0 B10R0.15 C=C(C)CCOCS(=O)(=O)[O-] 34a_100000764851_100009817235 [0,0,0,0,0,0|3,0,1]=4 1 B10R0.15 C=C(C)CCSCS(=O)(=O)N 62a_100000730704_100000741382 [0,0,0,0,0,0|4,0,0]=4 2 B10R0.15 C=C(C)CCSCS(=O)(=O)N 62a_100000741382_100000730704 [0,0,0,0,0,0|4,0,0]=4 3 B10R0.15 C=C(C)CCSCS(=O)(=O)[O-] 62a_100000730704_100009817235 [0,0,0,0,0,0|3,0,1]=4 4 B10R0.15 C=C(C)CCSCS(=O)(=O)[O-] 62a_100009817235_100000730704 [0,0,0,0,0,0|3,0,1]=4 5 B10R0.15 C=C(C)CNCCS(=O)(=O)C 2230a_100000740961_100000748629 [0,0,0,0,0,0|4,0,0]=4 6 B10R0.15 C=C(C)CNCCS(=O)(=O)C 34a_100000740961_100000748629 [0,0,0,0,0,0|4,0,0]=4 7 B10R0.15 C=C(C)CNCCS(=O)(=O)N 2230a_100000738205_100000748629 [0,0,0,0,0,0|4,0,0]=4 8 B10R0.15 C=C(C)CNCCS(=O)(=O)N 34a_100000738205_100000748629 [0,0,0,0,0,0|4,0,0]=4 9 B10R0.15 C=C(C)COCCS(=O)(=O)C 34a_100000210245_100000731031 [0,0,0,0,0,0|4,0,0]=4 10 B10R0.15 C=C(C)COCCS(=O)(=O)C 34a_100000211924_100000748629 [0,0,0,0,0,0|4,0,0]=4 11 B10R0.15 C=C(C)COCCS(=O)(=O)C 7a_100000211924_100000748629 [0,0,0,0,0,0|4,0,0]=4 12 B10R0.15 C=C(C)COCCS(=O)(=O)N 34a_100012334274_100000748629 [0,0,0,0,0,0|4,0,0]=4 13 B10R0.15 C=C(C)COCCS(=O)(=O)[O-] 34a_100000210245_100000762736 [0,0,0,0,0,0|3,0,1]=4 14 B10R0.15 C=C(C)CSCCS(=O)(=O)C 62a_100000731031_100000211660 [0,0,0,0,0,0|4,0,0]=4 15 B10R0.15 C=C(C)CSCCS(=O)(=O)C 62a_100000748629_100000230027 [0,0,0,0,0,0|4,0,0]=4 16 B10R0.15 C=C(C)CSCCS(=O)(=O)[O-] 62a_100000748629_100000762736 [0,0,0,0,0,0|3,0,1]=4 17 B10R0.15 C=C(C)CSCCS(=O)(=O)[O-] 62a_100000762736_100000211660 [0,0,0,0,0,0|3,0,1]=4 18 B10R0.15 CC(=CCNCS(=O)(=O)[O-])C 34a_100000718196_100009817235 [0,0,0,0,0,0|3,0,1]=4 19 B10R0.15 CC(=CCOCS(=O)(=O)[O-])C 34a_100000753907_100009817235 [0,0,0,0,0,0|3,0,1]=4 20 B10R0.15 CC(=CCSCS(=O)(=O)N)C 62a_100000741382_100000761012 [0,0,0,0,0,0|4,0,0]=4 21 B10R0.15 CC(=CCSCS(=O)(=O)N)C 62a_100000761012_100000741382 [0,0,0,0,0,0|4,0,0]=4 22 B10R0.15 CC(=CCSCS(=O)(=O)[O-])C 62a_100000761012_100009817235 [0,0,0,0,0,0|3,0,1]=4 23 B10R0.15 CC(=CCSCS(=O)(=O)[O-])C 62a_100009817235_100000761012 [0,0,0,0,0,0|3,0,1]=4 24 B10R0.15 CC(=O)CCOCS(=O)(=O)[O-] 34a_100000759926_100009817235 [0,0,0,0,0,0|2,0,1]=3 25 B10R0.15 CC(=O)CCSCS(=O)(=O)N 62a_100000053229_100000741382 [0,0,0,0,0,0|3,0,0]=3 26 B10R0.15 CC(=O)CCSCS(=O)(=O)N 62a_100000741382_100000053229 [0,0,0,0,0,0|3,0,0]=3 27 B10R0.15 CC(=O)CCSCS(=O)(=O)[O-] 62a_100000053229_100009817235 [0,0,0,0,0,0|2,0,1]=3 28 B10R0.15 CC(=O)CCSCS(=O)(=O)[O-] 62a_100009817235_100000053229 [0,0,0,0,0,0|2,0,1]=3 29 B10R0.15 CC(=O)COCCS(=O)(=O)C 34a_100000211253_100000731031 [0,0,0,0,0,0|3,0,0]=3 30 B10R0.15 CC(=O)COCCS(=O)(=O)[O-] 34a_100000211253_100000762736 [0,0,0,0,0,0|2,0,1]=3 31 B10R0.15 CC(=O)NCCCC(F)(F)F 11a_100000727188_100015343762 [0,0,0,0,0,0|4,0,0]=4 32 B10R0.15 CC(=O)NCCCC(F)(F)F 1626a_100000727188_100015343762 [0,0,0,0,0,0|4,0,0]=4 33 B10R0.15 CC(=O)NCCCC(F)(F)F 240690a_100000727188_100015343762 [0,0,0,0,0,0|4,0,0]=4 34 B10R0.15 CC(=O)NCCCC(F)(F)F 527a_100000727188_100103153847 [0,0,0,0,0,0|4,0,0]=4 35 B10R0.15 CC(=O)NCCCS(=O)(=O)C 11a_100000742409_100015343762 [0,0,0,0,0,0|1,0,0]=1 36 B10R0.15 CC(=O)NCCCS(=O)(=O)C 1626a_100000742409_100015343762 [0,0,0,0,0,0|1,0,0]=1 37 B10R0.15 CC(=O)NCCCS(=O)(=O)C 240690a_100000742409_100015343762 [0,0,0,0,0,0|1,0,0]=1 38 B10R0.15 CC(=O)NCCCS(=O)(=O)C 527a_100000742409_100103153847 [0,0,0,0,0,0|1,0,0]=1 39 B10R0.15 CC(=O)NCCC[Si](C)(C)C 1626a_100000725946_100015343762 [0,0,0,0,0,0|4,0,0]=4 40 B10R0.15 CC(=O)NCCC[Si](C)(C)C 240690a_100000725946_100015343762 [0,0,0,0,0,0|4,0,0]=4 41 B10R0.15 CC(=O)NCCC[Si](C)(C)C 527a_100000725946_100103153847 [0,0,0,0,0,0|4,0,0]=4 42 B10R0.15 CC(=O)NCCNS(=O)(=O)C 11a_100000752411_100015343762 [0,0,0,0,0,0|2,0,0]=2 43 B10R0.15 CC(=O)NCCNS(=O)(=O)C 1626a_100000752411_100015343762 [0,0,0,0,0,0|2,0,0]=2 44 B10R0.15 CC(=O)NCCNS(=O)(=O)C 240690a_100000752411_100015343762 [0,0,0,0,0,0|2,0,0]=2 45 B10R0.15 CC(=O)NCCNS(=O)(=O)C 40a_100000209853_100000738038 [0,0,0,0,0,0|2,0,0]=2 46 B10R0.15 CC(=O)NCCNS(=O)(=O)C 527a_100000752411_100103153847 [0,0,0,0,0,0|2,0,0]=2 47 B10R0.15 CC(=O)OCCNS(=O)(=O)C 40a_100000724843_100000738038 [0,0,0,0,0,0|3,0,0]=3 48 B10R0.15 CC(=O)OCSCS(=O)(=O)N 62a_100000076356_100000741382 [0,0,0,0,0,0|3,0,0]=3 49 B10R0.15 CC(=O)OCSCS(=O)(=O)N 62a_100000741382_100000076356 [0,0,0,0,0,0|3,0,0]=3 50 B10R0.15 CC(=O)OCSCS(=O)(=O)[O-] 62a_100000076356_100009817235 [0,0,0,0,0,0|2,0,1]=3 51 B10R0.15 CC(=O)OCSCS(=O)(=O)[O-] 62a_100009817235_100000076356 [0,0,0,0,0,0|2,0,1]=3 52 B10R0.15 CC(=O)SCCNS(=O)(=O)C 40a_100020647217_100000738038 [0,0,0,0,0,0|3,0,0]=3 53 B10R0.15 CC(C)NCCCS(=O)(=O)C 2230a_100000742409_100000210206 [0,0,0,0,0,0|2,0,1]=3 54 B10R0.15 CC(C)NCCCS(=O)(=O)C 2230a_100138425928_100000754308 [0,0,0,0,0,0|2,0,1]=3 55 B10R0.15 CC(C)NCCCS(=O)(=O)C 34a_100000742409_100000210206 [0,0,0,0,0,0|2,0,1]=3 56 B10R0.15 CC(C)NCCCS(=O)(=O)C 34a_100138425928_100000754308 [0,0,0,0,0,0|2,0,1]=3 57 B10R0.15 CC(C)NCCCS(=O)(=O)N 2230a_100138425928_100000750626 [0,0,0,0,0,0|2,0,1]=3 58 B10R0.15 CC(C)NCCCS(=O)(=O)N 34a_100138425928_100000750626 [0,0,0,0,0,0|2,0,1]=3 59 B10R0.15 CC(C)NCCCS(=O)(=O)[O-] 34a_100138425928_100009813499 [0,0,0,0,0,0|1,0,2]=3 60 B10R0.15 CC(C)NCCNS(=O)(=O)C 2230a_100138425928_100000754112 [0,0,0,0,0,0|3,0,1]=4 61 B10R0.15 CC(C)NCCNS(=O)(=O)C 34a_100000752411_100000210206 [0,0,0,0,0,0|3,0,1]=4 62 B10R0.15 CC(C)NCCOS(=O)(=O)C 2230a_100138425928_200000036756 [0,0,0,0,0,0|3,0,1]=4 63 B10R0.15 CC(C)NCCOS(=O)(=O)C 34a_100138425928_200000036756 [0,0,0,0,0,0|3,0,1]=4 64 B10R0.15 CC(C)OCCCS(=O)(=O)C 34a_100000212225_100000754308 [0,0,0,0,0,0|3,0,1]=4 65 B10R0.15 CC(C)OCCCS(=O)(=O)C 34a_100000689940_100000210206 [0,0,0,0,0,0|3,0,1]=4 66 B10R0.15 CC(C)OCCCS(=O)(=O)C 7a_100000689940_100000210206 [0,0,0,0,0,0|3,0,1]=4 67 B10R0.15 CC(C)OCCCS(=O)(=O)N 34a_100000212225_100000750626 [0,0,0,0,0,0|3,0,1]=4 68 B10R0.15 CC(C)OCCCS(=O)(=O)[O-] 34a_100000212225_100009813499 [0,0,0,0,0,0|2,0,2]=4 69 B10R0.15 CC(C)SCCCS(=O)(=O)C 62a_100000210206_100000754308 [0,0,0,0,0,0|3,0,1]=4 70 B10R0.15 CC(C)SCCCS(=O)(=O)C 62a_100000754308_100000210206 [0,0,0,0,0,0|3,0,1]=4 71 B10R0.15 CC(C)SCCCS(=O)(=O)N 62a_100000210206_100000750626 [0,0,0,0,0,0|3,0,1]=4 72 B10R0.15 CC(C)SCCCS(=O)(=O)N 62a_100000750626_100000210206 [0,0,0,0,0,0|3,0,1]=4 73 B10R0.15 CC(C)SCCCS(=O)(=O)[O-] 62a_100000210206_100009813499 [0,0,0,0,0,0|2,0,2]=4 74 B10R0.15 CC(C)SCCCS(=O)(=O)[O-] 62a_100009813499_100000210206 [0,0,0,0,0,0|2,0,2]=4 75 B10R0.15 CS(=O)(=O)CCNCC(=O)N 2230a_100000711301_100000731031 [0,0,0,0,0,0|4,0,0]=4 76 B10R0.15 CS(=O)(=O)CCNCC(=O)N 2230a_100000740961_100000747473 [0,0,0,0,0,0|4,0,0]=4 77 B10R0.15 CS(=O)(=O)CCNCC(=O)N 34a_100000740961_100000187820 [0,0,0,0,0,0|4,0,0]=4 78 B10R0.15 CS(=O)(=O)CCNCC(=O)O 269956a_100016091260_100000731031 [0,0,0,0,0,0|4,0,0]=4 79 B10R0.15 CS(=O)(=O)CCNCC(=O)[O-] 34a_100000740961_100020667443 [0,0,0,0,0,0|4,0,0]=4 80 B10R0.15 CS(=O)(=O)CCOCC(=O)N 34a_100000211924_100000187820 [0,0,0,0,0,0|4,0,0]=4 81 B10R0.15 CS(=O)(=O)CCOCC(=O)N 7a_100000211924_100000187820 [0,0,0,0,0,0|4,0,0]=4 82 B10R0.15 CS(=O)(=O)CCOCC(=O)[O-] 34a_100000211924_100020667443 [0,0,0,0,0,0|4,0,0]=4 83 B10R0.15 CS(=O)(=O)CCSCC(=O)N 62a_100000731031_100000747473 [0,0,0,0,0,0|4,0,0]=4 84 B10R0.15 CS(=O)(=O)CCSCC(=O)N 62a_100000747473_100000230027 [0,0,0,0,0,0|4,0,0]=4 85 B10R0.15 CS(=O)(=O)CCSCC(=O)[O-] 62a_100000731031_100020667443 [0,0,0,0,0,0|4,0,0]=4 86 B10R0.15 CS(=O)(=O)CCSCC(=O)[O-] 62a_100020667443_100000230027 [0,0,0,0,0,0|4,0,0]=4 87 B10R0.15 CS(=O)(=O)NCCCC(=O)N 40a_100000739312_100000738038 [0,0,0,0,0,0|4,0,0]=4 88 B10R0.15 CS(=O)CCCNS(=O)(=O)C 40a_200000753449_100000738038 [0,0,0,0,0,0|4,0,0]=4 89 B10R0.15 NC(=O)CCOCS(=O)(=O)[O-] 34a_100000757172_100009817235 [0,0,0,0,0,0|3,0,1]=4 90 B10R0.15 NC(=O)CCSCS(=O)(=O)N 62a_100000741382_100000744528 [0,0,0,0,0,0|4,0,0]=4 91 B10R0.15 NC(=O)CCSCS(=O)(=O)N 62a_100000744528_100000741382 [0,0,0,0,0,0|4,0,0]=4 92 B10R0.15 NC(=O)CCSCS(=O)(=O)[O-] 62a_100000744528_100009817235 [0,0,0,0,0,0|3,0,1]=4 93 B10R0.15 NC(=O)CCSCS(=O)(=O)[O-] 62a_100009817235_100000744528 [0,0,0,0,0,0|3,0,1]=4 94 B10R0.15 NC(=O)CNCCS(=O)(=O)N 2230a_100000738205_100000747473 [0,0,0,0,0,0|4,0,0]=4 95 B10R0.15 NC(=O)CNCCS(=O)(=O)N 34a_100000738205_100000187820 [0,0,0,0,0,0|4,0,0]=4 96 B10R0.15 NC(=O)CNCCS(=O)(=O)[O-] 2230a_100000711301_100000737633 [0,0,0,0,0,0|3,0,1]=4 97 B10R0.15 NC(=O)COCCS(=O)(=O)N 34a_100012334274_100000187820 [0,0,0,0,0,0|4,0,0]=4 98 B10R0.15 NC(=O)CSCCS(=O)(=O)[O-] 62a_100000747473_100000762736 [0,0,0,0,0,0|3,0,1]=4 99 B10R0.15 NC(=O)CSCCS(=O)(=O)[O-] 62a_100000762736_100000747473 [0,0,0,0,0,0|3,0,1]=4 100 B10R0.15 NS(=O)(=O)CCNCC(=O)[O-] 34a_100000738205_100020667443 [0,0,0,0,0,0|4,0,0]=4 101 B10R0.15 NS(=O)(=O)CCOCC(=O)[O-] 34a_100012334274_100020667443 [0,0,0,0,0,0|4,0,0]=4 102 B10R0.15 O=C(O)CNCCS(=O)(=O)[O-] 269956a_100016091260_100000762736 [0,0,0,0,0,0|3,0,1]=4 103 B10R0.15 O=C([O-])CSCCS(=O)(=O)[O-] 62a_100000762736_100020667443 [0,0,0,0,0,0|3,0,1]=4 104 B10R0.15 O=C([O-])CSCCS(=O)(=O)[O-] 62a_100020667443_100000762736 [0,0,0,0,0,0|3,0,1]=4 105 B9R0.38 C/C=C/COCS(=O)(=O)[O-] 34a_100016270725_100009817235 [1,0,0,0,0,0|2,0,1]=4 106 B9R0.38 C/C=C/CSCS(=O)(=O)N 62a_100000741382_100102629194 [1,0,0,0,0,0|3,0,0]=4 107 B9R0.38 C/C=C/CSCS(=O)(=O)N 62a_100102629194_100000741382 [1,0,0,0,0,0|3,0,0]=4 108 B9R0.38 C/C=C/CSCS(=O)(=O)[O-] 62a_100009817235_100102629194 [1,0,0,0,0,0|2,0,1]=4 109 B9R0.38 C/C=C/CSCS(=O)(=O)[O-] 62a_100102629194_100009817235 [1,0,0,0,0,0|2,0,1]=4 110 B9R0.38 CC=CCSCS(=O)(=O)N 62a_100000070051_100000741382 [1,0,0,0,0,0|3,0,0]=4 111 B9R0.38 CC=CCSCS(=O)(=O)N 62a_100000741382_100000070051 [1,0,0,0,0,0|3,0,0]=4 112 B9R0.38 CC=CCSCS(=O)(=O)[O-] 62a_100000070051_100009817235 [1,0,0,0,0,0|2,0,1]=4 113 B9R0.38 CC=CCSCS(=O)(=O)[O-] 62a_100009817235_100000070051 [1,0,0,0,0,0|2,0,1]=4 114 B9R0.38 CCNCCCS(=O)(=O)C 2230a_100000742409_100000210202 [1,0,0,0,0,0|1,0,1]=3 115 B9R0.38 CCNCCCS(=O)(=O)C 2230a_100015525214_100000754308 [1,0,0,0,0,0|1,0,1]=3 116 B9R0.38 CCNCCCS(=O)(=O)C 34a_100000742409_100000210202 [1,0,0,0,0,0|1,0,1]=3 117 B9R0.38 CCNCCCS(=O)(=O)N 2230a_100015525214_100000750626 [1,0,0,0,0,0|1,0,1]=3 118 B9R0.38 CCNCCNS(=O)(=O)C 2230a_100015525214_100000754112 [1,0,0,0,0,0|2,0,1]=4 119 B9R0.38 CCNCCNS(=O)(=O)C 34a_100000752411_100000210202 [1,0,0,0,0,0|2,0,1]=4 120 B9R0.38 CCNCCOS(=O)(=O)C 2230a_100015525214_200000036756 [1,0,0,0,0,0|2,0,1]=4 121 B9R0.38 CCOCCCS(=O)(=O)C 34a_100000689940_100000210202 [1,0,0,0,0,0|2,0,1]=4 122 B9R0.38 CCOCCCS(=O)(=O)C 34a_100121572206_100000754308 [1,0,0,0,0,0|2,0,1]=4 123 B9R0.38 CCOCCCS(=O)(=O)C 7a_100000689940_100000210202 [1,0,0,0,0,0|2,0,1]=4 124 B9R0.38 CCOCCCS(=O)(=O)N 34a_100121572206_100000750626 [1,0,0,0,0,0|2,0,1]=4 125 B9R0.38 CCOCCCS(=O)(=O)[O-] 34a_100121572206_100009813499 [1,0,0,0,0,0|1,0,2]=4 126 B9R0.38 CCSCCCS(=O)(=O)C 62a_100000210202_100000754308 [1,0,0,0,0,0|2,0,1]=4 127 B9R0.38 CCSCCCS(=O)(=O)C 62a_100000754308_100000210202 [1,0,0,0,0,0|2,0,1]=4 128 B9R0.38 CCSCCCS(=O)(=O)N 62a_100000210202_100000750626 [1,0,0,0,0,0|2,0,1]=4 129 B9R0.38 CCSCCCS(=O)(=O)N 62a_100000750626_100000210202 [1,0,0,0,0,0|2,0,1]=4 130 B9R0.38 CCSCCCS(=O)(=O)[O-] 62a_100000210202_100009813499 [1,0,0,0,0,0|1,0,2]=4 131 B9R0.38 CCSCCCS(=O)(=O)[O-] 62a_100009813499_100000210202 [1,0,0,0,0,0|1,0,2]=4 132 B9R0.38 CS(=O)(=O)CCCNCF 34a_100000742409_100015361967 [1,0,0,0,0,0|2,0,1]=4 133 B9R0.38 CS(=O)(=O)CCNCC=O 2230a_100000740961_200015260668 [1,0,0,0,0,0|3,0,0]=4 134 B9R0.38 CS(=O)(=O)CCNCC=O 34a_100000740961_200009817547 [1,0,0,0,0,0|3,0,0]=4 135 B9R0.38 CS(=O)(=O)CCOCC=O 34a_100000211924_200009817547 [1,0,0,0,0,0|3,0,0]=4 136 B9R0.38 CS(=O)(=O)CCOCC=O 7a_100000211924_200015260668 [1,0,0,0,0,0|3,0,0]=4 137 B9R0.38 CS(=O)(=O)CCSCC=O 62a_100000731031_200015260668 [1,0,0,0,0,0|3,0,0]=4 138 B9R0.38 CS(=O)(=O)CCSCC=O 62a_200015260668_100000230027 [1,0,0,0,0,0|3,0,0]=4 139 B9R0.38 NS(=O)(=O)CCNCC=O 2230a_100000738205_200015260668 [1,0,0,0,0,0|3,0,0]=4 140 B9R0.38 NS(=O)(=O)CCNCC=O 34a_100000738205_200009817547 [1,0,0,0,0,0|3,0,0]=4 141 B9R0.38 NS(=O)(=O)CCOCC=O 34a_100012334274_200009817547 [1,0,0,0,0,0|3,0,0]=4 142 B9R0.38 O=CCSCCS(=O)(=O)[O-] 62a_100000762736_200015260668 [1,0,0,0,0,0|2,0,1]=4 143 B9R0.38 O=CCSCCS(=O)(=O)[O-] 62a_200015260668_100000762736 [1,0,0,0,0,0|2,0,1]=4 144 B9R0.55 CC(=O)CCCCB(O)O 1458a_100000070787_200009817182 [1,0,0,0,0,0|2,0,1]=4 145 B9R0.55 CC(=O)CCCCC(=O)C 1458a_100000070787_100000735457 [1,0,0,0,0,0|3,0,0]=4 146 B9R0.55 CC(=O)CCCNC(=O)C 1458a_100000194741_200000210301 [1,0,0,0,0,0|2,0,0]=3 147 B9R0.55 CC(=O)CCCOC(=O)C 1458a_100000070787_100000042594 [1,0,0,0,0,0|3,0,0]=4 148 B9R0.55 CC(=O)CCCSC(=O)C 1458a_100000070787_100000038929 [1,0,0,0,0,0|3,0,0]=4 149 B9R0.55 CC(=O)CCNCC(=O)O 269956a_100016091260_100000053229 [1,0,0,0,0,0|3,0,0]=4 150 B9R0.55 CC(=O)NCCCC(=O)N 240690a_100000739312_100015343762 [1,0,0,0,0,0|2,0,0]=3 151 B9R0.55 CC(=O)NCCCC(=O)N 527a_100000739312_100103153847 [1,0,0,0,0,0|2,0,0]=3 152 B9R0.55 CC(=O)NCCCC(=O)[13CH3] 1458a_100000194741_200025704644 [1,0,0,0,0,0|2,0,0]=3 153 B9R0.55 CC(=O)NCCCC(C)C 11a_200000737386_100015343762 [1,0,0,0,0,0|3,0,0]=4 154 B9R0.55 CC(=O)NCCCC(C)C 1626a_200000737386_100015343762 [1,0,0,0,0,0|3,0,0]=4 155 B9R0.55 CC(=O)NCCCC(C)C 240690a_200000737386_100015343762 [1,0,0,0,0,0|3,0,0]=4 156 B9R0.55 CC(=O)NCCCC(C)C 527a_200000737386_100103153847 [1,0,0,0,0,0|3,0,0]=4 157 B9R0.55 CC(=O)NCCCN(C)C 240690a_102531767803_100015343762 [1,0,0,0,0,0|3,0,0]=4 158 B9R0.55 CC(=O)NCCCN(C)C 527a_102531767803_100103153847 [1,0,0,0,0,0|3,0,0]=4 159 B9R0.55 CC(=O)NCCCS(=O)C 11a_200000753449_100015343762 [1,0,0,0,0,0|1,0,1]=3 160 B9R0.55 CC(=O)NCCCS(=O)C 240690a_200000753449_100015343762 [1,0,0,0,0,0|1,0,1]=3 161 B9R0.55 CC(=O)NCCCS(=O)C 527a_200000753449_100103153847 [1,0,0,0,0,0|1,0,1]=3 162 B9R0.55 CC(=O)NCCNC(=O)C 240690a_100000209853_100015343762 [1,0,0,0,0,0|3,0,0]=4 163 B9R0.55 CC(=O)NCCNC(=O)C 527a_100000209853_100103153847 [1,0,0,0,0,0|3,0,0]=4 164 B9R0.55 CC(=O)NCCNC(=O)N 240690a_100020590234_100015343762 [1,0,0,0,0,0|3,0,0]=4 165 B9R0.55 CC(=O)NCCNC(=O)N 527a_100020590234_100103153847 [1,0,0,0,0,0|3,0,0]=4 166 B9R0.55 CC(=O)NCCOC(=O)C 11a_100000724843_100015343762 [1,0,0,0,0,0|3,0,0]=4 167 B9R0.55 CC(=O)NCCOC(=O)C 240690a_100000724843_100015343762 [1,0,0,0,0,0|3,0,0]=4 168 B9R0.55 CC(=O)NCCOC(=O)C 527a_100000724843_100103153847 [1,0,0,0,0,0|3,0,0]=4 169 B9R0.55 CC(=O)NCCSC(=O)C 11a_100020647217_100015343762 [1,0,0,0,0,0|3,0,0]=4 170 B9R0.55 CC(=O)NCCSC(=O)C 240690a_100020647217_100015343762 [1,0,0,0,0,0|3,0,0]=4 171 B9R0.55 CC(=O)NCCSC(=O)C 527a_100020647217_100103153847 [1,0,0,0,0,0|3,0,0]=4 172 B9R0.55 CC(=O)OCNCC(=O)O 269956a_100016091260_100000076356 [1,0,0,0,0,0|3,0,0]=4 173 B11R0.34 CC(=O)NCC(=O)CS(=O)(=O)N 1458a_100000194580_100000741382 [0,1,0,0,0,0|1,0,1]=3 174 B11R0.34 CC(=O)NCC(=O)CS(=O)(=O)[O-] 1458a_100000194580_100009817235 [0,1,0,0,0,0|0,0,2]=3 175 B11R0.34 CC(=O)NCC(=O)NS(=O)(=O)C 2740a_100000171171_100000194580 [0,1,0,0,0,0|2,0,1]=4 176 B11R0.34 CC(=O)NNC(=O)CS(=O)(=O)C 22a_100000189765_100000744497 [0,1,0,0,0,0|2,0,1]=4 177 B11R0.34 CC(=O)OCC(=O)CS(=O)(=O)N 1458a_100000183556_100000741382 [0,1,0,0,0,0|2,0,1]=4 178 B11R0.34 CC(=O)OCC(=O)CS(=O)(=O)[O-] 1458a_100000183556_100009817235 [0,1,0,0,0,0|1,0,2]=4 179 B11R0.34 CC(=O)SCC(=O)CS(=O)(=O)N 1458a_100000049016_100000741382 [0,1,0,0,0,0|2,0,1]=4 180 B11R0.34 CC(=O)SCC(=O)CS(=O)(=O)[O-] 1458a_100000049016_100009817235 [0,1,0,0,0,0|1,0,2]=4 181 B11R0.34 CC(C)NCC(O)CS(=O)(=O)[O-] 34a_100138425928_100016993520 [0,1,0,0,0,0|1,0,2]=4 182 B11R0.34 NC(=O)NCC(=O)CS(=O)(=O)N 1458a_100000184981_100000741382 [0,1,0,0,0,0|2,0,1]=4 183 B11R0.34 NC(=O)NCC(=O)CS(=O)(=O)[O-] 1458a_100000184981_100009817235 [0,1,0,0,0,0|1,0,2]=4 184 B11R0.84 CC(=O)NCCN(C)S(=O)(=O)C 11a_100015186441_100015343762 [0,1,0,0,0,0|2,0,0]=3 185 B11R0.84 CC(=O)NCCN(C)S(=O)(=O)C 1626a_100015186441_100015343762 [0,1,0,0,0,0|2,0,0]=3 186 B11R0.84 CC(=O)NCCN(C)S(=O)(=O)C 240690a_100015186441_100015343762 [0,1,0,0,0,0|2,0,0]=3 187 B11R0.84 CC(=O)NCCN(C)S(=O)(=O)C 527a_100015186441_100103153847 [0,1,0,0,0,0|2,0,0]=3 188 B11R0.114 C#CC(C)NCCCS(=O)(=O)C 2230a_100000707721_100000754308 [0,1,0,0,0,0|2,0,1]=4 189 B11R0.114 C#CC(C)NCCCS(=O)(=O)C 34a_100000707721_100000754308 [0,1,0,0,0,0|2,0,1]=4 190 B11R0.114 C#CC(C)NCCCS(=O)(=O)C 34a_100000742409_200000035995 [0,1,0,0,0,0|2,0,1]=4 191 B11R0.114 C#CC(C)NCCCS(=O)(=O)N 2230a_100000707721_100000750626 [0,1,0,0,0,0|2,0,1]=4 192 B11R0.114 C#CC(C)NCCCS(=O)(=O)N 34a_100000707721_100000750626 [0,1,0,0,0,0|2,0,1]=4 193 B11R0.114 C#CC(C)NCCCS(=O)(=O)[O-] 34a_100000707721_100009813499 [0,1,0,0,0,0|1,0,2]=4 194 B11R0.114 C=CC(=O)NCCCS(=O)(=O)C 1626a_100000742409_100000185746 [0,1,0,0,0,0|1,0,1]=3 195 B11R0.114 C=CC(=O)NCCCS(=O)(=O)C 240690a_100000742409_200121576911 [0,1,0,0,0,0|1,0,1]=3 196 B11R0.114 C=CC(=O)NCCNS(=O)(=O)C 1626a_100000752411_100000185746 [0,1,0,0,0,0|2,0,1]=4 197 B11R0.114 C=CC(=O)NCCNS(=O)(=O)C 240690a_100000752411_200121576911 [0,1,0,0,0,0|2,0,1]=4 198 B11R0.114 C=CC(=O)NCCNS(=O)(=O)C 40a_114873766552_100000738038 [0,1,0,0,0,0|2,0,1]=4 199 B11R0.114 CC(C#N)NCCCS(=O)(=O)C 2230a_100000737613_100000754308 [0,1,0,0,0,0|2,0,1]=4 200 B11R0.114 CC(C#N)NCCCS(=O)(=O)C 2230a_100000742409_100000184139 [0,1,0,0,0,0|2,0,1]=4 201 B11R0.114 CC(C#N)NCCCS(=O)(=O)N 2230a_100000737613_100000750626 [0,1,0,0,0,0|2,0,1]=4 202 B11R0.114 CC(CO)NCCCS(=O)(=O)C 2230a_100000742409_100012180447 [0,1,0,0,0,0|1,0,2]=4 203 B11R0.114 CC(CO)NCCCS(=O)(=O)C 34a_100000742409_100012180447 [0,1,0,0,0,0|1,0,2]=4 204 B11R0.114 CCC(=O)COCCS(=O)(=O)C 34a_100000725409_100000731031 [0,1,0,0,0,0|3,0,0]=4 205 B11R0.114 CCC(=O)COCCS(=O)(=O)C 7a_100000211924_100000747405 [0,1,0,0,0,0|3,0,0]=4 206 B11R0.114 CCC(=O)COCCS(=O)(=O)[O-] 34a_100000725409_100000762736 [0,1,0,0,0,0|2,0,1]=4 207 B11R0.114 CCC(=O)CSCCS(=O)(=O)C 62a_100000731031_100000747405 [0,1,0,0,0,0|3,0,0]=4 208 B11R0.114 CCC(=O)CSCCS(=O)(=O)C 62a_100000747405_100000230027 [0,1,0,0,0,0|3,0,0]=4 209 B11R0.114 CCC(=O)CSCCS(=O)(=O)[O-] 62a_100000747405_100000762736 [0,1,0,0,0,0|2,0,1]=4 210 B11R0.114 CCC(=O)CSCCS(=O)(=O)[O-] 62a_100000762736_100000747405 [0,1,0,0,0,0|2,0,1]=4 211 B11R0.114 CCC(=O)NCCCS(=O)(=O)C 11a_100000742409_100000210414 [0,1,0,0,0,0|1,0,0]=2 212 B11R0.114 CCC(=O)NCCCS(=O)(=O)C 1626a_100000742409_100000210414 [0,1,0,0,0,0|1,0,0]=2 213 B11R0.114 CCC(=O)NCCCS(=O)(=O)C 240690a_100000742409_100000210414 [0,1,0,0,0,0|1,0,0]=2 214 B11R0.114 CCC(=O)NCCCS(=O)(=O)C 527a_100000742409_100000210414 [0,1,0,0,0,0|1,0,0]=2 215 B11R0.114 CCC(=O)NCCNS(=O)(=O)C 11a_100000752411_100000210414 [0,1,0,0,0,0|2,0,0]=3 216 B11R0.114 CCC(=O)NCCNS(=O)(=O)C 1626a_100000752411_100000210414 [0,1,0,0,0,0|2,0,0]=3 217 B11R0.114 CCC(=O)NCCNS(=O)(=O)C 240690a_100000752411_100000210414 [0,1,0,0,0,0|2,0,0]=3 218 B11R0.114 CCC(=O)NCCNS(=O)(=O)C 40a_100132302217_100000738038 [0,1,0,0,0,0|2,0,0]=3 219 B11R0.114 CCC(=O)NCCNS(=O)(=O)C 527a_100000752411_100000210414 [0,1,0,0,0,0|2,0,0]=3 220 B11R0.114 CCC(C)NCCCS(=O)(=O)C 2230a_100000209981_100000754308 [0,1,0,0,0,0|2,0,1]=4 221 B11R0.114 CCC(C)NCCCS(=O)(=O)C 2230a_100000742409_100000758301 [0,1,0,0,0,0|2,0,1]=4 222 B11R0.114 CCC(C)NCCCS(=O)(=O)C 34a_100000742409_100011215416 [0,1,0,0,0,0|2,0,1]=4 223 B11R0.114 CCC(C)NCCCS(=O)(=O)N 2230a_100000209981_100000750626 [0,1,0,0,0,0|2,0,1]=4 224 B11R0.114 CNC(=O)CCCNS(=O)(=O)C 40a_100000740002_100000738038 [0,1,0,0,0,0|3,0,0]=4 225 B11R0.114 CNC(=O)CCNCS(=O)(=O)[O-] 34a_100000738227_100009817235 [0,1,0,0,0,0|2,0,1]=4 226 B11R0.114 CNC(=O)CCOCS(=O)(=O)[O-] 34a_100000754576_100009817235 [0,1,0,0,0,0|2,0,1]=4 227 B11R0.114 CNC(=O)CCSCS(=O)(=O)N 62a_100000737683_100000741382 [0,1,0,0,0,0|3,0,0]=4 228 B11R0.114 CNC(=O)CCSCS(=O)(=O)N 62a_100000741382_100000737683 [0,1,0,0,0,0|3,0,0]=4 229 B11R0.114 CNC(=O)CCSCS(=O)(=O)[O-] 62a_100000737683_100009817235 [0,1,0,0,0,0|2,0,1]=4 230 B11R0.114 CNC(=O)CCSCS(=O)(=O)[O-] 62a_100009817235_100000737683 [0,1,0,0,0,0|2,0,1]=4 231 B11R0.114 CNC(=O)CNCCS(=O)(=O)C 2230a_100000693194_100000731031 [0,1,0,0,0,0|3,0,0]=4 232 B11R0.114 CNC(=O)CNCCS(=O)(=O)C 2230a_100000740961_100000183359 [0,1,0,0,0,0|3,0,0]=4 233 B11R0.114 CNC(=O)CNCCS(=O)(=O)C 34a_100000740961_100000183359 [0,1,0,0,0,0|3,0,0]=4 234 B11R0.114 CNC(=O)CNCCS(=O)(=O)N 2230a_100000738205_100000183359 [0,1,0,0,0,0|3,0,0]=4 235 B11R0.114 CNC(=O)CNCCS(=O)(=O)N 34a_100000738205_100000183359 [0,1,0,0,0,0|3,0,0]=4 236 B11R0.114 CNC(=O)CNCCS(=O)(=O)[O-] 2230a_100000693194_100000737633 [0,1,0,0,0,0|2,0,1]=4 237 B11R0.114 CNC(=O)COCCS(=O)(=O)C 34a_100000211924_100000183359 [0,1,0,0,0,0|3,0,0]=4 238 B11R0.114 CNC(=O)COCCS(=O)(=O)C 34a_100000750040_100000731031 [0,1,0,0,0,0|3,0,0]=4 239 B11R0.114 CNC(=O)COCCS(=O)(=O)C 7a_100000211924_100000183359 [0,1,0,0,0,0|3,0,0]=4 240 B11R0.114 CNC(=O)COCCS(=O)(=O)N 34a_100012334274_100000183359 [0,1,0,0,0,0|3,0,0]=4 241 B11R0.114 CNC(=O)COCCS(=O)(=O)[O-] 34a_100000750040_100000762736 [0,1,0,0,0,0|2,0,1]=4 242 B11R0.114 CNC(=O)CSCCS(=O)(=O)C 62a_100000183359_100000230027 [0,1,0,0,0,0|3,0,0]=4 243 B11R0.114 CNC(=O)CSCCS(=O)(=O)C 62a_100000731031_100000183359 [0,1,0,0,0,0|3,0,0]=4 244 B11R0.114 CNC(=O)CSCCS(=O)(=O)[O-] 62a_100000183359_100000762736 [0,1,0,0,0,0|2,0,1]=4 245 B11R0.114 CNC(=O)CSCCS(=O)(=O)[O-] 62a_100000762736_100000183359 [0,1,0,0,0,0|2,0,1]=4 246 B11R0.114 CNC(=O)NCCCS(=O)(=O)C 2708a_100000742409_106832991635 [0,1,0,0,0,0|1,0,0]=2 247 B11R0.114 CNC(=O)NCCCS(=O)(=O)C 2708a_100102657272_100000742409 [0,1,0,0,0,0|1,0,0]=2 248 B11R0.114 CNC(=O)NCCCS(=O)(=O)C 273464a_100000742409_100102657272 [0,1,0,0,0,0|1,0,0]=2 249 B11R0.114 CNC(=O)NCCCS(=O)(=O)C 273464a_100102657272_100000742409 [0,1,0,0,0,0|1,0,0]=2 250 B11R0.114 CNC(=O)NCCCS(=O)(=O)C 512a_100000742409_100102657272 [0,1,0,0,0,0|1,0,0]=2 251 B11R0.114 CNC(=O)NCCCS(=O)(=O)C 512a_106832991638_100000742409 [0,1,0,0,0,0|1,0,0]=2 252 B11R0.114 CNC(=O)NCCC[Si](O)(O)O 273464a_100102657272_100000066040 [0,1,0,0,0,0|1,0,2]=4 253 B11R0.114 CNC(=O)NCCC[Si](O)(O)O 512a_100000066040_100102657272 [0,1,0,0,0,0|1,0,2]=4 254 B11R0.114 CNC(=O)NCCNS(=O)(=O)C 2708a_100000752411_106832991635 [0,1,0,0,0,0|2,0,0]=3 255 B11R0.114 CNC(=O)NCCNS(=O)(=O)C 2708a_100102657272_100000752411 [0,1,0,0,0,0|2,0,0]=3 256 B11R0.114 CNC(=O)NCCNS(=O)(=O)C 273464a_100000752411_100102657272 [0,1,0,0,0,0|2,0,0]=3 257 B11R0.114 CNC(=O)NCCNS(=O)(=O)C 273464a_100102657272_100000752411 [0,1,0,0,0,0|2,0,0]=3 258 B11R0.114 CNC(=O)NCCNS(=O)(=O)C 40a_100015205895_100000738038 [0,1,0,0,0,0|2,0,0]=3 259 B11R0.114 CNC(=O)NCCNS(=O)(=O)C 512a_100000752411_100102657272 [0,1,0,0,0,0|2,0,0]=3 260 B11R0.114 CNC(=O)NCCNS(=O)(=O)C 512a_106832991638_100000752411 [0,1,0,0,0,0|2,0,0]=3 261 B11R0.114 COC(=O)CCSCS(=O)(=O)N 62a_100000204255_100000741382 [0,1,0,0,0,0|3,0,0]=4 262 B11R0.114 COC(=O)CCSCS(=O)(=O)N 62a_100000741382_100000204255 [0,1,0,0,0,0|3,0,0]=4 263 B11R0.114 COC(=O)CCSCS(=O)(=O)[O-] 62a_100000204255_100009817235 [0,1,0,0,0,0|2,0,1]=4 264 B11R0.114 COC(=O)CCSCS(=O)(=O)[O-] 62a_100009817235_100000204255 [0,1,0,0,0,0|2,0,1]=4 265 B11R0.114 COC(=O)CNCCS(=O)(=O)C 2230a_100000740961_100000747449 [0,1,0,0,0,0|3,0,0]=4 266 B11R0.114 COC(=O)CNCCS(=O)(=O)C 34a_100000740961_100000747449 [0,1,0,0,0,0|3,0,0]=4 267 B11R0.114 COC(=O)CNCCS(=O)(=O)N 2230a_100000738205_100000747449 [0,1,0,0,0,0|3,0,0]=4 268 B11R0.114 COC(=O)CNCCS(=O)(=O)N 34a_100000738205_100000747449 [0,1,0,0,0,0|3,0,0]=4 269 B11R0.114 COC(=O)COCCS(=O)(=O)C 34a_100000211924_100000747449 [0,1,0,0,0,0|3,0,0]=4 270 B11R0.114 COC(=O)COCCS(=O)(=O)C 7a_100000211924_100000747449 [0,1,0,0,0,0|3,0,0]=4 271 B11R0.114 COC(=O)COCCS(=O)(=O)N 34a_100012334274_100000747449 [0,1,0,0,0,0|3,0,0]=4 272 B11R0.114 COC(=O)CSCCS(=O)(=O)C 62a_100000731031_100000747449 [0,1,0,0,0,0|3,0,0]=4 273 B11R0.114 COC(=O)CSCCS(=O)(=O)C 62a_100000747449_100000230027 [0,1,0,0,0,0|3,0,0]=4 274 B11R0.114 COC(=O)CSCCS(=O)(=O)[O-] 62a_100000747449_100000762736 [0,1,0,0,0,0|2,0,1]=4 275 B11R0.114 COC(=O)CSCCS(=O)(=O)[O-] 62a_100000762736_100000747449 [0,1,0,0,0,0|2,0,1]=4 276 B11R0.114 COC(=O)OCSCS(=O)(=O)N 62a_100000741382_100000139417 [0,1,0,0,0,0|3,0,0]=4 277 B11R0.114 COC(=O)OCSCS(=O)(=O)[O-] 62a_100009817235_100000139417 [0,1,0,0,0,0|2,0,1]=4 278 B11R0.114 CS(=O)(=O)CCCNC(=O)CO 240690a_100000742409_100000210174 [0,1,0,0,0,0|1,0,0]=2 279 B11R0.114 CS(=O)(=O)CCCNC(=O)CO 527a_100000742409_100000210174 [0,1,0,0,0,0|1,0,0]=2 280 B11R0.114 