 CC(O)COCCC(F)F 34a_100103093639_100011218427 [1,0,0,0,0,1|2,0,0]=4 4399 B9R0.55 CC(O)COCC[C@@H](C)N 34a_100000706166_100011218427 [1,0,0,0,0,1|0,0,0]=2 4400 B9R0.55 CC(O)CSCCC(=O)N 62a_100000744528_100011218427 [1,0,0,0,0,1|1,0,1]=4 4401 B9R0.55 CC(O)CSCCC(=O)N 62a_100011218427_100000744528 [1,0,0,0,0,1|1,0,1]=4 4402 B9R0.55 CC(O)CSCCN(C)C 62a_100011218427_100000755713 [1,0,0,0,0,1|2,0,0]=4 4403 B9R0.55 CC(O)CSCOC(C)C 62a_100000709892_100011218427 [1,0,0,0,0,1|2,0,0]=4 4404 B9R0.55 CC(O)CSCOC(C)C 62a_100011218427_100000709892 [1,0,0,0,0,1|2,0,0]=4 4405 B9R0.55 C[C@@H](N)CCOCC(F)F 34a_100000706166_100011934356 [1,0,0,0,0,1|2,0,0]=4 4406 B9R0.55 C[C@@H](N)CCOC[C@@H](C)O 34a_100000706166_100009817552 [1,0,0,0,0,1|0,0,0]=2 4407 B9R0.55 C[C@@H](O)COCCC(=O)N 34a_100000757172_100009817552 [1,0,0,0,0,1|1,0,1]=4 4408 B9R0.55 C[C@@H](O)COCCC(=O)N 7a_100000757172_100009817552 [1,0,0,0,0,1|1,0,1]=4 4409 B9R0.55 C[C@@H](O)COCCC(F)F 34a_100103093639_100009817552 [1,0,0,0,0,1|2,0,0]=4 4410 B9R0.55 C[C@@H](O)CSCCC(=O)N 62a_100000744528_100009817552 [1,0,0,0,0,1|1,0,1]=4 4411 B9R0.55 C[C@@H](O)CSCCC(=O)N 62a_100009817552_100000744528 [1,0,0,0,0,1|1,0,1]=4 4412 B9R0.55 C[C@@H](O)CSCCN(C)C 62a_100009817552_100000755713 [1,0,0,0,0,1|2,0,0]=4 4413 B11R0.31 C=C(C)CCOCCC(C)(C)O 34a_100000764851_100000702414 [0,0,0,0,0,2|1,0,1]=4 4414 B11R0.31 C=C(C)CCSCCC(C)(C)O 62a_100000702414_100000730704 [0,0,0,0,0,2|1,0,1]=4 4415 B11R0.31 C=C(C)CCSCCC(C)(C)O 62a_100000730704_100000702414 [0,0,0,0,0,2|1,0,1]=4 4416 B11R0.31 C=C(C)COCCCC(C)(C)O 34a_100000210245_100009888830 [0,0,0,0,0,2|1,0,1]=4 4417 B11R0.31 C=C(C)CSCCCC(C)(C)O 62a_100000748629_100009888830 [0,0,0,0,0,2|1,0,1]=4 4418 B11R0.31 C=C(C)CSCCCC(C)(C)O 62a_100009888830_100000211660 [0,0,0,0,0,2|1,0,1]=4 4419 B11R0.31 CC(=CCCNCC(C)(C)O)C 2230a_100000751335_100011217483 [0,0,0,0,0,2|1,0,1]=4 4420 B11R0.31 CC(=CCCSCC(C)(C)O)C 62a_100000764493_100011217483 [0,0,0,0,0,2|1,0,1]=4 4421 B11R0.31 CC(=CCCSCC(C)(C)O)C 62a_100011217483_100000764493 [0,0,0,0,0,2|1,0,1]=4 4422 B11R0.31 CC(=CCNCCC(C)(C)O)C 34a_100000718196_100000702414 [0,0,0,0,0,2|1,0,1]=4 4423 B11R0.31 CC(=CCOCCC(C)(C)O)C 34a_100000753907_100000702414 [0,0,0,0,0,2|1,0,1]=4 4424 B11R0.31 CC(=CCSCCC(C)(C)O)C 62a_100000702414_100000761012 [0,0,0,0,0,2|1,0,1]=4 4425 B11R0.31 CC(=CCSCCC(C)(C)O)C 62a_100000761012_100000702414 [0,0,0,0,0,2|1,0,1]=4 4426 B11R0.31 CC(=O)CCCOCC(C)(C)O 34a_100000759063_100000764493 [0,0,0,0,0,2|1,0,1]=4 4427 B11R0.31 CC(=O)CCCOCC(C)(C)O 7a_100000759063_100000764493 [0,0,0,0,0,2|1,0,1]=4 4428 B11R0.31 CC(=O)CCCSCC(C)(C)O 62a_100000764493_100011215641 [0,0,0,0,0,2|1,0,1]=4 4429 B11R0.31 CC(=O)CCCSCC(C)(C)O 62a_100011215641_100000764493 [0,0,0,0,0,2|1,0,1]=4 4430 B11R0.31 CC(=O)CCOCCC(C)(C)O 34a_100000759926_100000702414 [0,0,0,0,0,2|1,0,1]=4 4431 B11R0.31 CC(=O)CCOCCC(C)(C)O 7a_100000759926_100000702414 [0,0,0,0,0,2|1,0,1]=4 4432 B11R0.31 CC(=O)CCSCCC(C)(C)O 62a_100000053229_100000702414 [0,0,0,0,0,2|1,0,1]=4 4433 B11R0.31 CC(=O)CCSCCC(C)(C)O 62a_100000702414_100000053229 [0,0,0,0,0,2|1,0,1]=4 4434 B11R0.31 CC(=O)COCCCC(C)(C)O 34a_100000211253_100009888830 [0,0,0,0,0,2|1,0,1]=4 4435 B11R0.31 CC(=O)NCCNCC(C)(C)O 2230a_100000751335_100000189650 [0,0,0,0,0,2|1,0,1]=4 4436 B11R0.31 CC(=O)NCCOCC(C)(C)O 34a_100000158858_100000764493 [0,0,0,0,0,2|1,0,1]=4 4437 B11R0.31 CC(=O)NCCSCC(C)(C)O 62a_100000189650_100000764493 [0,0,0,0,0,2|1,0,1]=4 4438 B11R0.31 CC(=O)NCCSCC(C)(C)O 62a_100000764493_100000189650 [0,0,0,0,0,2|1,0,1]=4 4439 B11R0.31 CC(=O)OCCSCC(C)(C)O 62a_100000764493_100009814007 [0,0,0,0,0,2|1,0,1]=4 4440 B11R0.31 CC(=O)OCCSCC(C)(C)O 62a_100009814007_100000764493 [0,0,0,0,0,2|1,0,1]=4 4441 B11R0.31 CC(=O)OCSCCC(C)(C)O 62a_100000076356_100000702414 [0,0,0,0,0,2|1,0,1]=4 4442 B11R0.31 CC(=O)OCSCCC(C)(C)O 62a_100000702414_100000076356 [0,0,0,0,0,2|1,0,1]=4 4443 B11R0.31 CC(Br)CCOCCC(C)(C)C 34a_100009893172_100000755188 [0,0,0,0,0,2|2,0,0]=4 4444 B11R0.31 CC(Br)CCOCCC(C)(C)O 34a_100009893172_100000702414 [0,0,0,0,0,2|1,0,0]=3 4445 B11R0.31 CC(Br)COCCCC(C)(C)O 34a_100012180447_100009888830 [0,0,0,0,0,2|1,0,0]=3 4446 B11R0.31 CC(C)(O)CCCNCC(=O)N 2230a_100000711301_100009888830 [0,0,0,0,0,2|1,0,1]=4 4447 B11R0.31 CC(C)(O)CCCNCC(F)F 34a_100000765723_100009888830 [0,0,0,0,0,2|2,0,0]=4 4448 B11R0.31 CC(C)(O)CCCOCC(F)F 34a_100000743014_100009888830 [0,0,0,0,0,2|2,0,0]=4 4449 B11R0.31 CC(C)(O)CCCSCC(=O)N 62a_100000747473_100009888830 [0,0,0,0,0,2|1,0,1]=4 4450 B11R0.31 CC(C)(O)CCCSCC(=O)N 62a_100009888830_100000747473 [0,0,0,0,0,2|1,0,1]=4 4451 B11R0.31 CC(C)(O)CCCSCC(F)F 62a_100009888830_100011934356 [0,0,0,0,0,2|2,0,0]=4 4452 B11R0.31 CC(C)(O)CCCSCC(F)F 62a_100011934356_100009888830 [0,0,0,0,0,2|2,0,0]=4 4453 B11R0.31 CC(C)(O)CCOCCC(=O)N 34a_100000757172_100000702414 [0,0,0,0,0,2|1,0,1]=4 4454 B11R0.31 CC(C)(O)CCOCCC(=O)N 7a_100000757172_100000702414 [0,0,0,0,0,2|1,0,1]=4 4455 B11R0.31 CC(C)(O)CCOCCC(F)F 34a_100103093639_100000702414 [0,0,0,0,0,2|2,0,0]=4 4456 B11R0.31 CC(C)(O)CCSCCC(=O)N 62a_100000702414_100000744528 [0,0,0,0,0,2|1,0,1]=4 4457 B11R0.31 CC(C)(O)CCSCCC(=O)N 62a_100000744528_100000702414 [0,0,0,0,0,2|1,0,1]=4 4458 B11R0.31 CC(C)(O)CNCCCC(=O)N 34a_100000739312_100000764493 [0,0,0,0,0,2|1,0,1]=4 4459 B11R0.31 CC(C)(O)CNCCNC(=O)N 2230a_100000751335_200000034859 [0,0,0,0,0,2|1,0,1]=4 4460 B11R0.31 CC(C)(O)CNCCNC(=O)N 34a_100020590234_100000764493 [0,0,0,0,0,2|1,0,1]=4 4461 B11R0.31 CC(C)(O)COCCNC(=O)N 34a_100000181757_100000764493 [0,0,0,0,0,2|1,0,1]=4 4462 B11R0.31 CC(C)(O)COCCOC(=O)N 7a_100000766696_100000764493 [0,0,0,0,0,2|1,0,1]=4 4463 B11R0.31 CC(C)(O)CSCCCC(=O)N 62a_100000764493_100102525003 [0,0,0,0,0,2|1,0,1]=4 4464 B11R0.31 CC(C)(O)CSCCCC(=O)N 62a_100102525003_100000764493 [0,0,0,0,0,2|1,0,1]=4 4465 B11R0.31 CC(C)(O)CSCCNC(=O)N 62a_100000764493_200000034859 [0,0,0,0,0,2|1,0,1]=4 4466 B11R0.31 CC(C)(O)CSCCNC(=O)N 62a_200000034859_100000764493 [0,0,0,0,0,2|1,0,1]=4 4467 B11R0.31 CC(C)(O)CSCCOC(=O)N 62a_100000764493_200011214921 [0,0,0,0,0,2|1,0,1]=4 4468 B11R0.31 CC(C)(O)CSCCOC(=O)N 62a_200011214921_100000764493 [0,0,0,0,0,2|1,0,1]=4 4469 B11R0.31 CC(C)CCCCNC(C)(C)C 2230a_100000715429_100011216152 [0,0,0,0,0,2|2,0,0]=4 4470 B11R0.31 CC(C)CCCCOC(C)(C)C 34a_100011214890_100000210625 [0,0,0,0,0,2|2,0,0]=4 4471 B11R0.31 CC(C)CCCCOC(C)(C)C 34a_100015890283_100011216152 [0,0,0,0,0,2|2,0,0]=4 4472 B11R0.31 CC(C)CCCCOC(C)(C)C 7a_100015890283_100011216152 [0,0,0,0,0,2|2,0,0]=4 4473 B11R0.31 CC(C)CCCCSC(C)(C)C 62a_100000211941_100011216152 [0,0,0,0,0,2|2,0,0]=4 4474 B11R0.31 CC(C)CCCCSC(C)(C)C 62a_100011216152_100000211941 [0,0,0,0,0,2|2,0,0]=4 4475 B11R0.31 CC(C)CCCNCC(C)(C)C 2230a_100000743828_100011214892 [0,0,0,0,0,2|2,0,0]=4 4476 B11R0.31 CC(C)CCCNCC(C)(C)C 270004a_200000737386_100011204126 [0,0,0,0,0,2|2,0,0]=4 4477 B11R0.31 CC(C)CCCNCC(C)(C)C 34a_200000737386_100011219605 [0,0,0,0,0,2|2,0,0]=4 4478 B11R0.31 CC(C)CCCNCC(C)(C)F 2230a_100020643315_100011214892 [0,0,0,0,0,2|2,0,0]=4 4479 B11R0.31 CC(C)CCCNCC(C)(C)F 34a_200000737386_100011997219 [0,0,0,0,0,2|2,0,0]=4 4480 B11R0.31 