CS(=O)(=O)NCCNC(=O)CO 240690a_100000752411_100000210174 [0,1,0,0,0,0|2,0,0]=3 281 B11R0.114 CS(=O)(=O)NCCNC(=O)CO 527a_100000752411_100000210174 [0,1,0,0,0,0|2,0,0]=3 282 B11R0.114 C[C@H](CO)NCCCS(=O)(=O)C 2230a_100000737577_100000754308 [0,1,0,0,0,0|1,0,2]=4 283 B11R0.114 C[C@H](CO)NCCCS(=O)(=O)N 2230a_100000737577_100000750626 [0,1,0,0,0,0|1,0,2]=4 284 B11R0.127 CC(=O)NCCCC(C)(C)CO 240690a_100000039164_100015343762 [0,1,0,0,0,0|3,0,0]=4 285 B11R0.127 CC(=O)NCCCC(C)(C)CO 527a_100000039164_100103153847 [0,1,0,0,0,0|3,0,0]=4 286 B11R0.127 CC(=O)NCCNS(=O)(=O)CCl 270084a_100000209853_100000031410 [0,1,0,0,0,0|2,0,0]=3 287 B11R0.127 CC(=O)NCCNS(=O)(=O)CCl 274078a_100000209853_100000031410 [0,1,0,0,0,0|2,0,0]=3 288 B11R0.127 CC(=O)OCCNS(=O)(=O)CCl 270084a_100000724843_100000031410 [0,1,0,0,0,0|3,0,0]=4 289 B11R0.127 CC(=O)OCCNS(=O)(=O)CCl 274078a_100000724843_100000031410 [0,1,0,0,0,0|3,0,0]=4 290 B11R0.127 CC(=O)SCCNS(=O)(=O)CCl 274078a_100020647217_100000031410 [0,1,0,0,0,0|3,0,0]=4 291 B11R0.127 CCS(=O)(=O)CCOCC(=O)C 34a_100000211253_100000756660 [0,1,0,0,0,0|3,0,0]=4 292 B11R0.127 CCS(=O)(=O)NCCNC(=O)C 270084a_100000209853_100000211323 [0,1,0,0,0,0|2,0,0]=3 293 B11R0.127 CCS(=O)(=O)NCCNC(=O)C 274078a_100000209853_100000211323 [0,1,0,0,0,0|2,0,0]=3 294 B11R0.127 CCS(=O)(=O)NCCNC(=O)C 40a_100000209853_100000053943 [0,1,0,0,0,0|2,0,0]=3 295 B11R0.127 CCS(=O)(=O)NCCNC(=O)N 270084a_100020590234_100000211323 [0,1,0,0,0,0|3,0,0]=4 296 B11R0.127 CCS(=O)(=O)NCCNC(=O)N 274078a_100020590234_100000211323 [0,1,0,0,0,0|3,0,0]=4 297 B11R0.127 CCS(=O)(=O)NCCOC(=O)C 270084a_100000724843_100000211323 [0,1,0,0,0,0|3,0,0]=4 298 B11R0.127 CCS(=O)(=O)NCCOC(=O)C 274078a_100000724843_100000211323 [0,1,0,0,0,0|3,0,0]=4 299 B11R0.127 CCS(=O)(=O)NCCOC(=O)C 40a_100000724843_100000053943 [0,1,0,0,0,0|3,0,0]=4 300 B11R0.127 CCS(=O)(=O)NCCSC(=O)C 274078a_100020647217_100000211323 [0,1,0,0,0,0|3,0,0]=4 301 B11R0.127 CCS(=O)(=O)NCCSC(=O)C 40a_100020647217_100000053943 [0,1,0,0,0,0|3,0,0]=4 302 B11R0.127 CO[Si](C)(C)CCCNC(=O)C 1626a_200000066741_100015343762 [0,1,0,0,0,0|3,0,0]=4 303 B11R0.127 CO[Si](C)(C)CCCNC(=O)C 240690a_200000066741_100015343762 [0,1,0,0,0,0|3,0,0]=4 304 B11R0.127 CO[Si](C)(C)CCCNC(=O)C 527a_200000066741_100103153847 [0,1,0,0,0,0|3,0,0]=4 305 B11R0.127 NC(=O)NCCNS(=O)(=O)CCl 270084a_100020590234_100000031410 [0,1,0,0,0,0|3,0,0]=4 306 B11R0.127 NC(=O)NCCNS(=O)(=O)CCl 274078a_100020590234_100000031410 [0,1,0,0,0,0|3,0,0]=4 307 B11R0.199 CC(C)(C)NCCCS(=O)(=O)C 2230a_100000715429_100000754308 [0,1,0,0,0,0|2,0,1]=4 308 B11R0.199 CC(C)(C)NCCCS(=O)(=O)C 34a_100000742409_100000210625 [0,1,0,0,0,0|2,0,1]=4 309 B11R0.199 CC(C)(C)NCCCS(=O)(=O)N 2230a_100000715429_100000750626 [0,1,0,0,0,0|2,0,1]=4 310 B11R0.199 CS(=O)(=O)CCCNS(=O)(=O)C 40a_100000742409_100000738038 [0,1,0,0,0,0|2,0,0]=3 311 B11R0.199 CS(=O)(=O)NCCNS(=O)(=O)C 40a_100000752411_100000738038 [0,1,0,0,0,0|3,0,0]=4 312 B11R0.318 C=C(C)C(=O)CCCS(=O)(=O)C 1458a_100000185857_100000754308 [0,1,0,0,0,0|3,0,0]=4 313 B11R0.318 C=C(C)C(=O)CCCS(=O)(=O)N 1458a_100000185857_100000750626 [0,1,0,0,0,0|3,0,0]=4 314 B11R0.318 C=C(C)C(=O)CCCS(=O)(=O)[O-] 1458a_100000185857_100009813499 [0,1,0,0,0,0|2,0,1]=4 315 B11R0.318 CC(=O)C(=O)CSCS(=O)(=O)N 62a_100000741382_100011261029 [0,1,0,0,0,0|3,0,0]=4 316 B11R0.318 CC(=O)C(=O)CSCS(=O)(=O)N 62a_100011261029_100000741382 [0,1,0,0,0,0|3,0,0]=4 317 B11R0.318 CC(=O)C(=O)CSCS(=O)(=O)[O-] 62a_100009817235_100011261029 [0,1,0,0,0,0|2,0,1]=4 318 B11R0.318 CC(=O)C(=O)CSCS(=O)(=O)[O-] 62a_100011261029_100009817235 [0,1,0,0,0,0|2,0,1]=4 319 B11R0.318 CC(=O)C(C)COCS(=O)(=O)[O-] 34a_100000032740_100009817235 [0,1,0,0,0,0|2,0,1]=4 320 B11R0.318 CC(=O)C(C)NCCS(=O)(=O)C 2230a_100000740961_100009814033 [0,1,0,0,0,0|3,0,0]=4 321 B11R0.318 CC(=O)C(C)NCCS(=O)(=O)N 2230a_100000738205_100009814033 [0,1,0,0,0,0|3,0,0]=4 322 B11R0.318 CC(=O)C(C)OCCS(=O)(=O)C 34a_100000212229_100000731031 [0,1,0,0,0,0|3,0,0]=4 323 B11R0.318 CC(=O)C(C)OCCS(=O)(=O)C 7a_100000211924_100000179758 [0,1,0,0,0,0|3,0,0]=4 324 B11R0.318 CC(=O)C(C)OCCS(=O)(=O)[O-] 34a_100000212229_100000762736 [0,1,0,0,0,0|2,0,1]=4 325 B11R0.318 CC(=O)C(C)SCCS(=O)(=O)C 62a_100000731031_100009814033 [0,1,0,0,0,0|3,0,0]=4 326 B11R0.318 CC(=O)C(C)SCCS(=O)(=O)C 62a_100009814033_100000230027 [0,1,0,0,0,0|3,0,0]=4 327 B11R0.318 CC(=O)C(C)SCCS(=O)(=O)[O-] 62a_100000762736_100009814033 [0,1,0,0,0,0|2,0,1]=4 328 B11R0.318 CC(=O)C(C)SCCS(=O)(=O)[O-] 62a_100009814033_100000762736 [0,1,0,0,0,0|2,0,1]=4 329 B11R0.318 CC(C)N(C)CCCS(=O)(=O)C 269982a_200000211004_100000754308 [0,1,0,0,0,0|2,0,1]=4 330 B11R0.318 CC(C)N(C)CCCS(=O)(=O)N 269982a_200000211004_100000750626 [0,1,0,0,0,0|2,0,1]=4 331 B11R0.318 CC(C)N(C)CCCS(=O)(=O)[O-] 269982a_200000211004_100009813499 [0,1,0,0,0,0|1,0,2]=4 332 B11R0.337 CC(=O)CC(=O)CCS(=O)(=O)C 1458a_100000070787_100103131435 [0,1,0,0,0,0|2,0,1]=4 333 B11R0.337 CC(=O)OC(C)SCS(=O)(=O)N 62a_100000741382_100009818208 [0,1,0,0,0,0|3,0,0]=4 334 B11R0.337 CC(=O)OC(C)SCS(=O)(=O)N 62a_100009818208_100000741382 [0,1,0,0,0,0|3,0,0]=4 335 B11R0.337 CC(=O)OC(C)SCS(=O)(=O)[O-] 62a_100009817235_100009818208 [0,1,0,0,0,0|2,0,1]=4 336 B11R0.337 CC(=O)OC(C)SCS(=O)(=O)[O-] 62a_100009818208_100009817235 [0,1,0,0,0,0|2,0,1]=4 337 B11R1.76 CS(=O)(=O)NC1CNC(=O)C1 40a_100000697751_100000738038 [0,0,0,1,0,0|2,0,0]=3 338 B11R1.155 CS(=O)(=O)N1CCNC(=O)C1 40a_100000184651_100000738038 [0,0,0,1,0,0|2,0,0]=3 339 B11R1.155 CS(=O)(=O)N1CCOC(=O)C1 40a_100000131268_100000738038 [0,0,0,1,0,0|3,0,0]=4 340 B11R1.343 CS(=O)(=O)CCCNC1CC1 34a_100000212008_100000754308 [0,0,0,1,0,0|2,0,1]=4 341 B11R1.343 CS(=O)(=O)CCCNC1CC1 34a_100000742409_100000211595 [0,0,0,1,0,0|2,0,1]=4 342 B11R1.343 NS(=O)(=O)CCCNC1CC1 34a_100000212008_100000750626 [0,0,0,1,0,0|2,0,1]=4 343 B11R1.343 O=S(=O)([O-])CCCNC1CC1 34a_100000212008_100009813499 [0,0,0,1,0,0|1,0,2]=4 344 B11R1.577 NS(=O)(=O)CSC1CC(=O)C1 62a_100009894365_100000741382 [0,0,0,1,0,0|3,0,0]=4 345 B11R1.577 O=C1CC(C1)SCS(=O)(=O)[O-] 62a_100009894365_100009817235 [0,0,0,1,0,0|2,0,1]=4 346 B11R1.710 CC(=O)CC1CCS(=O)(=O)C1 1458a_100000186120_200000210301 [0,0,0,1,0,0|2,0,0]=3 347 B11R1.710 CC(=O)NC1C=CS(=O)(=O)C1 1626a_100000687631_100015343762 [0,0,0,1,0,0|1,0,2]=4 348 B11R1.710 CC(=O)NC1C=CS(=O)(=O)C1 240690a_100000687631_100015343762 [0,0,0,1,0,0|1,0,2]=4 349 B11R1.710 CC(=O)NC1CCS(=O)(=O)C1 11a_100000683523_100015343762 [0,0,0,1,0,0|1,0,0]=2 350 B11R1.710 CC(=O)NC1CCS(=O)(=O)C1 1626a_100000683523_100015343762 [0,0,0,1,0,0|1,0,0]=2 351 B11R1.710 CC(=O)NC1CCS(=O)(=O)C1 240690a_100000683523_100015343762 [0,0,0,1,0,0|1,0,0]=2 352 B11R1.710 CC(=O)NC1CCS(=O)(=O)C1 527a_100000683523_100103153847 [0,0,0,1,0,0|1,0,0]=2 353 B11R1.710 CC(C)NC1CCS(=O)(=O)C1 2230a_100000683523_100000210206 [0,0,0,1,0,0|2,0,1]=4 354 B11R1.710 CC(C)NC1CCS(=O)(=O)C1 34a_100000683523_100000210206 [0,0,0,1,0,0|2,0,1]=4 355 B11R1.710 [13CH3]C(=O)CC1CCS(=O)(=O)C1 1458a_100000186120_200025704644 [0,0,0,1,0,0|2,0,0]=3 356 B11R1.714 CC(=O)NC[C@H]1C[C@@](C1)(C)O 11a_100015257651_100015343762 [0,0,0,1,0,0|3,0,0]=4 357 B11R1.714 CC(=O)NC[C@H]1C[C@@](C1)(C)O 240690a_100015257651_100015343762 [0,0,0,1,0,0|3,0,0]=4 358 B11R1.714 CC(=O)NC[C@H]1C[C@@](C1)(C)O 527a_100015257651_100103153847 [0,0,0,1,0,0|3,0,0]=4 359 B11R1.730 CC(=O)N1CCCC(C1)(C)O 11a_100000695535_100015343762 [0,0,0,1,0,0|3,0,0]=4 360 B11R1.730 CC(=O)N1CCCC(C1)(C)O 240690a_100000695535_100015343762 [0,0,0,1,0,0|3,0,0]=4 361 B11R1.730 CC(=O)N1CCCC(C1)(C)O 527a_100000695535_100103153847 [0,0,0,1,0,0|3,0,0]=4 362 B11R1.730 CC(=O)[C@@H]1CCCS(=O)(=O)C1 1458a_200009923180_200000210301 [0,0,0,1,0,0|2,0,0]=3 363 B11R1.730 [13CH3]C(=O)[C@@H]1CCCS(=O)(=O)C1 1458a_200009923180_200025704644 [0,0,0,1,0,0|2,0,0]=3 364 B9R0.56 C=C(C)COCS(=O)(=O)[O-] 34a_100000210245_100009817235 [0,0,0,0,1,0|2,0,1]=4 365 B9R0.56 C=C(C)CSCS(=O)(=O)N 62a_100000741382_100000211660 [0,0,0,0,1,0|3,0,0]=4 366 B9R0.56 C=C(C)CSCS(=O)(=O)N 62a_100000748629_100000741382 [0,0,0,0,1,0|3,0,0]=4 367 B9R0.56 C=C(C)CSCS(=O)(=O)[O-] 62a_100000748629_100009817235 [0,0,0,0,1,0|2,0,1]=4 368 B9R0.56 C=C(C)CSCS(=O)(=O)[O-] 62a_100009817235_100000211660 [0,0,0,0,1,0|2,0,1]=4 369 B9R0.56 CC(=O)CCCS(=O)(=O)C 1458a_100000070787_100000754308 [0,0,0,0,1,0|1,0,0]=2 370 B9R0.56 CC(=O)CCCS(=O)(=O)N 1458a_100000070787_100000750626 [0,0,0,0,1,0|1,0,0]=2 371 B9R0.56 CC(=O)CCCS(=O)(=O)N 1458a_100000739357_200000210301 [0,0,0,0,1,0|1,0,0]=2 372 B9R0.56 CC(=O)CCCS(=O)(=O)[O-] 1458a_100000070787_100009813499 [0,0,0,0,1,0|0,0,1]=2 373 B9R0.56 CC(=O)CCNS(=O)(=O)C 1458a_100000070787_100000754112 [0,0,0,0,1,0|2,0,0]=3 374 B9R0.56 CC(=O)CCNS(=O)(=O)C 1458a_100000165793_200000210301 [0,0,0,0,1,0|2,0,0]=3 375 B9R0.56 CC(=O)CCOS(=O)(=O)C 1458a_100000070787_200000036756 [0,0,0,0,1,0|2,0,0]=3 376 B9R0.56 CC(=O)COCS(=O)(=O)[O-] 34a_100000211253_100009817235 [0,0,0,0,1,0|1,0,1]=3 377 B9R0.56 CC(=O)NCCC(C)(C)O 1626a_100000707701_100015343762 [0,0,0,0,1,0|3,0,0]=4 378 B9R0.56 CC(=O)NCCC(C)(C)O 527a_100000707701_100103153847 [0,0,0,0,1,0|3,0,0]=4 379 B9R0.56 CC(=O)NCCS(=O)(=O)C 11a_100000740961_100015343762 [0,0,0,0,1,0|1,0,0]=2 380 B9R0.56 CC(=O)NCCS(=O)(=O)C 1626a_100000740961_100015343762 [0,0,0,0,1,0|1,0,0]=2 381 B9R0.56 CC(=O)NCCS(=O)(=O)C 240690a_100000740961_100015343762 [0,0,0,0,1,0|1,0,0]=2 382 B9R0.56 CC(=O)NCCS(=O)(=O)C 527a_100000740961_100103153847 [0,0,0,0,1,0|1,0,0]=2 383 B9R0.56 CC(=O)NCCS(=O)(=O)N 240690a_100000738205_100015343762 [0,0,0,0,1,0|1,0,0]=2 384 B9R0.56 CC(=O)NCCS(=O)(=O)N 527a_100000738205_100103153847 [0,0,0,0,1,0|1,0,0]=2 385 B9R0.56 CC(C)NCCS(=O)(=O)C 2230a_100000740961_100000210206 [0,0,0,0,1,0|2,0,1]=4 386 B9R0.56 CC(C)NCCS(=O)(=O)C 2230a_100138425928_100000731031 [0,0,0,0,1,0|2,0,1]=4 387 B9R0.56 CC(C)NCCS(=O)(=O)C 34a_100000740961_100000210206 [0,0,0,0,1,0|2,0,1]=4 388 B9R0.56 CC(C)NCCS(=O)(=O)C 34a_100138425928_100000731031 [0,0,0,0,1,0|2,0,1]=4 389 B9R0.56 CC(C)NCCS(=O)(=O)N 2230a_100000738205_100000210206 [0,0,0,0,1,0|2,0,1]=4 390 B9R0.56 CC(C)NCCS(=O)(=O)N 34a_100000738205_100000210206 [0,0,0,0,1,0|2,0,1]=4 391 B9R0.56 CC(C)NCCS(=O)(=O)[O-] 2230a_100138425928_100000737633 [0,0,0,0,1,0|1,0,2]=4 392 B9R0.56 CC(C)NCCS(=O)(=O)[O-] 34a_100138425928_100000762736 [0,0,0,0,1,0|1,0,2]=4 393 B9R0.56 CN(C)CCCS(=O)(=O)C 2230a_100102631434_100000754308 [0,0,0,0,1,0|3,0,0]=4 394 B9R0.56 CN(C)CCCS(=O)(=O)C 269982a_100102631434_100000754308 [0,0,0,0,1,0|3,0,0]=4 395 B9R0.56 CN(C)CCCS(=O)(=O)N 2230a_100102631434_100000750626 [0,0,0,0,1,0|3,0,0]=4 396 B9R0.56 CN(C)CCCS(=O)(=O)N 269982a_100102631434_100000750626 [0,0,0,0,1,0|3,0,0]=4 397 B9R0.56 CN(C)CCCS(=O)(=O)[O-] 269982a_100102631434_100009813499 [0,0,0,0,1,0|2,0,1]=4 398 B9R0.56 CS(=O)(=O)NCCC(=O)N 40a_100000740010_100000738038 [0,0,0,0,1,0|3,0,0]=4 399 B9R0.56 CS(=O)(=O)NCCC(=O)[13CH3] 1458a_100000165793_200025704644 [0,0,0,0,1,0|2,0,0]=3 400 B9R0.56 NC(=O)CSCS(=O)(=O)N 62a_100000741382_100000747473 [0,0,0,0,1,0|3,0,0]=4 401 B9R0.56 NC(=O)CSCS(=O)(=O)N 62a_100000747473_100000741382 [0,0,0,0,1,0|3,0,0]=4 402 B9R0.56 NC(=O)CSCS(=O)(=O)[O-] 62a_100000747473_100009817235 [0,0,0,0,1,0|2,0,1]=4 403 B9R0.56 NC(=O)CSCS(=O)(=O)[O-] 62a_100009817235_100000747473 [0,0,0,0,1,0|2,0,1]=4 404 B9R0.56 NS(=O)(=O)CNCC(=O)O 269956a_100016091260_100000741382 [0,0,0,0,1,0|3,0,0]=4 405 B9R0.56 NS(=O)(=O)CSCC(=O)[O-] 62a_100000741382_100020667443 [0,0,0,0,1,0|3,0,0]=4 406 B9R0.56 NS(=O)(=O)CSCC(=O)[O-] 62a_100020667443_100000741382 [0,0,0,0,1,0|3,0,0]=4 407 B9R0.56 O=C(O)CNCS(=O)(=O)[O-] 269956a_100016091260_100009817235 [0,0,0,0,1,0|2,0,1]=4 408 B9R0.56 O=C([O-])CSCS(=O)(=O)[O-] 62a_100009817235_100020667443 [0,0,0,0,1,0|2,0,1]=4 409 B9R0.56 O=C([O-])CSCS(=O)(=O)[O-] 62a_100020667443_100009817235 [0,0,0,0,1,0|2,0,1]=4 410 B9R0.56 [13CH3]C(=O)CCCS(=O)(=O)N 1458a_100000739357_200025704644 [0,0,0,0,1,0|1,0,0]=2 411 B11R0.31 C=C(C)CCNCCS(=O)(=O)C 2230a_100000740961_100000730704 [0,0,0,0,0,1|3,0,0]=4 412 B11R0.31 C=C(C)CCNCCS(=O)(=O)C 34a_100000740961_100000730704 [0,0,0,0,0,1|3,0,0]=4 413 B11R0.31 C=C(C)CCNCCS(=O)(=O)N 2230a_100000738205_100000730704 [0,0,0,0,0,1|3,0,0]=4 414 B11R0.31 C=C(C)CCNCCS(=O)(=O)N 34a_100000738205_100000730704 [0,0,0,0,0,1|3,0,0]=4 415 B11R0.31 C=C(C)CCOCCS(=O)(=O)C 34a_100000211924_100000730704 [0,0,0,0,0,1|3,0,0]=4 416 B11R0.31 