CC(C)CCCNCC(C)(C)O 2230a_100000751335_100011214892 [0,0,0,0,0,2|1,0,0]=3 4481 B11R0.31 CC(C)CCCNCC(C)(C)O 34a_200000737386_100000764493 [0,0,0,0,0,2|1,0,0]=3 4482 B11R0.31 CC(C)CCCOCC(C)(C)C 34a_100000210774_100011219605 [0,0,0,0,0,2|2,0,0]=4 4483 B11R0.31 CC(C)CCCOCC(C)(C)F 34a_100000210774_100011997219 [0,0,0,0,0,2|2,0,0]=4 4484 B11R0.31 CC(C)CCCOCC(C)(C)F 34a_100000716592_100011214892 [0,0,0,0,0,2|2,0,0]=4 4485 B11R0.31 CC(C)CCCOCC(C)(C)O 34a_100000210774_100000764493 [0,0,0,0,0,2|1,0,0]=3 4486 B11R0.31 CC(C)CCCOCC(C)(C)O 7a_100000210774_100000764493 [0,0,0,0,0,2|1,0,0]=3 4487 B11R0.31 CC(C)CCCSCC(C)(C)C 62a_100011214892_100011219605 [0,0,0,0,0,2|2,0,0]=4 4488 B11R0.31 CC(C)CCCSCC(C)(C)C 62a_100011219605_100011214892 [0,0,0,0,0,2|2,0,0]=4 4489 B11R0.31 CC(C)CCCSCC(C)(C)F 62a_100011214892_100011997219 [0,0,0,0,0,2|2,0,0]=4 4490 B11R0.31 CC(C)CCCSCC(C)(C)F 62a_100011997219_100011214892 [0,0,0,0,0,2|2,0,0]=4 4491 B11R0.31 CC(C)CCCSCC(C)(C)O 62a_100000764493_100011214892 [0,0,0,0,0,2|1,0,0]=3 4492 B11R0.31 CC(C)CCCSCC(C)(C)O 62a_100011214892_100000764493 [0,0,0,0,0,2|1,0,0]=3 4493 B11R0.31 CC(C)CCNCCC(C)(C)C 2230a_100000738805_100000210312 [0,0,0,0,0,2|2,0,0]=4 4494 B11R0.31 CC(C)CCNCCC(C)(C)C 269862a_100000738805_100000185833 [0,0,0,0,0,2|2,0,0]=4 4495 B11R0.31 CC(C)CCNCCC(C)(C)F 2230a_100016253952_100000210312 [0,0,0,0,0,2|2,0,0]=4 4496 B11R0.31 CC(C)CCNCCC(C)(C)F 269862a_100016253952_100000185833 [0,0,0,0,0,2|2,0,0]=4 4497 B11R0.31 CC(C)CCNCCC(C)(C)O 269862a_100000707701_100000185833 [0,0,0,0,0,2|1,0,0]=3 4498 B11R0.31 CC(C)CCOCCC(C)(C)C 34a_100000210254_100000755188 [0,0,0,0,0,2|2,0,0]=4 4499 B11R0.31 CC(C)CCOCCC(C)(C)C 7a_100000210254_100000755188 [0,0,0,0,0,2|2,0,0]=4 4500 B11R0.31 CC(C)CCOCCC(C)(C)C 7a_100000765024_100000210626 [0,0,0,0,0,2|2,0,0]=4 4501 B11R0.31 CC(C)CCOCCC(C)(C)O 34a_100000210254_100000702414 [0,0,0,0,0,2|1,0,0]=3 4502 B11R0.31 CC(C)CCOCCC(C)(C)O 7a_100000210254_100000702414 [0,0,0,0,0,2|1,0,0]=3 4503 B11R0.31 CC(C)CCSCCC(C)(C)C 62a_100000210312_100000755188 [0,0,0,0,0,2|2,0,0]=4 4504 B11R0.31 CC(C)CCSCCC(C)(C)C 62a_100000755188_100000210312 [0,0,0,0,0,2|2,0,0]=4 4505 B11R0.31 CC(C)CCSCCC(C)(C)O 62a_100000210312_100000702414 [0,0,0,0,0,2|1,0,0]=3 4506 B11R0.31 CC(C)CCSCCC(C)(C)O 62a_100000702414_100000210312 [0,0,0,0,0,2|1,0,0]=3 4507 B11R0.31 CC(C)CNCCCC(C)(C)O 2230a_100000210953_100009888830 [0,0,0,0,0,2|1,0,0]=3 4508 B11R0.31 CC(C)CNCCCC(C)(C)O 34a_100000210953_100009888830 [0,0,0,0,0,2|1,0,0]=3 4509 B11R0.31 CC(C)CNCCOC(C)(C)C 2230a_100000747557_100000210760 [0,0,0,0,0,2|2,0,0]=4 4510 B11R0.31 CC(C)CNCCOC(C)(C)C 270004a_100000747557_100000210432 [0,0,0,0,0,2|2,0,0]=4 4511 B11R0.31 CC(C)CNCCOC(C)(C)C 34a_100015185251_100000210625 [0,0,0,0,0,2|2,0,0]=4 4512 B11R0.31 CC(C)CNCCSC(C)(C)C 2230a_100000689375_100000210760 [0,0,0,0,0,2|2,0,0]=4 4513 B11R0.31 CC(C)CNCCSC(C)(C)C 270004a_100000689375_100000210432 [0,0,0,0,0,2|2,0,0]=4 4514 B11R0.31 CC(C)COCCCC(C)(C)O 34a_100000210257_100009888830 [0,0,0,0,0,2|1,0,0]=3 4515 B11R0.31 CC(C)COCCOC(C)(C)C 34a_100000693234_100000210624 [0,0,0,0,0,2|2,0,0]=4 4516 B11R0.31 CC(C)COCCOC(C)(C)C 34a_100000703358_100000210625 [0,0,0,0,0,2|2,0,0]=4 4517 B11R0.31 CC(C)COCCOC(C)(C)C 7a_100000693234_100000210760 [0,0,0,0,0,2|2,0,0]=4 4518 B11R0.31 CC(C)CSCCCC(C)(C)O 62a_100000210624_100009888830 [0,0,0,0,0,2|1,0,0]=3 4519 B11R0.31 CC(C)CSCCCC(C)(C)O 62a_100009888830_100000210760 [0,0,0,0,0,2|1,0,0]=3 4520 B11R0.31 CC(C)CSCCOC(C)(C)C 34a_200000230437_100000210625 [0,0,0,0,0,2|2,0,0]=4 4521 B11R0.31 CC(C)NCCCOC(C)(C)C 2230a_100011250582_100000210206 [0,0,0,0,0,2|2,0,0]=4 4522 B11R0.31 CC(C)NCCCOC(C)(C)C 34a_100000182298_100000210625 [0,0,0,0,0,2|2,0,0]=4 4523 B11R0.31 CC(C)NCCOCC(C)(C)C 34a_100000224655_100011219605 [0,0,0,0,0,2|2,0,0]=4 4524 B11R0.31 CC(C)NCCOCC(C)(C)F 34a_100000224655_100011997219 [0,0,0,0,0,2|2,0,0]=4 4525 B11R0.31 CC(C)NCCOCC(C)(C)O 34a_100000224655_100000764493 [0,0,0,0,0,2|1,0,0]=3 4526 B11R0.31 CC(C)OCCCNC(C)(C)C 34a_100000737246_100000210625 [0,0,0,0,0,2|2,0,0]=4 4527 B11R0.31 CC(C)OCCNCC(C)(C)C 2230a_100000743828_100000211751 [0,0,0,0,0,2|2,0,0]=4 4528 B11R0.31 CC(C)OCCNCC(C)(C)C 270004a_100000701111_100011204126 [0,0,0,0,0,2|2,0,0]=4 4529 B11R0.31 CC(C)OCCNCC(C)(C)C 34a_100000701111_100011219605 [0,0,0,0,0,2|2,0,0]=4 4530 B11R0.31 CC(C)OCCNCC(C)(C)F 2230a_100020643315_100000211751 [0,0,0,0,0,2|2,0,0]=4 4531 B11R0.31 CC(C)OCCNCC(C)(C)F 34a_100000701111_100011997219 [0,0,0,0,0,2|2,0,0]=4 4532 B11R0.31 CC(C)OCCNCC(C)(C)O 2230a_100000751335_100000211751 [0,0,0,0,0,2|1,0,0]=3 4533 B11R0.31 CC(C)OCCNCC(C)(C)O 34a_100000701111_100000764493 [0,0,0,0,0,2|1,0,0]=3 4534 B11R0.31 CC(C)OCCOCC(C)(C)C 34a_100000211219_100011219605 [0,0,0,0,0,2|2,0,0]=4 