C=C(C)CCOCCS(=O)(=O)C 34a_100000764851_100000731031 [0,0,0,0,0,1|3,0,0]=4 417 B11R0.31 C=C(C)CCOCCS(=O)(=O)C 7a_100000211924_100000730704 [0,0,0,0,0,1|3,0,0]=4 418 B11R0.31 C=C(C)CCOCCS(=O)(=O)N 34a_100012334274_100000730704 [0,0,0,0,0,1|3,0,0]=4 419 B11R0.31 C=C(C)CCOCCS(=O)(=O)[O-] 34a_100000764851_100000762736 [0,0,0,0,0,1|2,0,1]=4 420 B11R0.31 C=C(C)CCSCCS(=O)(=O)C 62a_100000730704_100000230027 [0,0,0,0,0,1|3,0,0]=4 421 B11R0.31 C=C(C)CCSCCS(=O)(=O)C 62a_100000731031_100000730704 [0,0,0,0,0,1|3,0,0]=4 422 B11R0.31 C=C(C)CCSCCS(=O)(=O)[O-] 62a_100000730704_100000762736 [0,0,0,0,0,1|2,0,1]=4 423 B11R0.31 C=C(C)CCSCCS(=O)(=O)[O-] 62a_100000762736_100000730704 [0,0,0,0,0,1|2,0,1]=4 424 B11R0.31 C=C(C)CNCCCS(=O)(=O)C 2230a_100000742409_100000748629 [0,0,0,0,0,1|2,0,0]=3 425 B11R0.31 C=C(C)CNCCCS(=O)(=O)C 34a_100000742409_100000748629 [0,0,0,0,0,1|2,0,0]=3 426 B11R0.31 C=C(C)CNCCNS(=O)(=O)C 34a_100000752411_100000748629 [0,0,0,0,0,1|3,0,0]=4 427 B11R0.31 C=C(C)COCCCS(=O)(=O)C 34a_100000210245_100000754308 [0,0,0,0,0,1|3,0,0]=4 428 B11R0.31 C=C(C)COCCCS(=O)(=O)C 34a_100000689940_100000748629 [0,0,0,0,0,1|3,0,0]=4 429 B11R0.31 C=C(C)COCCCS(=O)(=O)C 7a_100000689940_100000748629 [0,0,0,0,0,1|3,0,0]=4 430 B11R0.31 C=C(C)COCCCS(=O)(=O)N 34a_100000210245_100000750626 [0,0,0,0,0,1|3,0,0]=4 431 B11R0.31 C=C(C)COCCCS(=O)(=O)[O-] 34a_100000210245_100009813499 [0,0,0,0,0,1|2,0,1]=4 432 B11R0.31 C=C(C)CSCCCS(=O)(=O)C 62a_100000748629_100000754308 [0,0,0,0,0,1|3,0,0]=4 433 B11R0.31 C=C(C)CSCCCS(=O)(=O)C 62a_100000754308_100000211660 [0,0,0,0,0,1|3,0,0]=4 434 B11R0.31 C=C(C)CSCCCS(=O)(=O)N 62a_100000748629_100000750626 [0,0,0,0,0,1|3,0,0]=4 435 B11R0.31 C=C(C)CSCCCS(=O)(=O)N 62a_100000750626_100000211660 [0,0,0,0,0,1|3,0,0]=4 436 B11R0.31 C=C(C)CSCCCS(=O)(=O)[O-] 62a_100000748629_100009813499 [0,0,0,0,0,1|2,0,1]=4 437 B11R0.31 C=C(C)CSCCCS(=O)(=O)[O-] 62a_100009813499_100000211660 [0,0,0,0,0,1|2,0,1]=4 438 B11R0.31 C=C(F)CNCCCS(=O)(=O)C 2230a_100000742409_100009893438 [0,0,0,0,0,1|2,0,1]=4 439 B11R0.31 C=C(F)CNCCCS(=O)(=O)C 34a_100000742409_100009893438 [0,0,0,0,0,1|2,0,1]=4 440 B11R0.31 CC(=CCCSCS(=O)(=O)N)C 62a_100000741382_100011217483 [0,0,0,0,0,1|3,0,0]=4 441 B11R0.31 CC(=CCCSCS(=O)(=O)N)C 62a_100011217483_100000741382 [0,0,0,0,0,1|3,0,0]=4 442 B11R0.31 CC(=CCCSCS(=O)(=O)[O-])C 62a_100009817235_100011217483 [0,0,0,0,0,1|2,0,1]=4 443 B11R0.31 CC(=CCCSCS(=O)(=O)[O-])C 62a_100011217483_100009817235 [0,0,0,0,0,1|2,0,1]=4 444 B11R0.31 CC(=CCNCCS(=O)(=O)C)C 2230a_100000740961_100000761012 [0,0,0,0,0,1|3,0,0]=4 445 B11R0.31 CC(=CCNCCS(=O)(=O)C)C 34a_100000718196_100000731031 [0,0,0,0,0,1|3,0,0]=4 446 B11R0.31 CC(=CCNCCS(=O)(=O)C)C 34a_100000740961_100000761012 [0,0,0,0,0,1|3,0,0]=4 447 B11R0.31 CC(=CCNCCS(=O)(=O)N)C 2230a_100000738205_100000761012 [0,0,0,0,0,1|3,0,0]=4 448 B11R0.31 CC(=CCNCCS(=O)(=O)N)C 34a_100000738205_100000761012 [0,0,0,0,0,1|3,0,0]=4 449 B11R0.31 CC(=CCNCCS(=O)(=O)[O-])C 34a_100000718196_100000762736 [0,0,0,0,0,1|2,0,1]=4 450 B11R0.31 CC(=CCOCCS(=O)(=O)C)C 34a_100000211924_100000761012 [0,0,0,0,0,1|3,0,0]=4 451 B11R0.31 CC(=CCOCCS(=O)(=O)C)C 34a_100000753907_100000731031 [0,0,0,0,0,1|3,0,0]=4 452 B11R0.31 CC(=CCOCCS(=O)(=O)C)C 7a_100000211924_100000761012 [0,0,0,0,0,1|3,0,0]=4 453 B11R0.31 CC(=CCOCCS(=O)(=O)N)C 34a_100012334274_100000761012 [0,0,0,0,0,1|3,0,0]=4 454 B11R0.31 CC(=CCOCCS(=O)(=O)[O-])C 34a_100000753907_100000762736 [0,0,0,0,0,1|2,0,1]=4 455 B11R0.31 CC(=CCSCCS(=O)(=O)C)C 62a_100000731031_100000761012 [0,0,0,0,0,1|3,0,0]=4 456 B11R0.31 CC(=CCSCCS(=O)(=O)C)C 62a_100000761012_100000230027 [0,0,0,0,0,1|3,0,0]=4 457 B11R0.31 CC(=CCSCCS(=O)(=O)[O-])C 62a_100000761012_100000762736 [0,0,0,0,0,1|2,0,1]=4 458 B11R0.31 CC(=CCSCCS(=O)(=O)[O-])C 62a_100000762736_100000761012 [0,0,0,0,0,1|2,0,1]=4 459 B11R0.31 CC(=O)CCCOCS(=O)(=O)[O-] 34a_100000759063_100009817235 [0,0,0,0,0,1|1,0,1]=3 460 B11R0.31 CC(=O)CCCSCS(=O)(=O)N 62a_100000741382_100011215641 [0,0,0,0,0,1|2,0,0]=3 461 B11R0.31 CC(=O)CCCSCS(=O)(=O)N 62a_100011215641_100000741382 [0,0,0,0,0,1|2,0,0]=3 462 B11R0.31 CC(=O)CCCSCS(=O)(=O)[O-] 62a_100009817235_100011215641 [0,0,0,0,0,1|1,0,1]=3 463 B11R0.31 CC(=O)CCCSCS(=O)(=O)[O-] 62a_100011215641_100009817235 [0,0,0,0,0,1|1,0,1]=3 464 B11R0.31 CC(=O)CCOCCS(=O)(=O)C 34a_100000759926_100000731031 [0,0,0,0,0,1|2,0,0]=3 465 B11R0.31 CC(=O)CCOCCS(=O)(=O)C 7a_100000211924_100000053229 [0,0,0,0,0,1|2,0,0]=3 466 B11R0.31 CC(=O)CCOCCS(=O)(=O)C 7a_100000759926_100000230027 [0,0,0,0,0,1|2,0,0]=3 467 B11R0.31 CC(=O)CCOCCS(=O)(=O)[O-] 34a_100000759926_100000762736 [0,0,0,0,0,1|1,0,1]=3 468 B11R0.31 CC(=O)CCSCCS(=O)(=O)C 62a_100000053229_100000230027 [0,0,0,0,0,1|2,0,0]=3 469 B11R0.31 CC(=O)CCSCCS(=O)(=O)C 62a_100000731031_100000053229 [0,0,0,0,0,1|2,0,0]=3 470 B11R0.31 CC(=O)CCSCCS(=O)(=O)[O-] 62a_100000053229_100000762736 [0,0,0,0,0,1|1,0,1]=3 471 B11R0.31 CC(=O)CCSCCS(=O)(=O)[O-] 62a_100000762736_100000053229 [0,0,0,0,0,1|1,0,1]=3 472 B11R0.31 CC(=O)COCCCS(=O)(=O)C 34a_100000211253_100000754308 [0,0,0,0,0,1|2,0,0]=3 473 B11R0.31 CC(=O)COCCCS(=O)(=O)N 34a_100000211253_100000750626 [0,0,0,0,0,1|2,0,0]=3 474 B11R0.31 CC(=O)COCCCS(=O)(=O)[O-] 34a_100000211253_100009813499 [0,0,0,0,0,1|1,0,1]=3 475 B11R0.31 CC(=O)COCCOS(=O)(=O)C 34a_100000211253_200000036756 [0,0,0,0,0,1|3,0,0]=4 476 B11R0.31 CC(=O)NCCCNS(=O)(=O)C 11a_100000736790_100015343762 [0,0,0,0,0,1|1,0,0]=2 477 B11R0.31 CC(=O)NCCCNS(=O)(=O)C 1626a_100000736790_100015343762 [0,0,0,0,0,1|1,0,0]=2 478 B11R0.31 CC(=O)NCCCNS(=O)(=O)C 240690a_100000736790_100015343762 [0,0,0,0,0,1|1,0,0]=2 479 B11R0.31 CC(=O)NCCCNS(=O)(=O)C 40a_100000736810_100000738038 [0,0,0,0,0,1|1,0,0]=2 480 B11R0.31 CC(=O)NCCCNS(=O)(=O)C 527a_100000736790_100103153847 [0,0,0,0,0,1|1,0,0]=2 481 B11R0.31 CC(=O)NCCNCC(C)(C)O 2230a_100000751335_100000189650 [0,0,0,0,0,1|3,0,0]=4 482 B11R0.31 CC(=O)NCCOCC(C)(C)O 34a_100000158858_100000764493 [0,0,0,0,0,1|3,0,0]=4 483 B11R0.31 CC(=O)NCCOCS(=O)(=O)[O-] 34a_100000158858_100009817235 [0,0,0,0,0,1|0,0,1]=2 484 B11R0.31 CC(=O)NCCSCC(C)(C)O 62a_100000189650_100000764493 [0,0,0,0,0,1|3,0,0]=4 485 B11R0.31 CC(=O)NCCSCC(C)(C)O 62a_100000764493_100000189650 [0,0,0,0,0,1|3,0,0]=4 486 B11R0.31 CC(=O)NCCSCS(=O)(=O)N 62a_100000189650_100000741382 [0,0,0,0,0,1|1,0,0]=2 487 B11R0.31 CC(=O)NCCSCS(=O)(=O)N 62a_100000741382_100000189650 [0,0,0,0,0,1|1,0,0]=2 488 B11R0.31 CC(=O)NCCSCS(=O)(=O)[O-] 62a_100000189650_100009817235 [0,0,0,0,0,1|0,0,1]=2 489 B11R0.31 CC(=O)NCCSCS(=O)(=O)[O-] 62a_100009817235_100000189650 [0,0,0,0,0,1|0,0,1]=2 490 B11R0.31 CC(=O)OCCSCS(=O)(=O)N 62a_100000741382_100009814007 [0,0,0,0,0,1|2,0,0]=3 491 B11R0.31 CC(=O)OCCSCS(=O)(=O)N 62a_100009814007_100000741382 [0,0,0,0,0,1|2,0,0]=3 492 B11R0.31 CC(=O)OCCSCS(=O)(=O)[O-] 62a_100009814007_100009817235 [0,0,0,0,0,1|1,0,1]=3 493 B11R0.31 CC(=O)OCCSCS(=O)(=O)[O-] 62a_100009817235_100009814007 [0,0,0,0,0,1|1,0,1]=3 494 B11R0.31 CC(=O)OCNCCS(=O)(=O)C 34a_100000740961_100009813279 [0,0,0,0,0,1|2,0,0]=3 495 B11R0.31 CC(=O)OCNCCS(=O)(=O)N 34a_100000738205_100009813279 [0,0,0,0,0,1|2,0,0]=3 496 B11R0.31 CC(=O)OCOCCS(=O)(=O)C 34a_100000211924_100009813279 [0,0,0,0,0,1|2,0,0]=3 497 B11R0.31 CC(=O)OCOCCS(=O)(=O)N 34a_100012334274_100009813279 [0,0,0,0,0,1|2,0,0]=3 498 B11R0.31 CC(=O)OCSCCS(=O)(=O)C 62a_100000076356_100000230027 [0,0,0,0,0,1|2,0,0]=3 499 B11R0.31 CC(=O)OCSCCS(=O)(=O)C 62a_100000731031_100000076356 [0,0,0,0,0,1|2,0,0]=3 500 B11R0.31 CC(=O)OCSCCS(=O)(=O)[O-] 62a_100000076356_100000762736 [0,0,0,0,0,1|1,0,1]=3 501 B11R0.31 CC(=O)OCSCCS(=O)(=O)[O-] 62a_100000762736_100000076356 [0,0,0,0,0,1|1,0,1]=3 502 B11R0.31 CC(C)CNCCCS(=O)(=O)C 2230a_100000210953_100000754308 [0,0,0,0,0,1|2,0,1]=4 503 B11R0.31 CC(C)CNCCCS(=O)(=O)C 2230a_100000742409_100000210760 [0,0,0,0,0,1|2,0,1]=4 504 B11R0.31 CC(C)CNCCCS(=O)(=O)C 270004a_100000742409_100000210432 [0,0,0,0,0,1|2,0,1]=4 505 B11R0.31 CC(C)CNCCCS(=O)(=O)C 34a_100000210953_100000754308 [0,0,0,0,0,1|2,0,1]=4 506 B11R0.31 CC(C)CNCCCS(=O)(=O)C 34a_100000742409_100000210624 [0,0,0,0,0,1|2,0,1]=4 507 B11R0.31 CC(C)CNCCCS(=O)(=O)N 2230a_100000210953_100000750626 [0,0,0,0,0,1|2,0,1]=4 508 B11R0.31 CC(C)CNCCCS(=O)(=O)N 34a_100000210953_100000750626 [0,0,0,0,0,1|2,0,1]=4 509 B11R0.31 CC(C)CNCCCS(=O)(=O)[O-] 34a_100000210953_100009813499 [0,0,0,0,0,1|1,0,2]=4 510 B11R0.31 CC(C)NCCCNS(=O)(=O)C 34a_100000736790_100000210206 [0,0,0,0,0,1|2,0,1]=4 511 B11R0.31 CC(C)NCCOCS(=O)(=O)[O-] 34a_100000224655_100009817235 [0,0,0,0,0,1|1,0,2]=4 512 B11R0.31 CC(O)CNCCCS(=O)(=O)C 2230a_100000210904_100000754308 [0,0,0,0,0,1|1,0,2]=4 513 B11R0.31 CC(O)CNCCCS(=O)(=O)C 2230a_100000742409_100011218427 [0,0,0,0,0,1|1,0,2]=4 514 B11R0.31 CC(O)CNCCCS(=O)(=O)C 34a_100000210904_100000754308 [0,0,0,0,0,1|1,0,2]=4 515 B11R0.31 CC(O)CNCCCS(=O)(=O)C 34a_100000742409_100011218427 [0,0,0,0,0,1|1,0,2]=4 516 B11R0.31 CC(O)CNCCCS(=O)(=O)N 2230a_100000210904_100000750626 [0,0,0,0,0,1|1,0,2]=4 517 B11R0.31 CC(O)CNCCCS(=O)(=O)N 34a_100000210904_100000750626 [0,0,0,0,0,1|1,0,2]=4 518 B11R0.31 CC(O)CNCCCS(=O)(=O)[O-] 34a_100000210904_100009813499 [0,0,0,0,0,1|0,0,3]=4 519 B11R0.31 CS(=O)(=O)CCCNCC(=O)N 2230a_100000711301_100000754308 [0,0,0,0,0,1|2,0,0]=3 520 B11R0.31 CS(=O)(=O)CCCNCC(=O)N 2230a_100000742409_100000747473 [0,0,0,0,0,1|2,0,0]=3 521 B11R0.31 CS(=O)(=O)CCCNCC(=O)N 34a_100000742409_100000187820 [0,0,0,0,0,1|2,0,0]=3 522 B11R0.31 CS(=O)(=O)CCCNCC(=O)O 269956a_100016091260_100000754308 [0,0,0,0,0,1|2,0,0]=3 523 B11R0.31 CS(=O)(=O)CCCNCC(=O)[O-] 34a_100000742409_100020667443 [0,0,0,0,0,1|2,0,0]=3 524 B11R0.31 CS(=O)(=O)CCCNC[N+](=O)[O-] 34a_100000742409_100000761209 [0,0,0,0,0,1|3,0,0]=4 525 B11R0.31 CS(=O)(=O)CCCOCC(=O)N 34a_100000689940_100000187820 [0,0,0,0,0,1|3,0,0]=4 526 B11R0.31 CS(=O)(=O)CCCOCC(=O)N 7a_100000689940_100000187820 [0,0,0,0,0,1|3,0,0]=4 527 B11R0.31 CS(=O)(=O)CCCOCC(=O)[O-] 34a_100000689940_100020667443 [0,0,0,0,0,1|3,0,0]=4 528 B11R0.31 CS(=O)(=O)CCCSCC(=O)N 62a_100000747473_100000754308 [0,0,0,0,0,1|3,0,0]=4 529 B11R0.31 CS(=O)(=O)CCCSCC(=O)N 62a_100000754308_100000747473 [0,0,0,0,0,1|3,0,0]=4 530 B11R0.31 CS(=O)(=O)CCCSCC(=O)[O-] 62a_100000754308_100020667443 [0,0,0,0,0,1|3,0,0]=4 531 B11R0.31 CS(=O)(=O)CCCSCC(=O)[O-] 62a_100020667443_100000754308 [0,0,0,0,0,1|3,0,0]=4 532 B11R0.31 CS(=O)(=O)CCNCCC(=O)N 2230a_100000740961_100000744528 [0,0,0,0,0,1|3,0,0]=4 533 B11R0.31 CS(=O)(=O)CCNCCC(=O)N 34a_100000740961_100000731001 [0,0,0,0,0,1|3,0,0]=4 534 B11R0.31 CS(=O)(=O)CCOCCC(=O)N 34a_100000211924_100000731001 [0,0,0,0,0,1|3,0,0]=4 535 B11R0.31 CS(=O)(=O)CCOCCC(=O)N 34a_100000757172_100000731031 [0,0,0,0,0,1|3,0,0]=4 536 B11R0.31 CS(=O)(=O)CCOCCC(=O)N 7a_100000211924_100000744528 [0,0,0,0,0,1|3,0,0]=4 537 B11R0.31 CS(=O)(=O)CCOCCC(=O)N 7a_100000757172_100000230027 [0,0,0,0,0,1|3,0,0]=4 538 B11R0.31 CS(=O)(=O)CCSCCC(=O)N 62a_100000731031_100000744528 [0,0,0,0,0,1|3,0,0]=4 539 B11R0.31 CS(=O)(=O)CCSCCC(=O)N 62a_100000744528_100000230027 [0,0,0,0,0,1|3,0,0]=4 540 B11R0.31 CS(=O)(=O)NCCCCC(=O)N 40a_100000696515_100000738038 [0,0,0,0,0,1|3,0,0]=4 541 B11R0.31 CS(=O)(=O)NCCNCC(=O)N 2230a_100000711301_100000754112 [0,0,0,0,0,1|3,0,0]=4 542 B11R0.31 CS(=O)(=O)NCCNCC(=O)N 34a_100000752411_100000187820 [0,0,0,0,0,1|3,0,0]=4 543 B11R0.31 CS(=O)(=O)NCCNCC(=O)O 269956a_100016091260_100000754112 [0,0,0,0,0,1|3,0,0]=4 544 B11R0.31 CS(=O)(=O)NCCNCC(=O)[O-] 34a_100000752411_100020667443 [0,0,0,0,0,1|3,0,0]=4 545 B11R0.31 CS(=O)(=O)OCCNCC(=O)N 2230a_100000711301_200000036756 [0,0,0,0,0,1|3,0,0]=4 546 B11R0.31 CS(=O)(=O)OCCNCC(=O)O 269956a_100016091260_200000036756 [0,0,0,0,0,1|3,0,0]=4 547 B11R0.31 C[C@@H](O)CNCCCS(=O)(=O)C 2230a_100000742409_100009817552 [0,0,0,0,0,1|1,0,2]=4 548 B11R0.31 C[C@@H](O)CNCCCS(=O)(=O)C 34a_100000742409_100009817552 [0,0,0,0,0,1|1,0,2]=4 549 B11R0.31 NC(=O)CCCNCS(=O)(=O)[O-] 34a_100000739312_100009817235 [0,0,0,0,0,1|2,0,1]=4 550 B11R0.31 NC(=O)CCCSCS(=O)(=O)N 62a_100000741382_100102525003 [0,0,0,0,0,1|3,0,0]=4 551 B11R0.31 NC(=O)CCCSCS(=O)(=O)N 62a_100102525003_100000741382 [0,0,0,0,0,1|3,0,0]=4 552 B11R0.31 NC(=O)CCCSCS(=O)(=O)[O-] 62a_100009817235_100102525003 [0,0,0,0,0,1|2,0,1]=4 553 B11R0.31 NC(=O)CCCSCS(=O)(=O)[O-] 62a_100102525003_100009817235 [0,0,0,0,0,1|2,0,1]=4 554 B11R0.31 NC(=O)CCNCCS(=O)(=O)N 