4535 B11R0.31 CC(C)OCCOCC(C)(C)F 34a_100000211219_100011997219 [0,0,0,0,0,2|2,0,0]=4 4536 B11R0.31 CC(C)OCCOCC(C)(C)F 34a_100000716592_100000211751 [0,0,0,0,0,2|2,0,0]=4 4537 B11R0.31 CC(C)OCCOCC(C)(C)O 34a_100000211219_100000764493 [0,0,0,0,0,2|1,0,0]=3 4538 B11R0.31 CC(C)OCCOCC(C)(C)O 7a_100000211219_100000764493 [0,0,0,0,0,2|1,0,0]=3 4539 B11R0.31 CC(C)OCCSCC(C)(C)C 62a_100000211751_100011219605 [0,0,0,0,0,2|2,0,0]=4 4540 B11R0.31 CC(C)OCCSCC(C)(C)C 62a_100011219605_100000211751 [0,0,0,0,0,2|2,0,0]=4 4541 B11R0.31 CC(C)OCCSCC(C)(C)F 62a_100000211751_100011997219 [0,0,0,0,0,2|2,0,0]=4 4542 B11R0.31 CC(C)OCCSCC(C)(C)F 62a_100011997219_100000211751 [0,0,0,0,0,2|2,0,0]=4 4543 B11R0.31 CC(C)OCCSCC(C)(C)O 62a_100000211751_100000764493 [0,0,0,0,0,2|1,0,0]=3 4544 B11R0.31 CC(C)OCCSCC(C)(C)O 62a_100000764493_100000211751 [0,0,0,0,0,2|1,0,0]=3 4545 B11R0.31 CC(C)OCNCCC(C)(C)C 2230a_100000738805_100000709892 [0,0,0,0,0,2|2,0,0]=4 4546 B11R0.31 CC(C)OCNCCC(C)(C)F 2230a_100016253952_100000709892 [0,0,0,0,0,2|2,0,0]=4 4547 B11R0.31 CC(C)OCSCCC(C)(C)C 62a_100000709892_100000755188 [0,0,0,0,0,2|2,0,0]=4 4548 B11R0.31 CC(C)OCSCCC(C)(C)C 62a_100000755188_100000709892 [0,0,0,0,0,2|2,0,0]=4 4549 B11R0.31 CC(C)OCSCCC(C)(C)O 62a_100000702414_100000709892 [0,0,0,0,0,2|1,0,0]=3 4550 B11R0.31 CC(C)OCSCCC(C)(C)O 62a_100000709892_100000702414 [0,0,0,0,0,2|1,0,0]=3 4551 B11R0.31 CC(C)SCCNCC(C)(C)C 2230a_100000743828_100000730970 [0,0,0,0,0,2|2,0,0]=4 4552 B11R0.31 CC(C)SCCNCC(C)(C)C 270004a_100000731138_100011204126 [0,0,0,0,0,2|2,0,0]=4 4553 B11R0.31 CC(C)SCCNCC(C)(C)C 34a_100000731138_100011219605 [0,0,0,0,0,2|2,0,0]=4 4554 B11R0.31 CC(C)SCCNCC(C)(C)F 2230a_100020643315_100000730970 [0,0,0,0,0,2|2,0,0]=4 4555 B11R0.31 CC(C)SCCNCC(C)(C)F 34a_100000731138_100011997219 [0,0,0,0,0,2|2,0,0]=4 4556 B11R0.31 CC(C)SCCNCC(C)(C)O 2230a_100000751335_100000730970 [0,0,0,0,0,2|1,0,0]=3 4557 B11R0.31 CC(C)SCCNCC(C)(C)O 34a_100000731138_100000764493 [0,0,0,0,0,2|1,0,0]=3 4558 B11R0.31 CC(C)SCCOCC(C)(C)C 34a_200011212901_100011219605 [0,0,0,0,0,2|2,0,0]=4 4559 B11R0.31 CC(C)SCCOCC(C)(C)F 34a_100000716592_100000730970 [0,0,0,0,0,2|2,0,0]=4 4560 B11R0.31 CC(C)SCCOCC(C)(C)F 34a_200011212901_100011997219 [0,0,0,0,0,2|2,0,0]=4 4561 B11R0.31 CC(C)SCCOCC(C)(C)O 34a_200011212901_100000764493 [0,0,0,0,0,2|1,0,0]=3 4562 B11R0.31 CC(C)SCCOCC(C)(C)O 7a_200011212901_100000764493 [0,0,0,0,0,2|1,0,0]=3 4563 B11R0.31 CC(C)SCCSCC(C)(C)C 62a_100000730970_100011219605 [0,0,0,0,0,2|2,0,0]=4 4564 B11R0.31 CC(C)SCCSCC(C)(C)C 62a_100011219605_100000730970 [0,0,0,0,0,2|2,0,0]=4 4565 B11R0.31 CC(C)SCCSCC(C)(C)F 62a_100000730970_100011997219 [0,0,0,0,0,2|2,0,0]=4 4566 B11R0.31 CC(C)SCCSCC(C)(C)F 62a_100011997219_100000730970 [0,0,0,0,0,2|2,0,0]=4 4567 B11R0.31 CC(C)SCCSCC(C)(C)O 62a_100000730970_100000764493 [0,0,0,0,0,2|1,0,0]=3 4568 B11R0.31 CC(C)SCCSCC(C)(C)O 62a_100000764493_100000730970 [0,0,0,0,0,2|1,0,0]=3 4569 B11R0.31 CC(F)COCCCC(C)(C)O 34a_100015925927_100009888830 [0,0,0,0,0,2|1,0,0]=3 4570 B11R0.31 CC(O)CCCNCC(C)(C)C 2230a_100000743828_200000718107 [0,0,0,0,0,2|2,0,0]=4 4571 B11R0.31 CC(O)CCCNCC(C)(C)F 2230a_100020643315_200000718107 [0,0,0,0,0,2|2,0,0]=4 4572 B11R0.31 CC(O)CCCNCC(C)(C)O 2230a_100000751335_200000718107 [0,0,0,0,0,2|1,0,0]=3 4573 B11R0.31 CC(O)CCCOCC(C)(C)F 34a_100000716592_200000718107 [0,0,0,0,0,2|2,0,0]=4 4574 B11R0.31 CC(O)CCCSCC(C)(C)C 62a_100011219605_200000718107 [0,0,0,0,0,2|2,0,0]=4 4575 B11R0.31 CC(O)CCCSCC(C)(C)C 62a_200000718107_100011219605 [0,0,0,0,0,2|2,0,0]=4 4576 B11R0.31 CC(O)CCCSCC(C)(C)F 62a_100011997219_200000718107 [0,0,0,0,0,2|2,0,0]=4 4577 B11R0.31 CC(O)CCCSCC(C)(C)F 62a_200000718107_100011997219 [0,0,0,0,0,2|2,0,0]=4 4578 B11R0.31 CC(O)CCCSCC(C)(C)O 62a_100000764493_200000718107 [0,0,0,0,0,2|1,0,0]=3 4579 B11R0.31 CC(O)CCCSCC(C)(C)O 62a_200000718107_100000764493 [0,0,0,0,0,2|1,0,0]=3 4580 B11R0.31 CC(O)CCNCCC(C)(C)C 2230a_100000738805_100012276601 [0,0,0,0,0,2|2,0,0]=4 4581 B11R0.31 CC(O)CCNCCC(C)(C)C 2230a_200000755665_100000755188 [0,0,0,0,0,2|2,0,0]=4 4582 B11R0.31 CC(O)CCNCCC(C)(C)F 2230a_100016253952_100012276601 [0,0,0,0,0,2|2,0,0]=4 4583 B11R0.31 CC(O)CCNCCC(C)(C)O 2230a_200000755665_100000702414 [0,0,0,0,0,2|1,0,0]=3 4584 B11R0.31 CC(O)CCOCCC(C)(C)C 7a_100000765024_100012276601 [0,0,0,0,0,2|2,0,0]=4 4585 B11R0.31 CC(O)CCSCCC(C)(C)C 62a_100000755188_100012276601 [0,0,0,0,0,2|2,0,0]=4 4586 B11R0.31 CC(O)CCSCCC(C)(C)C 62a_100012276601_100000755188 [0,0,0,0,0,2|2,0,0]=4 4587 B11R0.31 CC(O)CCSCCC(C)(C)O 62a_100000702414_100012276601 [0,0,0,0,0,2|1,0,0]=3 4588 B11R0.31 CC(O)CCSCCC(C)(C)O 62a_100012276601_100000702414 [0,0,0,0,0,2|1,0,0]=3 4589 B11R0.31 CC(O)CNCCCC(C)(C)O 2230a_100000210904_100009888830 [0,0,0,0,0,2|1,0,0]=3 4590 B11R0.31 CC(O)CNCCCC(C)(C)O 34a_100000210904_100009888830 [0,0,0,0,0,2|1,0,0]=3 4591 B11R0.31 CC(O)CNCCOC(C)(C)C 2230a_100000747557_100011218427 [0,0,0,0,0,2|2,0,0]=4 4592 B11R0.31 CC(O)CNCCSC(C)(C)C 2230a_100000689375_100011218427 [0,0,0,0,0,2|2,0,0]=4 4593 B11R0.31 CC(O)COCCOC(C)(C)C 34a_100000693234_100011218427 [0,0,0,0,0,2|2,0,0]=4 4594 B11R0.31 CC(O)COCCOC(C)(C)C 7a_100000693234_100011218427 [0,0,0,0,0,2|2,0,0]=4 4595 B11R0.31 CC(O)CSCCCC(C)(C)O 62a_100009888830_100011218427 [0,0,0,0,0,2|1,0,0]=3 4596 B11R0.31 CC(O)CSCCCC(C)(C)O 62a_100011218427_100009888830 [0,0,0,0,0,2|1,0,0]=3 4597 B11R0.31 CN(C)CCCCCC(C)(C)O 2230a_100102631434_100010402123 [0,0,0,0,0,2|2,0,0]=4 4598 B11R0.31 CN(C)CCCCCC(C)(C)O 269982a_100102631434_100010402123 [0,0,0,0,0,2|2,0,0]=4 4599 B11R0.31 CN(C)CCCSCC(C)(C)O 62a_100000764493_100000757444 [0,0,0,0,0,2|2,0,0]=4 4600 B11R0.31 CN(C)CCSCCC(C)(C)O 62a_100000702414_100000755713 [0,0,0,0,0,2|2,0,0]=4 4601 B11R0.31 C[C@@H](Cl)COCCCC(C)(C)O 34a_100016084084_100009888830 [0,0,0,0,0,2|1,0,0]=3 4602 B11R0.31 C[C@@H](N)CCOCCC(C)(C)C 34a_100000706166_100000755188 [0,0,0,0,0,2|1,0,0]=3 4603 B11R0.31 C[C@@H](N)CCOCCC(C)(C)O 34a_100000706166_100000702414 [0,0,0,0,0,2|0,0,0]=2 4604 B11R0.31 C[C@@H](N)CCOCC[N+](C)(C)C 34a_100000706166_100000085578 [0,0,0,0,0,2|2,0,0]=4 4605 B11R0.31 C[C@@H](N)CCOCC[Si](C)(C)C 34a_100000706166_200000733723 [0,0,0,0,0,2|1,1,0]=4 4606 B11R0.31 C[C@@H](N)COCCCC(C)(C)O 34a_100000737577_100009888830 [0,0,0,0,0,2|0,0,0]=2 4607 B11R0.31 C[C@@H](N)COCCC[N+](C)(C)C 34a_100000737577_100016990835 [0,0,0,0,0,2|2,0,0]=4 4608 B11R0.31 C[C@@H](N)COCCC[Si](C)(C)C 34a_100000737577_100011219597 [0,0,0,0,0,2|1,1,0]=4 4609 B11R0.31 C[C@@H](N)COCCO[Si](C)(C)C 34a_100000737577_200000032530 [0,0,0,0,0,2|1,1,0]=4 4610 B11R0.31 C[C@@H](O)CNCCOC(C)(C)C 2230a_100000747557_100009817552 [0,0,0,0,0,2|2,0,0]=4 4611 B11R0.31 C[C@@H](O)CNCCSC(C)(C)C 2230a_100000689375_100009817552 [0,0,0,0,0,2|2,0,0]=4 4612 B11R0.31 C[C@@H](O)COCCOC(C)(C)C 34a_100000693234_100009817552 [0,0,0,0,0,2|2,0,0]=4 4613 B11R0.31 C[C@@H](O)COCCOC(C)(C)C 7a_100000693234_100009817552 [0,0,0,0,0,2|2,0,0]=4 4614 B11R0.31 C[C@@H](O)CSCCCC(C)(C)O 62a_100009817552_100009888830 [0,0,0,0,0,2|1,0,0]=3 4615 B11R0.31 C[C@@H](O)CSCCCC(C)(C)O 62a_100009888830_100009817552 [0,0,0,0,0,2|1,0,0]=3