2230a_100000738205_100000744528 [0,0,0,0,0,1|3,0,0]=4 555 B11R0.31 NC(=O)CCNCCS(=O)(=O)N 34a_100000738205_100000731001 [0,0,0,0,0,1|3,0,0]=4 556 B11R0.31 NC(=O)CCOCCS(=O)(=O)N 34a_100012334274_100000731001 [0,0,0,0,0,1|3,0,0]=4 557 B11R0.31 NC(=O)CCOCCS(=O)(=O)[O-] 34a_100000757172_100000762736 [0,0,0,0,0,1|2,0,1]=4 558 B11R0.31 NC(=O)CCSCCS(=O)(=O)[O-] 62a_100000744528_100000762736 [0,0,0,0,0,1|2,0,1]=4 559 B11R0.31 NC(=O)CCSCCS(=O)(=O)[O-] 62a_100000762736_100000744528 [0,0,0,0,0,1|2,0,1]=4 560 B11R0.31 NC(=O)CNCCCS(=O)(=O)N 2230a_100000711301_100000750626 [0,0,0,0,0,1|2,0,0]=3 561 B11R0.31 NC(=O)CSCCCS(=O)(=O)N 62a_100000747473_100000750626 [0,0,0,0,0,1|3,0,0]=4 562 B11R0.31 NC(=O)CSCCCS(=O)(=O)N 62a_100000750626_100000747473 [0,0,0,0,0,1|3,0,0]=4 563 B11R0.31 NC(=O)CSCCCS(=O)(=O)[O-] 62a_100000747473_100009813499 [0,0,0,0,0,1|2,0,1]=4 564 B11R0.31 NC(=O)CSCCCS(=O)(=O)[O-] 62a_100009813499_100000747473 [0,0,0,0,0,1|2,0,1]=4 565 B11R0.31 NC(=O)NCCNCS(=O)(=O)[O-] 34a_100020590234_100009817235 [0,0,0,0,0,1|1,0,1]=3 566 B11R0.31 NC(=O)NCCOCS(=O)(=O)[O-] 34a_100000181757_100009817235 [0,0,0,0,0,1|1,0,1]=3 567 B11R0.31 NC(=O)NCCSCS(=O)(=O)N 62a_100000741382_200000034859 [0,0,0,0,0,1|2,0,0]=3 568 B11R0.31 NC(=O)NCCSCS(=O)(=O)N 62a_200000034859_100000741382 [0,0,0,0,0,1|2,0,0]=3 569 B11R0.31 NC(=O)NCCSCS(=O)(=O)[O-] 62a_100009817235_200000034859 [0,0,0,0,0,1|1,0,1]=3 570 B11R0.31 NC(=O)NCCSCS(=O)(=O)[O-] 62a_200000034859_100009817235 [0,0,0,0,0,1|1,0,1]=3 571 B11R0.31 NC(=O)OCCSCS(=O)(=O)N 62a_100000741382_200011214921 [0,0,0,0,0,1|3,0,0]=4 572 B11R0.31 NC(=O)OCCSCS(=O)(=O)N 62a_200011214921_100000741382 [0,0,0,0,0,1|3,0,0]=4 573 B11R0.31 NC(=O)OCCSCS(=O)(=O)[O-] 62a_100009817235_200011214921 [0,0,0,0,0,1|2,0,1]=4 574 B11R0.31 NC(=O)OCCSCS(=O)(=O)[O-] 62a_200011214921_100009817235 [0,0,0,0,0,1|2,0,1]=4 575 B11R0.31 NS(=O)(=O)CCCNCC(=O)O 269956a_100016091260_100000750626 [0,0,0,0,0,1|2,0,0]=3 576 B11R0.31 NS(=O)(=O)CCCSCC(=O)[O-] 62a_100000750626_100020667443 [0,0,0,0,0,1|3,0,0]=4 577 B11R0.31 NS(=O)(=O)CCCSCC(=O)[O-] 62a_100020667443_100000750626 [0,0,0,0,0,1|3,0,0]=4 578 B11R0.31 O=C(O)CNCCCS(=O)(=O)[O-] 269956a_100016091260_100009813499 [0,0,0,0,0,1|1,0,1]=3 579 B11R0.31 O=C([O-])CSCCCS(=O)(=O)[O-] 62a_100009813499_100020667443 [0,0,0,0,0,1|2,0,1]=4 580 B11R0.31 O=C([O-])CSCCCS(=O)(=O)[O-] 62a_100020667443_100009813499 [0,0,0,0,0,1|2,0,1]=4 581 B8R0.7 C#CCCCNC(=O)C 11a_100000718082_100015343762 [2,0,0,0,0,0|2,0,0]=4 582 B8R0.7 C#CCCCNC(=O)C 1626a_100000718082_100015343762 [2,0,0,0,0,0|2,0,0]=4 583 B8R0.7 C#CCCCNC(=O)C 240690a_100000718082_100015343762 [2,0,0,0,0,0|2,0,0]=4 584 B8R0.7 C#CCCCNC(=O)C 527a_100000718082_100103153847 [2,0,0,0,0,0|2,0,0]=4 585 B8R0.7 C=CCCCNC(=O)C 11a_100000700776_100015343762 [2,0,0,0,0,0|2,0,0]=4 586 B8R0.7 C=CCCCNC(=O)C 1626a_100000700776_100015343762 [2,0,0,0,0,0|2,0,0]=4 587 B8R0.7 C=CCCCNC(=O)C 240690a_100000700776_100015343762 [2,0,0,0,0,0|2,0,0]=4 588 B8R0.7 C=CCCCNC(=O)C 527a_100000700776_100103153847 [2,0,0,0,0,0|2,0,0]=4 589 B8R0.7 CC(=O)CCCCCO 1458a_100000070787_100000746330 [2,0,0,0,0,0|2,0,0]=4 590 B8R0.7 CC(=O)CCCCCO 1458a_100102619762_200000210301 [2,0,0,0,0,0|2,0,0]=4 591 B8R0.7 CC(=O)NCCCCO 240690a_100000750430_100015343762 [2,0,0,0,0,0|1,0,0]=3 592 B8R0.7 CC(=O)NCCCCO 527a_100000750430_100103153847 [2,0,0,0,0,0|1,0,0]=3 593 B8R0.7 CC(=O)NCCCN[13CH3] 34a_100000736810_200025704644 [2,0,0,0,0,0|2,0,0]=4 594 B8R0.7 CC(=O)NCCCO[13CH3] 34a_100000752032_200025704644 [2,0,0,0,0,0|1,1,0]=4 595 B8R0.7 CCCCCNC(=O)C 11a_100000209983_100015343762 [2,0,0,0,0,0|2,0,0]=4 596 B8R0.7 CCCCCNC(=O)C 1626a_100000209983_100015343762 [2,0,0,0,0,0|2,0,0]=4 597 B8R0.7 CCCCCNC(=O)C 240690a_100000209983_100015343762 [2,0,0,0,0,0|2,0,0]=4 598 B8R0.7 CCCCCNC(=O)C 527a_100000209983_100103153847 [2,0,0,0,0,0|2,0,0]=4 599 B8R0.7 CNCCCNC(=O)C 34a_100000736810_200000210301 [2,0,0,0,0,0|2,0,0]=4 600 B8R0.7 COCCCNC(=O)C 1626a_100150723488_100015343762 [2,0,0,0,0,0|1,1,0]=4 601 B8R0.7 COCCCNC(=O)C 240690a_100150723488_100015343762 [2,0,0,0,0,0|1,1,0]=4 602 B8R0.7 COCCCNC(=O)C 34a_100000752032_200000210301 [2,0,0,0,0,0|1,1,0]=4 603 B8R0.7 COCCCNC(=O)C 527a_100150723488_100103153847 [2,0,0,0,0,0|1,1,0]=4 604 B8R0.7 CSCCCNC(=O)C 11a_100000749238_100015343762 [2,0,0,0,0,0|1,0,1]=4 605 B8R0.7 CSCCCNC(=O)C 1626a_100000749238_100015343762 [2,0,0,0,0,0|1,0,1]=4 606 B8R0.7 CSCCCNC(=O)C 240690a_100000749238_100015343762 [2,0,0,0,0,0|1,0,1]=4 607 B8R0.7 CSCCCNC(=O)C 527a_100000749238_100103153847 [2,0,0,0,0,0|1,0,1]=4 608 B8R0.7 [13CH3]C(=O)CCCCCO 1458a_100102619762_200025704644 [2,0,0,0,0,0|2,0,0]=4 609 B8R0.21 CCNCCS(=O)(=O)C 2230a_100000740961_100000210202 [2,0,0,0,0,0|1,0,1]=4 610 B8R0.21 CCNCCS(=O)(=O)C 2230a_100015525214_100000731031 [2,0,0,0,0,0|1,0,1]=4 611 B8R0.21 CCNCCS(=O)(=O)C 34a_100000740961_100000210202 [2,0,0,0,0,0|1,0,1]=4 612 B8R0.21 CCNCCS(=O)(=O)N 2230a_100000738205_100000210202 [2,0,0,0,0,0|1,0,1]=4 613 B8R0.21 CCNCCS(=O)(=O)N 34a_100000738205_100000210202 [2,0,0,0,0,0|1,0,1]=4 614 B8R0.21 CCNCCS(=O)(=O)[O-] 2230a_100015525214_100000737633 [2,0,0,0,0,0|0,0,2]=4 615 B8R0.21 CNCCCS(=O)(=O)C 2230a_100000742409_200000210301 [2,0,0,0,0,0|1,0,0]=3 616 B8R0.21 CNCCCS(=O)(=O)C 2230a_106832991635_100000754308 [2,0,0,0,0,0|1,0,0]=3 617 B8R0.21 CNCCCS(=O)(=O)C 34a_100000742409_200000210301 [2,0,0,0,0,0|1,0,0]=3 618 B8R0.21 CNCCCS(=O)(=O)C 34a_100102657272_100000754308 [2,0,0,0,0,0|1,0,0]=3 619 B8R0.21 CNCCCS(=O)(=O)C 7a_106832991635_100000754308 [2,0,0,0,0,0|1,0,0]=3 620 B8R0.21 CNCCCS(=O)(=O)N 2230a_106832991635_100000750626 [2,0,0,0,0,0|1,0,0]=3 621 B8R0.21 CNCCCS(=O)(=O)N 34a_100102657272_100000750626 [2,0,0,0,0,0|1,0,0]=3 622 B8R0.21 CNCCCS(=O)(=O)N 7a_106832991635_100000750626 [2,0,0,0,0,0|1,0,0]=3 623 B8R0.21 CNCCCS(=O)(=O)[O-] 34a_100102657272_100009813499 [2,0,0,0,0,0|0,0,1]=3 624 B8R0.21 CNCCNS(=O)(=O)C 2230a_106832991635_100000754112 [2,0,0,0,0,0|2,0,0]=4 625 B8R0.21 CNCCNS(=O)(=O)C 34a_100000752411_200000210301 [2,0,0,0,0,0|2,0,0]=4 626 B8R0.21 CNCCNS(=O)(=O)C 7a_106832991635_100000754112 [2,0,0,0,0,0|2,0,0]=4 627 B8R0.21 CNCCOS(=O)(=O)C 2230a_106832991635_200000036756 [2,0,0,0,0,0|2,0,0]=4 628 B8R0.21 CNCCOS(=O)(=O)C 34a_100102657272_200000036756 [2,0,0,0,0,0|2,0,0]=4 629 B8R0.21 CNCCOS(=O)(=O)C 7a_106832991635_200000036756 [2,0,0,0,0,0|2,0,0]=4 630 B8R0.21 COCCCS(=O)(=O)C 34a_100000689940_200000210301 [2,0,0,0,0,0|2,0,0]=4 631 B8R0.21 COCCCS(=O)(=O)C 34a_100138415774_100000754308 [2,0,0,0,0,0|2,0,0]=4 632 B8R0.21 COCCCS(=O)(=O)C 7a_100000689940_200000210301 [2,0,0,0,0,0|2,0,0]=4 633 B8R0.21 COCCCS(=O)(=O)N 34a_100138415774_100000750626 [2,0,0,0,0,0|2,0,0]=4 634 B8R0.21 COCCCS(=O)(=O)[O-] 34a_100138415774_100009813499 [2,0,0,0,0,0|1,0,1]=4 635 B8R0.21 CS(=O)(=O)CCCN[13CH3] 2230a_100000742409_200025704644 [2,0,0,0,0,0|1,0,0]=3 636 B8R0.21 CS(=O)(=O)CCCN[13CH3] 34a_100000742409_200025704644 [2,0,0,0,0,0|1,0,0]=3 637 B8R0.21 CS(=O)(=O)CCCO[13CH3] 34a_100000689940_200025704644 [2,0,0,0,0,0|2,0,0]=4 638 B8R0.21 CS(=O)(=O)CCCO[13CH3] 7a_100000689940_200025704644 [2,0,0,0,0,0|2,0,0]=4 639 B8R0.21 CS(=O)(=O)CCCS[13CH3] 62a_100000754308_200025704644 [2,0,0,0,0,0|2,0,0]=4 640 B8R0.21 CS(=O)(=O)CCCS[13CH3] 62a_200025704644_100000754308 [2,0,0,0,0,0|2,0,0]=4 641 B8R0.21 CS(=O)(=O)NCCN[13CH3] 34a_100000752411_200025704644 [2,0,0,0,0,0|2,0,0]=4 642 B8R0.21 CSCCCS(=O)(=O)C 62a_100000754308_200000210301 [2,0,0,0,0,0|2,0,0]=4 643 B8R0.21 CSCCCS(=O)(=O)C 62a_200000210301_100000754308 [2,0,0,0,0,0|2,0,0]=4 644 B8R0.21 CSCCCS(=O)(=O)N 62a_100000750626_200000210301 [2,0,0,0,0,0|2,0,0]=4 645 B8R0.21 CSCCCS(=O)(=O)N 62a_200000210301_100000750626 [2,0,0,0,0,0|2,0,0]=4 646 B8R0.21 CSCCCS(=O)(=O)[O-] 62a_100009813499_200000210301 [2,0,0,0,0,0|1,0,1]=4 647 B8R0.21 CSCCCS(=O)(=O)[O-] 62a_200000210301_100009813499 [2,0,0,0,0,0|1,0,1]=4 648 B8R0.21 NS(=O)(=O)CSCC=O 62a_100000741382_200015260668 [2,0,0,0,0,0|2,0,0]=4 649 B8R0.21 NS(=O)(=O)CSCC=O 62a_200015260668_100000741382 [2,0,0,0,0,0|2,0,0]=4 650 B8R0.21 O=CCSCS(=O)(=O)[O-] 62a_100009817235_200015260668 [2,0,0,0,0,0|1,0,1]=4 651 B8R0.21 O=CCSCS(=O)(=O)[O-] 62a_200015260668_100009817235 [2,0,0,0,0,0|1,0,1]=4 652 B8R0.21 [13CH3]SCCCS(=O)(=O)N 62a_100000750626_200025704644 [2,0,0,0,0,0|2,0,0]=4 653 B8R0.21 [13CH3]SCCCS(=O)(=O)N 62a_200025704644_100000750626 [2,0,0,0,0,0|2,0,0]=4 654 B8R0.21 [13CH3]SCCCS(=O)(=O)[O-] 62a_100009813499_200025704644 [2,0,0,0,0,0|1,0,1]=4 655 B8R0.21 [13CH3]SCCCS(=O)(=O)[O-] 62a_200025704644_100009813499 [2,0,0,0,0,0|1,0,1]=4 656 B10R0.22 C/C=C/CCOCS(=O)(=O)[O-] 34a_100016278192_100009817235 [1,1,0,0,0,0|1,0,1]=4 657 B10R0.22 C/C=C/CNCCS(=O)(=O)C 34a_100000740961_100102629194 [1,1,0,0,0,0|2,0,0]=4 658 B10R0.22 C/C=C/CNCCS(=O)(=O)N 34a_100000738205_100102629194 [1,1,0,0,0,0|2,0,0]=4 659 B10R0.22 C/C=C/COCCS(=O)(=O)C 34a_100000211924_100102629194 [1,1,0,0,0,0|2,0,0]=4 660 B10R0.22 C/C=C/COCCS(=O)(=O)C 34a_100016270725_100000731031 [1,1,0,0,0,0|2,0,0]=4 661 B10R0.22 C/C=C/COCCS(=O)(=O)C 7a_100000211924_100102629194 [1,1,0,0,0,0|2,0,0]=4 662 B10R0.22 C/C=C/COCCS(=O)(=O)N 34a_100012334274_100102629194 [1,1,0,0,0,0|2,0,0]=4 663 B10R0.22 C/C=C/COCCS(=O)(=O)[O-] 34a_100016270725_100000762736 [1,1,0,0,0,0|1,0,1]=4 664 B10R0.22 C/C=C/CSCCS(=O)(=O)C 62a_100000731031_100102629194 [1,1,0,0,0,0|2,0,0]=4 665 B10R0.22 C/C=C/CSCCS(=O)(=O)C 62a_100102629194_100000230027 [1,1,0,0,0,0|2,0,0]=4 666 B10R0.22 C/C=C/CSCCS(=O)(=O)[O-] 62a_100000762736_100102629194 [1,1,0,0,0,0|1,0,1]=4 667 B10R0.22 C/C=C/CSCCS(=O)(=O)[O-] 62a_100102629194_100000762736 [1,1,0,0,0,0|1,0,1]=4 668 B10R0.22 C=CCNCCCS(=O)(=O)C 2230a_100000742409_100000210623 [1,1,0,0,0,0|1,0,1]=4 669 B10R0.22 C=CCNCCCS(=O)(=O)C 2230a_100020586998_100000754308 [1,1,0,0,0,0|1,0,1]=4 670 B10R0.22 C=CCNCCCS(=O)(=O)C 34a_100000742409_100015514636 [1,1,0,0,0,0|1,0,1]=4 671 B10R0.22 C=CCNCCCS(=O)(=O)N 2230a_100020586998_100000750626 [1,1,0,0,0,0|1,0,1]=4 672 B10R0.22 CC=CCNCCS(=O)(=O)C 2230a_100000740961_100000070051 [1,1,0,0,0,0|2,0,0]=4 673 B10R0.22 CC=CCNCCS(=O)(=O)C 34a_100000740961_100000070051 [1,1,0,0,0,0|2,0,0]=4 674 B10R0.22 CC=CCNCCS(=O)(=O)N 2230a_100000738205_100000070051 [1,1,0,0,0,0|2,0,0]=4 675 B10R0.22 CC=CCNCCS(=O)(=O)N 34a_100000738205_100000070051 [1,1,0,0,0,0|2,0,0]=4 676 B10R0.22 CC=CCOCCS(=O)(=O)C 34a_100000211924_100000070051 [1,1,0,0,0,0|2,0,0]=4 677 B10R0.22 CC=CCOCCS(=O)(=O)C 7a_100000211924_100000070051 [1,1,0,0,0,0|2,0,0]=4 678 B10R0.22 CC=CCOCCS(=O)(=O)N 34a_100012334274_100000070051 [1,1,0,0,0,0|2,0,0]=4 679 B10R0.22 CC=CCSCCS(=O)(=O)C 62a_100000070051_100000230027 [1,1,0,0,0,0|2,0,0]=4 680 B10R0.22 CC=CCSCCS(=O)(=O)C 62a_100000731031_100000070051 [1,1,0,0,0,0|2,0,0]=4 681 B10R0.22 CC=CCSCCS(=O)(=O)[O-] 62a_100000070051_100000762736 [1,1,0,0,0,0|1,0,1]=4 682 B10R0.22 CC=CCSCCS(=O)(=O)[O-] 62a_100000762736_100000070051 [1,1,0,0,0,0|1,0,1]=4 683 B10R0.22 CCCNCCCS(=O)(=O)C 2230a_100000742409_100000210303 [1,1,0,0,0,0|1,0,1]=4 684 B10R0.22 CCCNCCCS(=O)(=O)C 34a_100000742409_100000210303 [1,1,0,0,0,0|1,0,1]=4 685 B10R0.22 CCNCCCNS(=O)(=O)C 34a_100000736790_100000210202 [1,1,0,0,0,0|1,0,1]=4 686 B10R0.22 COCNCCCS(=O)(=O)C 2230a_100000742409_100000766300 [1,1,0,0,0,0|1,0,1]=4 687 B10R0.22 CS(=O)(=O)CCCNCC=O 2230a_100000742409_200015260668 [1,1,0,0,0,0|1,0,0]=3 688 B10R0.22 CS(=O)(=O)CCCNCC=O 34a_100000742409_200009817547 [1,1,0,0,0,0|1,0,0]=3 689 B10R0.22 CS(=O)(=O)CCCNCCF 2230a_100000742409_100011217306 [1,1,0,0,0,0|1,0,1]=4 690 B10R0.22 CS(=O)(=O)CCCNCCF 34a_100000724931_100000754308 [1,1,0,0,0,0|1,0,1]=4 691 B10R0.22 CS(=O)(=O)CCCNCCF 34a_100000742409_100011217306 [1,1,0,0,0,0|1,0,1]=4 692 B10R0.22 CS(=O)(=O)CCCNCCO 2230a_100000742409_100000211926 [1,1,0,0,0,0|1,0,1]=4 693 B10R0.22 CS(=O)(=O)CCCNCCO 2230a_100016997473_100000754308 [1,1,0,0,0,0|1,0,1]=4 694 B10R0.22 CS(=O)(=O)CCCNCCO 34a_100000742409_100000211926 [1,1,0,0,0,0|1,0,1]=4 695 B10R0.22 CS(=O)(=O)CCCNCCO 34a_100016990907_100000754308 [1,1,0,0,0,0|1,0,1]=4 696 B10R0.22 CS(=O)(=O)CCCOCC=O 34a_100000689940_200009817547 [1,1,0,0,0,0|2,0,0]=4 697 B10R0.22 CS(=O)(=O)CCCOCC=O 7a_100000689940_200015260668 [1,1,0,0,0,0|2,0,0]=4 698 B10R0.22 CS(=O)(=O)CCCSCC=O 62a_100000754308_200015260668 [1,1,0,0,0,0|2,0,0]=4 699 B10R0.22 CS(=O)(=O)CCCSCC=O 62a_200015260668_100000754308 [1,1,0,0,0,0|2,0,0]=4 700 B10R0.22 CS(=O)(=O)NCCNCC=O 34a_100000752411_200009817547 [1,1,0,0,0,0|2,0,0]=4 701 B10R0.22 CSCNCCCS(=O)(=O)C 2230a_100000742409_100011218213 [1,1,0,0,0,0|1,0,1]=4 702 B10R0.22 CSCNCCCS(=O)(=O)C 34a_100000742409_100011218213 [1,1,0,0,0,0|1,0,1]=4 703 B10R0.22 NS(=O)(=O)CCCNCCF 34a_100000724931_100000750626 [1,1,0,0,0,0|1,0,1]=4 704 B10R0.22 NS(=O)(=O)CCCNCCO 2230a_100016997473_100000750626 [1,1,0,0,0,0|1,0,1]=4 705 B10R0.22 NS(=O)(=O)CCCNCCO 34a_100016990907_100000750626 [1,1,0,0,0,0|1,0,1]=4 706 B10R0.22 NS(=O)(=O)CCCSCC=O 62a_100000750626_200015260668 [1,1,0,0,0,0|2,0,0]=4 707 B10R0.22 NS(=O)(=O)CCCSCC=O 62a_200015260668_100000750626 [1,1,0,0,0,0|2,0,0]=4 708 B10R0.22 NS(=O)(=O)CSCCCC=O 62a_100000741382_200011292268 [1,1,0,0,0,0|2,0,0]=4 709 B10R0.22 NS(=O)(=O)CSCCCC=O 62a_200011292268_100000741382 [1,1,0,0,0,0|2,0,0]=4 710 B10R0.22 O=CCCCSCS(=O)(=O)[O-] 62a_100009817235_200011292268 [1,1,0,0,0,0|1,0,1]=4 711 B10R0.22 O=CCCCSCS(=O)(=O)[O-] 62a_200011292268_100009817235 [1,1,0,0,0,0|1,0,1]=4 712 B10R0.22 O=CCSCCCS(=O)(=O)[O-] 62a_100009813499_200015260668 [1,1,0,0,0,0|1,0,1]=4 713 B10R0.22 O=CCSCCCS(=O)(=O)[O-] 62a_200015260668_100009813499 [1,1,0,0,0,0|1,0,1]=4 714 B10R0.22 O=S(=O)([O-])CCCNCCF 34a_100000724931_100009813499 [1,1,0,0,0,0|0,0,2]=4 715 B10R0.22 O=S(=O)([O-])CCCNCCO 34a_100016990907_100009813499 [1,1,0,0,0,0|0,0,2]=4 716 B10R0.60 CCN(C)CCCS(=O)(=O)C 2230a_100000225621_100000754308 [1,1,0,0,0,0|1,0,1]=4 717 B10R0.60 CCN(C)CCCS(=O)(=O)C 269982a_100000225621_100000754308 [1,1,0,0,0,0|1,0,1]=4 718 B10R0.60 CCN(C)CCCS(=O)(=O)N 2230a_100000225621_100000750626 [1,1,0,0,0,0|1,0,1]=4 719 B10R0.60 CCN(C)CCCS(=O)(=O)N 269982a_100000225621_100000750626 [1,1,0,0,0,0|1,0,1]=4 720 B10R0.60 CCN(C)CCCS(=O)(=O)[O-] 269982a_100000225621_100009813499 [1,1,0,0,0,0|0,0,2]=4 721 B10R0.55 CC(=O)CCCCC(=O)CO 1458a_100000210174_100000735457 [1,1,0,0,0,0|2,0,0]=4 722 B10R0.55 CC(=O)NCCCC(=O)CF 1458a_100000194741_100015361967 [1,1,0,0,0,0|2,0,0]=4 723 B10R0.55 CC(=O)NCCNC(=O)CO 240690a_100000209853_100000210174 [1,1,0,0,0,0|2,0,0]=4 724 B10R0.55 CC(=O)NCCNC(=O)CO 527a_100000209853_100000210174 [1,1,0,0,0,0|2,0,0]=4 725 B10R0.55 CC(=O)OCCCC(=O)CO 1458a_100000210174_100000042594 [1,1,0,0,0,0|2,0,0]=4 726 B10R0.55 CC(=O)SCCCC(=O)CO 1458a_100000210174_100000038929 [1,1,0,0,0,0|2,0,0]=4 727 B10R0.55 CCC(=O)CCCNC(=O)C 1458a_100000194741_100000210202 [1,1,0,0,0,0|2,0,0]=4 728 B10R0.55 CCC(=O)NCCCC(=O)N 240690a_100000739312_100000210414 [1,1,0,0,0,0|2,0,0]=4 729 B10R0.55 CCC(=O)NCCCC(=O)N 527a_100000739312_100000210414 [1,1,0,0,0,0|2,0,0]=4 730 B10R0.55 CCC(=O)NCCCS(=O)C 11a_200000753449_100000210414 [1,1,0,0,0,0|1,0,1]=4 731 B10R0.55 CCC(=O)NCCCS(=O)C 240690a_200000753449_100000210414 [1,1,0,0,0,0|1,0,1]=4 732 B10R0.55 CCC(=O)NCCCS(=O)C 527a_200000753449_100000210414 [1,1,0,0,0,0|1,0,1]=4 733 B10R0.55 CNC(=O)CCCNC(=O)C 11a_100000740002_100015343762 [1,1,0,0,0,0|2,0,0]=4 734 B10R0.55 CNC(=O)CCCNC(=O)C 11a_106832991635_100000194741 [1,1,0,0,0,0|2,0,0]=4 735 B10R0.55 CNC(=O)CCCNC(=O)C 1626a_100102657272_100000194741 [1,1,0,0,0,0|2,0,0]=4 736 B10R0.55 CNC(=O)CCCNC(=O)C 240690a_100000740002_100015343762 [1,1,0,0,0,0|2,0,0]=4 737 B10R0.55 CNC(=O)CCCNC(=O)C 240690a_100102657272_100000194741 [1,1,0,0,0,0|2,0,0]=4 738 B10R0.55 CNC(=O)CCCNC(=O)C 527a_100000740002_100103153847 [1,1,0,0,0,0|2,0,0]=4 739 B10R0.55 CNC(=O)CCCNC(=O)C 527a_100102657272_100000194741 [1,1,0,0,0,0|2,0,0]=4 740 B10R0.55 CNC(=O)NCCCC(=O)N 273464a_100000739312_100102657272 [1,1,0,0,0,0|2,0,0]=4 741 B10R0.55 CNC(=O)NCCCC(=O)N 273464a_100102657272_100000739312 [1,1,0,0,0,0|2,0,0]=4 742 B10R0.55 CNC(=O)NCCCC(=O)N 512a_100000739312_100102657272 [1,1,0,0,0,0|2,0,0]=4 743 B10R0.55 CNC(=O)NCCCC(=O)N 512a_106832991638_100000739312 [1,1,0,0,0,0|2,0,0]=4 744 B10R0.55 CNC(=O)NCCCS(=O)C 2708a_100102657272_200000753449 [1,1,0,0,0,0|1,0,1]=4 745 B10R0.55 CNC(=O)NCCCS(=O)C 2708a_200000753449_106832991635 [1,1,0,0,0,0|1,0,1]=4 746 B10R0.55 CNC(=O)NCCCS(=O)C 273464a_100102657272_200000753449 [1,1,0,0,0,0|1,0,1]=4 747 B10R0.55 CNC(=O)NCCCS(=O)C 273464a_200000753449_100102657272 [1,1,0,0,0,0|1,0,1]=4 748 B10R0.55 CNC(=O)NCCCS(=O)C 512a_106832991638_200000753449 [1,1,0,0,0,0|1,0,1]=4 749 B10R0.55 CNC(=O)NCCCS(=O)C 512a_200000753449_100102657272 [1,1,0,0,0,0|1,0,1]=4 750 B10R0.55 COC(=O)CCCCC(=O)C 1458a_100000070787_100000204269 [1,1,0,0,0,0|2,0,0]=4 751 B10R0.55 COC(=O)CCCCC(=O)C 1458a_100000695723_200000210301 [1,1,0,0,0,0|2,0,0]=4 752 B10R0.55 COC(=O)CCCCC(=O)[13CH3] 1458a_100000695723_200025704644 [1,1,0,0,0,0|2,0,0]=4 753 B10R0.55 COC(=O)CCCNC(=O)C 188690a_100000184769_100015343762 [1,1,0,0,0,0|1,0,0]=3 754 B10R0.55 COC(=O)NCCCC(=O)C 1458a_100000753017_200000210301 [1,1,0,0,0,0|2,0,0]=4 755 B10R0.55 COC(=O)NCCCC(=O)[13CH3] 1458a_100000753017_200025704644 [1,1,0,0,0,0|2,0,0]=4 756 B10R0.55 CS(=O)CCCNC(=O)CO 240690a_200000753449_100000210174 [1,1,0,0,0,0|1,0,1]=4 757 B10R0.55 CS(=O)CCCNC(=O)CO 527a_200000753449_100000210174 [1,1,0,0,0,0|1,0,1]=4 758 B10R0.55 NC(=O)CCCNC(=O)CO 240690a_100000739312_100000210174 [1,1,0,0,0,0|2,0,0]=4 759 B10R0.55 NC(=O)CCCNC(=O)CO 527a_100000739312_100000210174 [1,1,0,0,0,0|2,0,0]=4 760 B10R0.31 CC(=O)CC(O)CS(=O)(=O)[O-] 1458a_100000070787_100016993520 [0,1,0,0,1,0|0,0,1]=3 761 B10R0.65 CCS(=O)(=O)CCNC(=O)C 11a_100000751051_100015343762 [0,1,0,0,1,0|1,0,0]=3 762 B10R0.65 CCS(=O)(=O)CCNC(=O)C 1626a_100000751051_100015343762 [0,1,0,0,1,0|1,0,0]=3 763 B10R0.65 CCS(=O)(=O)CCNC(=O)C 240690a_100000751051_100015343762 [0,1,0,0,1,0|1,0,0]=3 764 B10R0.65 CCS(=O)(=O)CCNC(=O)C 527a_100000751051_100103153847 [0,1,0,0,1,0|1,0,0]=3 765 B10R0.65 CNS(=O)(=O)CCNC(=O)C 11a_100000710037_100015343762 [0,1,0,0,1,0|1,0,0]=3 766 B10R0.65 CNS(=O)(=O)CCNC(=O)C 240690a_100000710037_100015343762 [0,1,0,0,1,0|1,0,0]=3 767 B10R0.65 CNS(=O)(=O)CCNC(=O)C 527a_100000710037_100103153847 [0,1,0,0,1,0|1,0,0]=3 768 B10R0.65 CNS(=O)(=O)CCOC(=O)C 270084a_100102657272_200000119425 [0,1,0,0,1,0|2,0,0]=4 769 B10R0.65 CNS(=O)(=O)CCOC(=O)C 274078a_100102657272_200000119425 [0,1,0,0,1,0|2,0,0]=4 770 B10R0.92 CC(=O)C(C)OCS(=O)(=O)[O-] 34a_100000212229_100009817235 [0,1,0,0,1,0|1,0,1]=4 771 B10R0.92 CC(=O)C(C)SCS(=O)(=O)N 62a_100000741382_100009814033 [0,1,0,0,1,0|2,0,0]=4 772 B10R0.92 CC(=O)C(C)SCS(=O)(=O)N 62a_100009814033_100000741382 [0,1,0,0,1,0|2,0,0]=4 773 B10R0.92 CC(=O)C(C)SCS(=O)(=O)[O-] 62a_100009814033_100009817235 [0,1,0,0,1,0|1,0,1]=4 774 B10R0.92 CC(=O)C(C)SCS(=O)(=O)[O-] 62a_100009817235_100009814033 [0,1,0,0,1,0|1,0,1]=4 775 B10R0.92 CC(=O)N(C)CCS(=O)(=O)C 11a_100000750128_100015343762 [0,1,0,0,1,0|1,0,0]=3 776 B10R0.92 CC(=O)N(C)CCS(=O)(=O)C 1626a_100000750128_100015343762 [0,1,0,0,1,0|1,0,0]=3 777 B10R0.92 CC(=O)N(C)CCS(=O)(=O)C 240690a_100000750128_100015343762 [0,1,0,0,1,0|1,0,0]=3 778 B10R0.92 CC(=O)N(C)CCS(=O)(=O)C 527a_100000750128_100103153847 [0,1,0,0,1,0|1,0,0]=3 779 B10R0.113 CS(=O)(=O)CCNS(=O)(=O)C 40a_100000740961_100000738038 [0,1,0,0,1,0|2,0,0]=4 780 B12R0.66 C=C(C)CN(C)CCCS(=O)(=O)C 2230a_100000225649_100000754308 [0,1,0,0,0,1|2,0,0]=4 781 B12R0.66 C=C(C)CN(C)CCCS(=O)(=O)C 269982a_100000225649_100000754308 [0,1,0,0,0,1|2,0,0]=4 782 B12R0.66 C=C(C)CN(C)CCCS(=O)(=O)N 2230a_100000225649_100000750626 [0,1,0,0,0,1|2,0,0]=4 783 B12R0.66 C=C(C)CN(C)CCCS(=O)(=O)N 269982a_100000225649_100000750626 [0,1,0,0,0,1|2,0,0]=4 784 B12R0.66 C=C(C)CN(C)CCCS(=O)(=O)[O-] 269982a_100000225649_100009813499 [0,1,0,0,0,1|1,0,1]=4 785 B12R0.66 CC(=O)NC(=O)CSCS(=O)(=O)N 62a_100000741382_100000183797 [0,1,0,0,0,1|1,0,1]=4 786 B12R0.66 CC(=O)NC(=O)CSCS(=O)(=O)[O-] 62a_100009817235_100000183797 [0,1,0,0,0,1|0,0,2]=4 787 B12R0.66 CC(=O)OC(C)SCCS(=O)(=O)C 62a_100000731031_100009818208 [0,1,0,0,0,1|2,0,0]=4 788 B12R0.66 CC(=O)OC(C)SCCS(=O)(=O)C 62a_100009818208_100000230027 [0,1,0,0,0,1|2,0,0]=4 789 B12R0.66 CC(=O)OC(C)SCCS(=O)(=O)[O-] 62a_100000762736_100009818208 [0,1,0,0,0,1|1,0,1]=4 790 B12R0.66 CC(=O)OC(C)SCCS(=O)(=O)[O-] 62a_100009818208_100000762736 [0,1,0,0,0,1|1,0,1]=4 791 B12R0.66 CN(CCCS(=O)(=O)C)CC(=O)N 2230a_100000739694_100000754308 [0,1,0,0,0,1|2,0,0]=4 792 B12R0.66 CN(CCCS(=O)(=O)C)CC(=O)O 269956a_100000746989_100000754308 [0,1,0,0,0,1|2,0,0]=4 793 B12R0.66 CN(CCCS(=O)(=O)N)CC(=O)N 2230a_100000739694_100000750626 [0,1,0,0,0,1|2,0,0]=4 794 B12R0.66 CN(CCCS(=O)(=O)N)CC(=O)O 269956a_100000746989_100000750626 [0,1,0,0,0,1|2,0,0]=4 795 B12R0.66 CN(CCCS(=O)(=O)[O-])CC(=O)O 269956a_100000746989_100009813499 [0,1,0,0,0,1|1,0,1]=4 796 B12R0.140 CC(=O)CCCC(=O)CS(=O)(=O)C 1458a_100000744497_100011215641 [0,1,0,0,0,1|2,0,0]=4 797 B12R0.140 CC(=O)COCC(O)CS(=O)(=O)[O-] 34a_100000211253_100016993520 [0,1,0,0,0,1|1,0,1]=4 798 B12R0.140 CC(=O)NCCC(=O)CS(=O)(=O)C 1458a_100000744497_100000189650 [0,1,0,0,0,1|1,0,0]=3 799 B12R0.140 CC(=O)NCCC(=O)CS(=O)(=O)N 1458a_100000183196_100000741382 [0,1,0,0,0,1|1,0,0]=3 800 B12R0.140 CC(=O)NCCC(=O)CS(=O)(=O)[O-] 1458a_100000183196_100009817235 [0,1,0,0,0,1|0,0,1]=3 801 B12R0.140 CC(=O)NCCC(=O)NS(=O)(=O)C 2740a_100000171171_100000183196 [0,1,0,0,0,1|1,0,1]=4 802 B12R0.140 CC(=O)OCCC(=O)CS(=O)(=O)C 1458a_100000744497_100009814007 [0,1,0,0,0,1|2,0,0]=4 803 B12R0.140 CC(=O)SCCC(=O)CS(=O)(=O)N 1458a_100000048949_100000741382 [0,1,0,0,0,1|2,0,0]=4 804 B12R0.140 CC(=O)SCCC(=O)CS(=O)(=O)[O-] 1458a_100000048949_100009817235 [0,1,0,0,0,1|1,0,1]=4 805 B12R0.140 CS(=O)(=O)CC(=O)CCNC(=O)N 1458a_100000744497_200000034859 [0,1,0,0,0,1|2,0,0]=4 806 B12R0.140 NC(=O)NCCC(=O)CS(=O)(=O)N 1458a_100000181464_100000741382 [0,1,0,0,0,1|2,0,0]=4 807 B12R0.140 NC(=O)NCCC(=O)CS(=O)(=O)[O-] 1458a_100000181464_100009817235 [0,1,0,0,0,1|1,0,1]=4 808 B12R0.140 O=C(O)CNCC(O)CS(=O)(=O)[O-] 269956a_100016091260_100016993520 [0,1,0,0,0,1|1,0,1]=4 809 B12R0.150 C=CC(=O)NCCCNS(=O)(=O)C 1626a_100000736790_100000185746 [0,1,0,0,0,1|1,0,1]=4 810 B12R0.150 C=CC(=O)NCCCNS(=O)(=O)C 240690a_100000736790_200121576911 [0,1,0,0,0,1|1,0,1]=4 811 B12R0.150 C=CC(=O)NCCOCS(=O)(=O)[O-] 34a_100011304386_100009817235 [0,1,0,0,0,1|0,0,2]=4 812 B12R0.150 CCC(=O)COCCCS(=O)(=O)C 34a_100000725409_100000754308 [0,1,0,0,0,1|2,0,0]=4 813 B12R0.150 CCC(=O)COCCCS(=O)(=O)C 7a_100000689940_100000747405 [0,1,0,0,0,1|2,0,0]=4 814 B12R0.150 CCC(=O)COCCCS(=O)(=O)N 34a_100000725409_100000750626 [0,1,0,0,0,1|2,0,0]=4 815 B12R0.150 CCC(=O)COCCCS(=O)(=O)[O-] 34a_100000725409_100009813499 [0,1,0,0,0,1|1,0,1]=4 816 B12R0.150 CCC(=O)CSCCCS(=O)(=O)C 62a_100000747405_100000754308 [0,1,0,0,0,1|2,0,0]=4 817 B12R0.150 CCC(=O)CSCCCS(=O)(=O)C 62a_100000754308_100000747405 [0,1,0,0,0,1|2,0,0]=4 818 B12R0.150 CCC(=O)CSCCCS(=O)(=O)N 62a_100000747405_100000750626 [0,1,0,0,0,1|2,0,0]=4 819 B12R0.150 CCC(=O)CSCCCS(=O)(=O)N 62a_100000750626_100000747405 [0,1,0,0,0,1|2,0,0]=4 820 B12R0.150 CCC(=O)CSCCCS(=O)(=O)[O-] 62a_100000747405_100009813499 [0,1,0,0,0,1|1,0,1]=4 821 B12R0.150 CCC(=O)CSCCCS(=O)(=O)[O-] 62a_100009813499_100000747405 [0,1,0,0,0,1|1,0,1]=4 822 B12R0.150 CCC(=O)NCCCNS(=O)(=O)C 11a_100000736790_100000210414 [0,1,0,0,0,1|1,0,0]=3 823 B12R0.150 CCC(=O)NCCCNS(=O)(=O)C 1626a_100000736790_100000210414 [0,1,0,0,0,1|1,0,0]=3 824 B12R0.150 CCC(=O)NCCCNS(=O)(=O)C 240690a_100000736790_100000210414 [0,1,0,0,0,1|1,0,0]=3 825 B12R0.150 CCC(=O)NCCCNS(=O)(=O)C 527a_100000736790_100000210414 [0,1,0,0,0,1|1,0,0]=3 826 B12R0.150 CCC(=O)NCCNCS(=O)(=O)[O-] 34a_100132302217_100009817235 [0,1,0,0,0,1|0,0,1]=3 827 B12R0.150 CCC(=O)NCCOCS(=O)(=O)[O-] 34a_200000158885_100009817235 [0,1,0,0,0,1|0,0,1]=3 828 B12R0.150 CNC(=O)CCCNCS(=O)(=O)[O-] 34a_100000740002_100009817235 [0,1,0,0,0,1|1,0,1]=4 829 B12R0.150 CNC(=O)CCCSCS(=O)(=O)N 62a_100000741382_100000741757 [0,1,0,0,0,1|2,0,0]=4 830 B12R0.150 CNC(=O)CCCSCS(=O)(=O)N 62a_100000741757_100000741382 [0,1,0,0,0,1|2,0,0]=4 831 B12R0.150 CNC(=O)CCCSCS(=O)(=O)[O-] 62a_100000741757_100009817235 [0,1,0,0,0,1|1,0,1]=4 832 B12R0.150 CNC(=O)CCCSCS(=O)(=O)[O-] 62a_100009817235_100000741757 [0,1,0,0,0,1|1,0,1]=4 833 B12R0.150 CNC(=O)CCNCCS(=O)(=O)C 2230a_100000738227_100000731031 [0,1,0,0,0,1|2,0,0]=4 834 B12R0.150 CNC(=O)CCNCCS(=O)(=O)C 2230a_100000740961_100000737683 [0,1,0,0,0,1|2,0,0]=4 835 B12R0.150 CNC(=O)CCNCCS(=O)(=O)C 34a_100000738227_100000731031 [0,1,0,0,0,1|2,0,0]=4 836 B12R0.150 CNC(=O)CCNCCS(=O)(=O)C 34a_100000740961_100012179268 [0,1,0,0,0,1|2,0,0]=4 837 B12R0.150 CNC(=O)CCNCCS(=O)(=O)N 2230a_100000738205_100000737683 [0,1,0,0,0,1|2,0,0]=4 838 B12R0.150 CNC(=O)CCNCCS(=O)(=O)N 34a_100000738205_100012179268 [0,1,0,0,0,1|2,0,0]=4 839 B12R0.150 CNC(=O)CCNCCS(=O)(=O)[O-] 2230a_100000738227_100000737633 [0,1,0,0,0,1|1,0,1]=4 840 B12R0.150 CNC(=O)CCNCCS(=O)(=O)[O-] 34a_100000738227_100000762736 [0,1,0,0,0,1|1,0,1]=4 841 B12R0.150 CNC(=O)CCOCCS(=O)(=O)C 34a_100000211924_100012179268 [0,1,0,0,0,1|2,0,0]=4 842 B12R0.150 CNC(=O)CCOCCS(=O)(=O)C 34a_100000754576_100000731031 [0,1,0,0,0,1|2,0,0]=4 843 B12R0.150 CNC(=O)CCOCCS(=O)(=O)C 7a_100000211924_100000737683 [0,1,0,0,0,1|2,0,0]=4 844 B12R0.150 CNC(=O)CCOCCS(=O)(=O)N 34a_100012334274_100012179268 [0,1,0,0,0,1|2,0,0]=4 845 B12R0.150 CNC(=O)CCOCCS(=O)(=O)[O-] 34a_100000754576_100000762736 [0,1,0,0,0,1|1,0,1]=4 846 B12R0.150 CNC(=O)CCSCCS(=O)(=O)C 62a_100000731031_100000737683 [0,1,0,0,0,1|2,0,0]=4 847 B12R0.150 CNC(=O)CCSCCS(=O)(=O)C 62a_100000737683_100000230027 [0,1,0,0,0,1|2,0,0]=4 848 B12R0.150 CNC(=O)CCSCCS(=O)(=O)[O-] 62a_100000737683_100000762736 [0,1,0,0,0,1|1,0,1]=4 849 B12R0.150 CNC(=O)CCSCCS(=O)(=O)[O-] 62a_100000762736_100000737683 [0,1,0,0,0,1|1,0,1]=4 850 B12R0.150 CNC(=O)CNCCCS(=O)(=O)C 2230a_100000693194_100000754308 [0,1,0,0,0,1|1,0,0]=3 851 B12R0.150 CNC(=O)CNCCCS(=O)(=O)C 2230a_100000742409_100000183359 [0,1,0,0,0,1|1,0,0]=3 852 B12R0.150 CNC(=O)CNCCCS(=O)(=O)C 34a_100000742409_100000183359 [0,1,0,0,0,1|1,0,0]=3 853 B12R0.150 CNC(=O)CNCCCS(=O)(=O)N 2230a_100000693194_100000750626 [0,1,0,0,0,1|1,0,0]=3 854 B12R0.150 CNC(=O)CNCCNS(=O)(=O)C 2230a_100000693194_100000754112 [0,1,0,0,0,1|2,0,0]=4 855 B12R0.150 CNC(=O)CNCCNS(=O)(=O)C 34a_100000752411_100000183359 [0,1,0,0,0,1|2,0,0]=4 856 B12R0.150 CNC(=O)CNCCOS(=O)(=O)C 2230a_100000693194_200000036756 [0,1,0,0,0,1|2,0,0]=4 857 B12R0.150 CNC(=O)COCCCS(=O)(=O)C 34a_100000689940_100000183359 [0,1,0,0,0,1|2,0,0]=4 858 B12R0.150 CNC(=O)COCCCS(=O)(=O)C 34a_100000750040_100000754308 [0,1,0,0,0,1|2,0,0]=4 859 B12R0.150 CNC(=O)COCCCS(=O)(=O)C 7a_100000689940_100000183359 [0,1,0,0,0,1|2,0,0]=4 860 B12R0.150 CNC(=O)COCCCS(=O)(=O)N 34a_100000750040_100000750626 [0,1,0,0,0,1|2,0,0]=4 861 B12R0.150 CNC(=O)COCCCS(=O)(=O)[O-] 34a_100000750040_100009813499 [0,1,0,0,0,1|1,0,1]=4 862 B12R0.150 CNC(=O)CSCCCS(=O)(=O)C 62a_100000183359_100000754308 [0,1,0,0,0,1|2,0,0]=4 863 B12R0.150 CNC(=O)CSCCCS(=O)(=O)C 62a_100000754308_100000183359 [0,1,0,0,0,1|2,0,0]=4 864 B12R0.150 CNC(=O)CSCCCS(=O)(=O)N 62a_100000183359_100000750626 [0,1,0,0,0,1|2,0,0]=4 865 B12R0.150 CNC(=O)CSCCCS(=O)(=O)N 62a_100000750626_100000183359 [0,1,0,0,0,1|2,0,0]=4 866 B12R0.150 CNC(=O)CSCCCS(=O)(=O)[O-] 62a_100000183359_100009813499 [0,1,0,0,0,1|1,0,1]=4 867 B12R0.150 CNC(=O)CSCCCS(=O)(=O)[O-] 62a_100009813499_100000183359 [0,1,0,0,0,1|1,0,1]=4 868 B12R0.150 CNC(=O)NCCCNS(=O)(=O)C 2708a_100102657272_100000736790 [0,1,0,0,0,1|1,0,0]=3 869 B12R0.150 CNC(=O)NCCCNS(=O)(=O)C 273464a_100000736790_100102657272 [0,1,0,0,0,1|1,0,0]=3 870 B12R0.150 CNC(=O)NCCCNS(=O)(=O)C 273464a_100102657272_100000736790 [0,1,0,0,0,1|1,0,0]=3 871 B12R0.150 CNC(=O)NCCCNS(=O)(=O)C 512a_100000736790_100102657272 [0,1,0,0,0,1|1,0,0]=3 872 B12R0.150 CNC(=O)NCCCNS(=O)(=O)C 512a_106832991638_100000736790 [0,1,0,0,0,1|1,0,0]=3 873 B12R0.150 CNC(=O)NCCNCS(=O)(=O)[O-] 34a_100015205895_100009817235 [0,1,0,0,0,1|0,0,1]=3 874 B12R0.150 CNC(=O)OCCSCS(=O)(=O)N 62a_100000741382_200011997002 [0,1,0,0,0,1|2,0,0]=4 875 B12R0.150 CNC(=O)OCCSCS(=O)(=O)N 62a_200011997002_100000741382 [0,1,0,0,0,1|2,0,0]=4 876 B12R0.150 CNC(=O)OCCSCS(=O)(=O)[O-] 62a_100009817235_200011997002 [0,1,0,0,0,1|1,0,1]=4 877 B12R0.150 CNC(=O)OCCSCS(=O)(=O)[O-] 62a_200011997002_100009817235 [0,1,0,0,0,1|1,0,1]=4 878 B12R0.150 COC(=O)CCCSCS(=O)(=O)N 62a_100000741382_100011218270 [0,1,0,0,0,1|2,0,0]=4 879 B12R0.150 COC(=O)CCCSCS(=O)(=O)N 62a_100011218270_100000741382 [0,1,0,0,0,1|2,0,0]=4 880 B12R0.150 COC(=O)CCCSCS(=O)(=O)[O-] 62a_100009817235_100011218270 [0,1,0,0,0,1|1,0,1]=4 881 B12R0.150 COC(=O)CCCSCS(=O)(=O)[O-] 62a_100011218270_100009817235 [0,1,0,0,0,1|1,0,1]=4 882 B12R0.150 COC(=O)CCNCCS(=O)(=O)C 2230a_100000740961_100000204255 [0,1,0,0,0,1|2,0,0]=4 883 B12R0.150 COC(=O)CCNCCS(=O)(=O)C 34a_100000740961_100000742370 [0,1,0,0,0,1|2,0,0]=4 884 B12R0.150 COC(=O)CCNCCS(=O)(=O)N 2230a_100000738205_100000204255 [0,1,0,0,0,1|2,0,0]=4 885 B12R0.150 COC(=O)CCNCCS(=O)(=O)N 34a_100000738205_100000742370 [0,1,0,0,0,1|2,0,0]=4 886 B12R0.150 COC(=O)CCOCCS(=O)(=O)C 34a_100000211924_100000742370 [0,1,0,0,0,1|2,0,0]=4 887 B12R0.150 COC(=O)CCOCCS(=O)(=O)C 7a_100000211924_100000204255 [0,1,0,0,0,1|2,0,0]=4 888 B12R0.150 COC(=O)CCOCCS(=O)(=O)N 34a_100012334274_100000742370 [0,1,0,0,0,1|2,0,0]=4 889 B12R0.150 COC(=O)CCSCCS(=O)(=O)C 62a_100000204255_100000230027 [0,1,0,0,0,1|2,0,0]=4 890 B12R0.150 COC(=O)CCSCCS(=O)(=O)C 62a_100000731031_100000204255 [0,1,0,0,0,1|2,0,0]=4 891 B12R0.150 COC(=O)CCSCCS(=O)(=O)[O-] 62a_100000204255_100000762736 [0,1,0,0,0,1|1,0,1]=4 892 B12R0.150 COC(=O)CCSCCS(=O)(=O)[O-] 62a_100000762736_100000204255 [0,1,0,0,0,1|1,0,1]=4 893 B12R0.150 COC(=O)CNCCCS(=O)(=O)C 2230a_100000742409_100000747449 [0,1,0,0,0,1|1,0,0]=3 894 B12R0.150 COC(=O)CNCCCS(=O)(=O)C 34a_100000742409_100000747449 [0,1,0,0,0,1|1,0,0]=3 895 B12R0.150 COC(=O)CNCCNS(=O)(=O)C 34a_100000752411_100000747449 [0,1,0,0,0,1|2,0,0]=4 896 B12R0.150 COC(=O)COCCCS(=O)(=O)C 34a_100000689940_100000747449 [0,1,0,0,0,1|2,0,0]=4 897 B12R0.150 COC(=O)COCCCS(=O)(=O)C 7a_100000689940_100000747449 [0,1,0,0,0,1|2,0,0]=4 898 B12R0.150 COC(=O)CSCCCS(=O)(=O)C 62a_100000747449_100000754308 [0,1,0,0,0,1|2,0,0]=4 899 B12R0.150 COC(=O)CSCCCS(=O)(=O)C 62a_100000754308_100000747449 [0,1,0,0,0,1|2,0,0]=4 900 B12R0.150 COC(=O)CSCCCS(=O)(=O)N 62a_100000747449_100000750626 [0,1,0,0,0,1|2,0,0]=4 901 B12R0.150 COC(=O)CSCCCS(=O)(=O)N 62a_100000750626_100000747449 [0,1,0,0,0,1|2,0,0]=4 902 B12R0.150 COC(=O)CSCCCS(=O)(=O)[O-] 62a_100000747449_100009813499 [0,1,0,0,0,1|1,0,1]=4 903 B12R0.150 COC(=O)CSCCCS(=O)(=O)[O-] 62a_100009813499_100000747449 [0,1,0,0,0,1|1,0,1]=4 904 B12R0.150 COC(=O)NCCOCS(=O)(=O)[O-] 34a_100000757965_100009817235 [0,1,0,0,0,1|0,0,1]=3 905 B12R0.150 COC(=O)OCCOCS(=O)(=O)[O-] 34a_100010262106_100009817235 [0,1,0,0,0,1|1,0,1]=4 906 B12R0.150 COC(=O)OCSCCS(=O)(=O)C 62a_100000731031_100000139417 [0,1,0,0,0,1|2,0,0]=4 907 B12R0.150 COC(=O)OCSCCS(=O)(=O)[O-] 62a_100000762736_100000139417 [0,1,0,0,0,1|1,0,1]=4 908 B12R0.150 CS(=O)(=O)NCCCNC(=O)CO 240690a_100000736790_100000210174 [0,1,0,0,0,1|1,0,0]=3 909 B12R0.150 CS(=O)(=O)NCCCNC(=O)CO 527a_100000736790_100000210174 [0,1,0,0,0,1|1,0,0]=3 910 B12R0.210 CC(=O)NCCCNS(=O)(=O)CCl 270084a_100000736810_100000031410 [0,1,0,0,0,1|1,0,0]=3 911 B12R0.210 CC(=O)NCCCNS(=O)(=O)CCl 274078a_100000736810_100000031410 [0,1,0,0,0,1|1,0,0]=3 912 B12R0.210 CCS(=O)(=O)CCNCOC(=O)C 34a_100000751051_100009813279 [0,1,0,0,0,1|2,0,0]=4 913 B12R0.210 CCS(=O)(=O)CCOCCC(=O)C 34a_100000759926_100000756660 [0,1,0,0,0,1|2,0,0]=4 914 B12R0.210 CCS(=O)(=O)CCOCCC(=O)C 7a_100000759926_100000756660 [0,1,0,0,0,1|2,0,0]=4 915 B12R0.210 CCS(=O)(=O)CCOCCC(=O)C 7a_200011216379_100000053229 [0,1,0,0,0,1|2,0,0]=4 916 B12R0.210 CCS(=O)(=O)CCOCOC(=O)C 34a_200011216379_100009813279 [0,1,0,0,0,1|2,0,0]=4 917 B12R0.210 CCS(=O)(=O)CCSCCC(=O)C 62a_100000053229_100000756660 [0,1,0,0,0,1|2,0,0]=4 918 B12R0.210 CCS(=O)(=O)CCSCCC(=O)C 62a_100000756660_100000053229 [0,1,0,0,0,1|2,0,0]=4 919 B12R0.210 CCS(=O)(=O)CCSCOC(=O)C 62a_100000076356_100000756660 [0,1,0,0,0,1|2,0,0]=4 920 B12R0.210 CCS(=O)(=O)CCSCOC(=O)C 62a_100000756660_100000076356 [0,1,0,0,0,1|2,0,0]=4 921 B12R0.210 CCS(=O)(=O)NCCCNC(=O)C 270084a_100000736810_100000211323 [0,1,0,0,0,1|1,0,0]=3 922 B12R0.210 CCS(=O)(=O)NCCCNC(=O)C 274078a_100000736810_100000211323 [0,1,0,0,0,1|1,0,0]=3 923 B12R0.210 CCS(=O)(=O)NCCCNC(=O)C 40a_100000736810_100000053943 [0,1,0,0,0,1|1,0,0]=3 924 B12R0.210 CNS(=O)(=O)CCNCOC(=O)C 34a_100000710037_100009813279 [0,1,0,0,0,1|2,0,0]=4 925 B12R0.264 C=C(C)C(=O)NCCCS(=O)(=O)C 11a_100000742409_100000185857 [0,1,0,0,0,1|2,0,0]=4 926 B12R0.264 C=C(C)C(=O)NCCCS(=O)(=O)C 1626a_100000742409_100000185857 [0,1,0,0,0,1|2,0,0]=4 927 B12R0.264 C=C(C)C(C)NCCCS(=O)(=O)C 269862a_100000742409_100011216138 [0,1,0,0,0,1|2,0,0]=4 928 B12R0.264 CC(=O)C(=O)CNCCS(=O)(=O)C 34a_100000740961_100011261029 [0,1,0,0,0,1|2,0,0]=4 929 B12R0.264 CC(=O)C(=O)CNCCS(=O)(=O)N 34a_100000738205_100011261029 [0,1,0,0,0,1|2,0,0]=4 930 B12R0.264 CC(=O)C(=O)COCCS(=O)(=O)C 34a_100000211924_100011261029 [0,1,0,0,0,1|2,0,0]=4 931 B12R0.264 CC(=O)C(=O)COCCS(=O)(=O)N 34a_100012334274_100011261029 [0,1,0,0,0,1|2,0,0]=4 932 B12R0.264 CC(=O)C(=O)CSCCS(=O)(=O)C 62a_100000731031_100011261029 [0,1,0,0,0,1|2,0,0]=4 933 B12R0.264 CC(=O)C(=O)CSCCS(=O)(=O)C 62a_100011261029_100000230027 [0,1,0,0,0,1|2,0,0]=4 934 B12R0.264 CC(=O)C(=O)CSCCS(=O)(=O)[O-] 62a_100000762736_100011261029 [0,1,0,0,0,1|1,0,1]=4 935 B12R0.264 CC(=O)C(=O)CSCCS(=O)(=O)[O-] 62a_100011261029_100000762736 [0,1,0,0,0,1|1,0,1]=4 936 B12R0.264 CC(=O)C(C)COCCS(=O)(=O)C 34a_100000032740_100000731031 [0,1,0,0,0,1|2,0,0]=4 937 B12R0.264 CC(=O)C(C)COCCS(=O)(=O)C 7a_100000032740_100000230027 [0,1,0,0,0,1|2,0,0]=4 938 B12R0.264 CC(=O)C(C)COCCS(=O)(=O)[O-] 34a_100000032740_100000762736 [0,1,0,0,0,1|1,0,1]=4 939 B12R0.264 CC(=O)C(C)NCCCS(=O)(=O)C 2230a_100000742409_100009814033 [0,1,0,0,0,1|1,0,0]=3 940 B12R0.264 CC(=O)C(C)OCCCS(=O)(=O)C 34a_100000212229_100000754308 [0,1,0,0,0,1|2,0,0]=4 941 B12R0.264 CC(=O)C(C)OCCCS(=O)(=O)C 7a_100000689940_100000179758 [0,1,0,0,0,1|2,0,0]=4 942 B12R0.264 CC(=O)C(C)OCCCS(=O)(=O)N 34a_100000212229_100000750626 [0,1,0,0,0,1|2,0,0]=4 943 B12R0.264 CC(=O)C(C)OCCCS(=O)(=O)[O-] 34a_100000212229_100009813499 [0,1,0,0,0,1|1,0,1]=4 944 B12R0.264 CC(=O)C(C)SCCCS(=O)(=O)C 62a_100000754308_100009814033 [0,1,0,0,0,1|2,0,0]=4 945 B12R0.264 CC(=O)C(C)SCCCS(=O)(=O)C 62a_100009814033_100000754308 [0,1,0,0,0,1|2,0,0]=4 946 B12R0.264 CC(=O)C(C)SCCCS(=O)(=O)N 62a_100000750626_100009814033 [0,1,0,0,0,1|2,0,0]=4 947 B12R0.264 CC(=O)C(C)SCCCS(=O)(=O)N 62a_100009814033_100000750626 [0,1,0,0,0,1|2,0,0]=4 948 B12R0.264 CC(=O)C(C)SCCCS(=O)(=O)[O-] 62a_100009813499_100009814033 [0,1,0,0,0,1|1,0,1]=4 949 B12R0.264 CC(=O)C(C)SCCCS(=O)(=O)[O-] 62a_100009814033_100009813499 [0,1,0,0,0,1|1,0,1]=4 950 B12R0.264 CC(NCCCS(=O)(=O)C)C(=O)N 2230a_100000742409_100000702099 [0,1,0,0,0,1|2,0,0]=4 951 B12R0.264 CC(NCCCS(=O)(=O)C)C(=O)N 34a_100000742409_100000702099 [0,1,0,0,0,1|2,0,0]=4 952 B12R0.264 CS(=O)(=O)CCCNC(=O)C(=O)N 240690a_100000742409_100011215815 [0,1,0,0,0,1|2,0,0]=4 953 B12R0.264 CS(=O)(=O)CCCNC(F)C(=O)N 2230a_100000742409_100009813875 [0,1,0,0,0,1|2,0,0]=4 954 B12R0.264 CS(=O)(=O)CCCNC(F)C(=O)N 34a_100000742409_100009813875 [0,1,0,0,0,1|2,0,0]=4 955 B12R0.264 CS(=O)(=O)CCCNC(F)C(=O)[O-] 34a_100000742409_100020610796 [0,1,0,0,0,1|2,0,0]=4 956 B12R0.264 C[C@@H](NCCCS(=O)(=O)C)C(=O)N 2230a_100000119354_100000754308 [0,1,0,0,0,1|2,0,0]=4 957 B12R0.264 C[C@@H](NCCCS(=O)(=O)C)C(=O)N 34a_100000119354_100000754308 [0,1,0,0,0,1|2,0,0]=4 958 B12R0.264 C[C@@H](NCCCS(=O)(=O)N)C(=O)N 2230a_100000119354_100000750626 [0,1,0,0,0,1|2,0,0]=4 959 B12R0.264 C[C@@H](NCCCS(=O)(=O)N)C(=O)N 34a_100000119354_100000750626 [0,1,0,0,0,1|2,0,0]=4 960 B12R0.264 C[C@@H](NCCCS(=O)(=O)[O-])C(=O)N 34a_100000119354_100009813499 [0,1,0,0,0,1|1,0,1]=4 961 B12R0.264 C[C@H](NCCCS(=O)(=O)C)C(=O)O 269956a_100000743915_100000754308 [0,1,0,0,0,1|2,0,0]=4 962 B12R0.264 C[C@H](NCCCS(=O)(=O)N)C(=O)O 269956a_100000743915_100000750626 [0,1,0,0,0,1|2,0,0]=4 963 B12R0.264 C[C@H](NCCCS(=O)(=O)[O-])C(=O)O 269956a_100000743915_100009813499 [0,1,0,0,0,1|1,0,1]=4 964 B12R0.269 CC(=O)CCSCC(O)S(=O)(=O)[O-] 62a_100000053229_200000035551 [0,1,0,0,0,1|1,0,1]=4 965 B12R0.269 CC(=O)CCSCC(O)S(=O)(=O)[O-] 62a_200000035551_100000053229 [0,1,0,0,0,1|1,0,1]=4 966 B12R0.269 CC(=O)OCSCC(O)S(=O)(=O)[O-] 62a_100000076356_200000035551 [0,1,0,0,0,1|1,0,1]=4 967 B12R0.269 CC(=O)OCSCC(O)S(=O)(=O)[O-] 62a_200000035551_100000076356 [0,1,0,0,0,1|1,0,1]=4 968 B12R0.390 CC(=O)CCN(C)CCS(=O)(=O)C 269982a_100000750128_100000053229 [0,1,0,0,0,1|2,0,0]=4 969 B12R0.390 CC(=O)NCC(=O)CCS(=O)(=O)C 1458a_100000194580_100000731031 [0,1,0,0,0,1|1,0,0]=3 970 B12R0.390 CC(=O)NCC(=O)CCS(=O)(=O)[O-] 1458a_100000194580_100000762736 [0,1,0,0,0,1|0,0,1]=3 971 B12R0.390 CC(=O)NNC(=O)CCS(=O)(=O)C 22a_100000189765_100000737124 [0,1,0,0,0,1|1,0,1]=4 972 B12R0.390 CC(=O)NNC(=O)CCS(=O)(=O)N 22a_100000189765_100000737202 [0,1,0,0,0,1|1,0,1]=4 973 B12R0.390 CC(=O)OCC(=O)CCS(=O)(=O)C 1458a_100000183556_100000731031 [0,1,0,0,0,1|2,0,0]=4 974 B12R0.390 CC(=O)OCC(=O)CCS(=O)(=O)[O-] 1458a_100000183556_100000762736 [0,1,0,0,0,1|1,0,1]=4 975 B12R0.390 CC(=O)OCN(C)CCS(=O)(=O)C 269982a_100000750128_100000076356 [0,1,0,0,0,1|2,0,0]=4 976 B12R0.390 CC(=O)OCN(C)CCS(=O)(=O)C 34a_100000750128_100009813279 [0,1,0,0,0,1|2,0,0]=4 977 B12R0.390 CC(=O)SCC(=O)CCS(=O)(=O)C 1458a_100000049016_100000731031 [0,1,0,0,0,1|2,0,0]=4 978 B12R0.390 CC(=O)SCC(=O)CCS(=O)(=O)[O-] 1458a_100000049016_100000762736 [0,1,0,0,0,1|1,0,1]=4 979 B12R0.390 CS(=O)(=O)CCC(=O)CNC(=O)N 1458a_100000184981_100000731031 [0,1,0,0,0,1|2,0,0]=4 980 B12R0.390 NC(=O)NCC(=O)CCS(=O)(=O)[O-] 1458a_100000184981_100000762736 [0,1,0,0,0,1|1,0,1]=4 981 B12R0.638 CS(=O)(=O)NCCCNS(=O)(=O)C 40a_100000736790_100000738038 [0,1,0,0,0,1|2,0,0]=4 982 B12R0.638 CS(=O)(=O)NCCNCS(=O)(=O)[O-] 34a_100000752411_100009817235 [0,1,0,0,0,1|1,0,1]=4 983 B12R0.638 CS(=O)(=O)NCCSCS(=O)(=O)N 62a_100000741382_100000754112 [0,1,0,0,0,1|2,0,0]=4 984 B12R0.638 CS(=O)(=O)NCCSCS(=O)(=O)N 62a_100000754112_100000741382 [0,1,0,0,0,1|2,0,0]=4 985 B12R0.638 CS(=O)(=O)NCCSCS(=O)(=O)[O-] 62a_100000754112_100009817235 [0,1,0,0,0,1|1,0,1]=4 986 B12R0.638 CS(=O)(=O)NCCSCS(=O)(=O)[O-] 62a_100009817235_100000754112 [0,1,0,0,0,1|1,0,1]=4 987 B12R0.155 CCC(=O)NCC(=O)CS(=O)(=O)N 1458a_100000194589_100000741382 [0,2,0,0,0,0|1,0,1]=4 988 B12R0.155 CCC(=O)NCC(=O)CS(=O)(=O)[O-] 1458a_100000194589_100009817235 [0,2,0,0,0,0|0,0,2]=4 989 B12R0.155 COC(=O)NCC(=O)CS(=O)(=O)N 1458a_100000215747_100000741382 [0,2,0,0,0,0|1,0,1]=4 990 B12R0.155 COC(=O)NCC(=O)CS(=O)(=O)[O-] 1458a_100000215747_100009817235 [0,2,0,0,0,0|0,0,2]=4 991 B12R0.340 CC(=O)N(C)CC(=O)CS(=O)(=O)N 1458a_100000194957_100000741382 [0,2,0,0,0,0|1,0,1]=4 992 B12R0.340 CC(=O)N(C)CC(=O)CS(=O)(=O)[O-] 1458a_100000194957_100009817235 [0,2,0,0,0,0|0,0,2]=4 993 B12R0.696 CC(=O)N[C@H](C)C(=O)CS(=O)(=O)N 1458a_100011504603_100000741382 [0,2,0,0,0,0|1,0,1]=4 994 B12R0.696 CC(=O)N[C@H](C)C(=O)CS(=O)(=O)[O-] 1458a_100011504603_100009817235 [0,2,0,0,0,0|0,0,2]=4 995 B12R0.320 CCC(=O)NCCN(C)S(=O)(=O)C 11a_100015186441_100000210414 [0,2,0,0,0,0|2,0,0]=4 996 B12R0.320 CCC(=O)NCCN(C)S(=O)(=O)C 1626a_100015186441_100000210414 [0,2,0,0,0,0|2,0,0]=4 997 B12R0.320 CCC(=O)NCCN(C)S(=O)(=O)C 240690a_100015186441_100000210414 [0,2,0,0,0,0|2,0,0]=4 998 B12R0.320 CCC(=O)NCCN(C)S(=O)(=O)C 527a_100015186441_100000210414 [0,2,0,0,0,0|2,0,0]=4 999 B12R0.320 CN(CCNC(=O)CO)S(=O)(=O)C 240690a_100015186441_100000210174 [0,2,0,0,0,0|2,0,0]=4 1000 B12R0.320 CN(CCNC(=O)CO)S(=O)(=O)C 527a_100015186441_100000210174 [0,2,0,0,0,0|2,0,0]=4 1001 B12R0.320 CNC(=O)NCCN(C)S(=O)(=O)C 2708a_100015186441_106832991635 [0,2,0,0,0,0|2,0,0]=4 1002 B12R0.320 CNC(=O)NCCN(C)S(=O)(=O)C 2708a_100102657272_100015186441 [0,2,0,0,0,0|2,0,0]=4 1003 B12R0.320 CNC(=O)NCCN(C)S(=O)(=O)C 273464a_100015186441_100102657272 [0,2,0,0,0,0|2,0,0]=4 1004 B12R0.320 CNC(=O)NCCN(C)S(=O)(=O)C 273464a_100102657272_100015186441 [0,2,0,0,0,0|2,0,0]=4 1005 B12R0.320 CNC(=O)NCCN(C)S(=O)(=O)C 512a_100015186441_100102657272 [0,2,0,0,0,0|2,0,0]=4 1006 B12R0.320 CNC(=O)NCCN(C)S(=O)(=O)C 512a_106832991638_100015186441 [0,2,0,0,0,0|2,0,0]=4 1007 B12R0.72 C#CCC(=O)NCCCS(=O)(=O)C 1626a_100000742409_100011220946 [0,2,0,0,0,0|1,0,0]=3 1008 B12R0.72 C#CCC(=O)NCCCS(=O)(=O)C 527a_100000742409_100011220946 [0,2,0,0,0,0|1,0,0]=3 1009 B12R0.72 C#CCC(=O)NCCNS(=O)(=O)C 1626a_100000752411_100011220946 [0,2,0,0,0,0|2,0,0]=4 1010 B12R0.72 C#CCC(=O)NCCNS(=O)(=O)C 527a_100000752411_100011220946 [0,2,0,0,0,0|2,0,0]=4 1011 B12R0.72 C=CCC(=O)NCCCS(=O)(=O)C 11a_100000742409_100000210193 [0,2,0,0,0,0|1,0,0]=3 1012 B12R0.72 C=CCC(=O)NCCCS(=O)(=O)C 1626a_100000742409_100000210193 [0,2,0,0,0,0|1,0,0]=3 1013 B12R0.72 C=CCC(=O)NCCCS(=O)(=O)C 240690a_100000742409_100000210193 [0,2,0,0,0,0|1,0,0]=3 1014 B12R0.72 C=CCC(=O)NCCCS(=O)(=O)C 527a_100000742409_100000210193 [0,2,0,0,0,0|1,0,0]=3 1015 B12R0.72 C=CCC(=O)NCCNS(=O)(=O)C 11a_100000752411_100000210193 [0,2,0,0,0,0|2,0,0]=4 1016 B12R0.72 C=CCC(=O)NCCNS(=O)(=O)C 1626a_100000752411_100000210193 [0,2,0,0,0,0|2,0,0]=4 1017 B12R0.72 C=CCC(=O)NCCNS(=O)(=O)C 240690a_100000752411_100000210193 [0,2,0,0,0,0|2,0,0]=4 1018 B12R0.72 C=CCC(=O)NCCNS(=O)(=O)C 527a_100000752411_100000210193 [0,2,0,0,0,0|2,0,0]=4 1019 B12R0.72 CC=CC(=O)NCCCS(=O)(=O)C 11a_100000742409_100000210699 [0,2,0,0,0,0|1,0,0]=3 1020 B12R0.72 CC=CC(=O)NCCCS(=O)(=O)C 1626a_100000742409_100000210699 [0,2,0,0,0,0|1,0,0]=3 1021 B12R0.72 CC=CC(=O)NCCCS(=O)(=O)C 240690a_100000742409_100000210699 [0,2,0,0,0,0|1,0,0]=3 1022 B12R0.72 CC=CC(=O)NCCNS(=O)(=O)C 11a_100000752411_100000210699 [0,2,0,0,0,0|2,0,0]=4 1023 B12R0.72 CC=CC(=O)NCCNS(=O)(=O)C 1626a_100000752411_100000210699 [0,2,0,0,0,0|2,0,0]=4 1024 B12R0.72 CC=CC(=O)NCCNS(=O)(=O)C 240690a_100000752411_100000210699 [0,2,0,0,0,0|2,0,0]=4 1025 B12R0.72 CCCC(=O)NCCCS(=O)(=O)C 11a_100000742409_100000211992 [0,2,0,0,0,0|1,0,0]=3 1026 B12R0.72 CCCC(=O)NCCCS(=O)(=O)C 1626a_100000742409_100000211992 [0,2,0,0,0,0|1,0,0]=3 1027 B12R0.72 CCCC(=O)NCCCS(=O)(=O)C 240690a_100000742409_100000211992 [0,2,0,0,0,0|1,0,0]=3 1028 B12R0.72 CCCC(=O)NCCCS(=O)(=O)C 527a_100000742409_100000211992 [0,2,0,0,0,0|1,0,0]=3 1029 B12R0.72 CCCC(=O)NCCNS(=O)(=O)C 11a_100000752411_100000211992 [0,2,0,0,0,0|2,0,0]=4 1030 B12R0.72 CCCC(=O)NCCNS(=O)(=O)C 1626a_100000752411_100000211992 [0,2,0,0,0,0|2,0,0]=4 1031 B12R0.72 CCCC(=O)NCCNS(=O)(=O)C 240690a_100000752411_100000211992 [0,2,0,0,0,0|2,0,0]=4 1032 B12R0.72 CCCC(=O)NCCNS(=O)(=O)C 527a_100000752411_100000211992 [0,2,0,0,0,0|2,0,0]=4 1033 B12R0.72 CCNC(=O)NCCCS(=O)(=O)C 2708a_100000742409_100015525214 [0,2,0,0,0,0|1,0,0]=3 1034 B12R0.72 CCNC(=O)NCCCS(=O)(=O)C 2708a_100015525214_100000742409 [0,2,0,0,0,0|1,0,0]=3 1035 B12R0.72 CCNC(=O)NCCCS(=O)(=O)C 273464a_100000742409_100015525214 [0,2,0,0,0,0|1,0,0]=3 1036 B12R0.72 CCNC(=O)NCCCS(=O)(=O)C 273464a_100015525214_100000742409 [0,2,0,0,0,0|1,0,0]=3 1037 B12R0.72 CCNC(=O)NCCCS(=O)(=O)C 512a_100000742409_100015525214 [0,2,0,0,0,0|1,0,0]=3 1038 B12R0.72 CCNC(=O)NCCCS(=O)(=O)C 512a_100015525214_100000742409 [0,2,0,0,0,0|1,0,0]=3 1039 B12R0.72 CCNC(=O)NCCNS(=O)(=O)C 2708a_100000752411_100015525214 [0,2,0,0,0,0|2,0,0]=4 1040 B12R0.72 CCNC(=O)NCCNS(=O)(=O)C 2708a_100015525214_100000752411 [0,2,0,0,0,0|2,0,0]=4 1041 B12R0.72 CCNC(=O)NCCNS(=O)(=O)C 273464a_100000752411_100015525214 [0,2,0,0,0,0|2,0,0]=4 1042 B12R0.72 CCNC(=O)NCCNS(=O)(=O)C 273464a_100015525214_100000752411 [0,2,0,0,0,0|2,0,0]=4 1043 B12R0.72 CCNC(=O)NCCNS(=O)(=O)C 512a_100000752411_100015525214 [0,2,0,0,0,0|2,0,0]=4 1044 B12R0.72 CCNC(=O)NCCNS(=O)(=O)C 512a_100015525214_100000752411 [0,2,0,0,0,0|2,0,0]=4 1045 B12R0.72 CNNC(=O)NCCCS(=O)(=O)C 273464a_100000742409_100016993582 [0,2,0,0,0,0|1,0,0]=3 1046 B12R0.72 CNNC(=O)NCCCS(=O)(=O)C 512a_100000742409_100016993582 [0,2,0,0,0,0|1,0,0]=3 1047 B12R0.72 CNNC(=O)NCCCS(=O)(=O)C 512a_100016993582_100000742409 [0,2,0,0,0,0|1,0,0]=3 1048 B12R0.72 CNNC(=O)NCCNS(=O)(=O)C 273464a_100000752411_100016993582 [0,2,0,0,0,0|2,0,0]=4 1049 B12R0.72 CNNC(=O)NCCNS(=O)(=O)C 512a_100000752411_100016993582 [0,2,0,0,0,0|2,0,0]=4 1050 B12R0.72 CNNC(=O)NCCNS(=O)(=O)C 512a_100016993582_100000752411 [0,2,0,0,0,0|2,0,0]=4 1051 B12R0.72 COCC(=O)NCCCS(=O)(=O)C 11a_100000742409_100000210968 [0,2,0,0,0,0|1,0,0]=3 1052 B12R0.72 COCC(=O)NCCCS(=O)(=O)C 1626a_100000742409_100000210968 [0,2,0,0,0,0|1,0,0]=3 1053 B12R0.72 COCC(=O)NCCCS(=O)(=O)C 240690a_100000742409_100000210968 [0,2,0,0,0,0|1,0,0]=3 1054 B12R0.72 COCC(=O)NCCCS(=O)(=O)C 527a_100000742409_100000210968 [0,2,0,0,0,0|1,0,0]=3 1055 B12R0.72 COCC(=O)NCCNS(=O)(=O)C 11a_100000752411_100000210968 [0,2,0,0,0,0|2,0,0]=4 1056 B12R0.72 COCC(=O)NCCNS(=O)(=O)C 1626a_100000752411_100000210968 [0,2,0,0,0,0|2,0,0]=4 1057 B12R0.72 COCC(=O)NCCNS(=O)(=O)C 240690a_100000752411_100000210968 [0,2,0,0,0,0|2,0,0]=4 1058 B12R0.72 COCC(=O)NCCNS(=O)(=O)C 527a_100000752411_100000210968 [0,2,0,0,0,0|2,0,0]=4 1059 B12R0.72 CS(=O)(=O)CCCNC(=O)C=CBr 1626a_100000742409_100016273825 [0,2,0,0,0,0|1,0,1]=4 1060 B12R0.72 CS(=O)(=O)CCCNC(=O)C=CBr 240690a_100000742409_100016273825 [0,2,0,0,0,0|1,0,1]=4 1061 B12R0.72 CS(=O)(=O)CCCNC(=O)C=CCl 11a_100000742409_200016279998 [0,2,0,0,0,0|1,0,1]=4 1062 B12R0.72 CS(=O)(=O)CCCNC(=O)C=CCl 1626a_100000742409_200016279998 [0,2,0,0,0,0|1,0,1]=4 1063 B12R0.72 CS(=O)(=O)CCCNC(=O)C=CCl 240690a_100000742409_200016279998 [0,2,0,0,0,0|1,0,1]=4 1064 B12R0.72 CS(=O)(=O)CCCNC(=O)C=CI 1626a_100000742409_100016256311 [0,2,0,0,0,0|1,0,1]=4 1065 B12R0.72 CS(=O)(=O)CCCNC(=O)CC#N 1626a_100000742409_100051588842 [0,2,0,0,0,0|1,0,0]=3 1066 B12R0.72 CS(=O)(=O)CCCNC(=O)CC#N 240690a_100000742409_100051588842 [0,2,0,0,0,0|1,0,0]=3 1067 B12R0.72 CS(=O)(=O)CCCNC(=O)CCO 240690a_100000742409_100011216618 [0,2,0,0,0,0|1,0,0]=3 1068 B12R0.72 CS(=O)(=O)NCCNC(=O)CC#N 1626a_100000752411_100051588842 [0,2,0,0,0,0|2,0,0]=4 1069 B12R0.72 CS(=O)(=O)NCCNC(=O)CC#N 240690a_100000752411_100051588842 [0,2,0,0,0,0|2,0,0]=4 1070 B12R0.72 CS(=O)(=O)NCCNC(=O)CCO 240690a_100000752411_100011216618 [0,2,0,0,0,0|2,0,0]=4 1071 B12R0.72 CSCC(=O)NCCCS(=O)(=O)C 11a_100000742409_100000184570 [0,2,0,0,0,0|1,0,0]=3 1072 B12R0.72 CSCC(=O)NCCCS(=O)(=O)C 1626a_100000742409_100000184570 [0,2,0,0,0,0|1,0,0]=3 1073 B12R0.72 CSCC(=O)NCCCS(=O)(=O)C 240690a_100000742409_100000184570 [0,2,0,0,0,0|1,0,0]=3 1074 B12R0.72 CSCC(=O)NCCCS(=O)(=O)C 527a_100000742409_100000184570 [0,2,0,0,0,0|1,0,0]=3 1075 B12R0.72 CSCC(=O)NCCNS(=O)(=O)C 11a_100000752411_100000184570 [0,2,0,0,0,0|2,0,0]=4 1076 B12R0.72 CSCC(=O)NCCNS(=O)(=O)C 1626a_100000752411_100000184570 [0,2,0,0,0,0|2,0,0]=4 1077 B12R0.72 CSCC(=O)NCCNS(=O)(=O)C 240690a_100000752411_100000184570 [0,2,0,0,0,0|2,0,0]=4 1078 B12R0.72 CSCC(=O)NCCNS(=O)(=O)C 527a_100000752411_100000184570 [0,2,0,0,0,0|2,0,0]=4 1079 B12R0.90 CNC(=O)C(=O)CCCS(=O)(=O)C 1458a_100011218921_100000754308 [0,2,0,0,0,0|2,0,0]=4 1080 B12R0.90 CNC(=O)C(=O)CCCS(=O)(=O)N 1458a_100011218921_100000750626 [0,2,0,0,0,0|2,0,0]=4 1081 B12R0.90 CNC(=O)C(=O)CCCS(=O)(=O)[O-] 1458a_100011218921_100009813499 [0,2,0,0,0,0|1,0,1]=4 1082 B12R0.131 CCC(=O)NCCNS(=O)(=O)CC 270084a_100132302217_100000211323 [0,2,0,0,0,0|2,0,0]=4 1083 B12R0.131 CCC(=O)NCCNS(=O)(=O)CC 274078a_100132302217_100000211323 [0,2,0,0,0,0|2,0,0]=4 1084 B12R0.131 CCC(=O)NCCNS(=O)(=O)CC 40a_100132302217_100000053943 [0,2,0,0,0,0|2,0,0]=4 1085 B12R0.131 CCC(=O)NCCNS(=O)(=O)CCl 270084a_100132302217_100000031410 [0,2,0,0,0,0|2,0,0]=4 1086 B12R0.131 CCC(=O)NCCNS(=O)(=O)CCl 274078a_100132302217_100000031410 [0,2,0,0,0,0|2,0,0]=4 1087 B12R0.131 CCS(=O)(=O)NCCNC(=O)NC 270084a_100015205895_100000211323 [0,2,0,0,0,0|2,0,0]=4 1088 B12R0.131 CCS(=O)(=O)NCCNC(=O)NC 274078a_100015205895_100000211323 [0,2,0,0,0,0|2,0,0]=4 1089 B12R0.131 CCS(=O)(=O)NCCNC(=O)NC 40a_100015205895_100000053943 [0,2,0,0,0,0|2,0,0]=4 1090 B12R0.131 CNC(=O)NCCNS(=O)(=O)CCl 270084a_100015205895_100000031410 [0,2,0,0,0,0|2,0,0]=4 1091 B12R0.131 CNC(=O)NCCNS(=O)(=O)CCl 274078a_100015205895_100000031410 [0,2,0,0,0,0|2,0,0]=4 1092 B12R0.131 CNS(=O)(=O)CCCCC(=O)OC 270084a_100102657272_100000055593 [0,2,0,0,0,0|2,0,0]=4 1093 B12R0.131 CNS(=O)(=O)CCCCC(=O)OC 274078a_100102657272_100000055593 [0,2,0,0,0,0|2,0,0]=4 1094 B12R0.211 CCS(=O)(=O)NCCCS(=O)(=O)C 270084a_100000742409_100000211323 [0,2,0,0,0,0|2,0,0]=4 1095 B12R0.211 CCS(=O)(=O)NCCCS(=O)(=O)C 274078a_100000742409_100000211323 [0,2,0,0,0,0|2,0,0]=4 1096 B12R0.211 CCS(=O)(=O)NCCCS(=O)(=O)C 40a_100000742409_100000053943 [0,2,0,0,0,0|2,0,0]=4 1097 B12R0.211 CS(=O)(=O)CCCNS(=O)(=O)CCl 270084a_100000742409_100000031410 [0,2,0,0,0,0|2,0,0]=4 1098 B12R0.211 CS(=O)(=O)CCCNS(=O)(=O)CCl 274078a_100000742409_100000031410 [0,2,0,0,0,0|2,0,0]=4 1099 B12R0.172 C=CCS(=O)(=O)NCCNC(=O)C 270084a_100000209853_100000751117 [0,2,0,0,0,0|2,0,0]=4 1100 B12R0.172 C=CCS(=O)(=O)NCCNC(=O)C 274078a_100000209853_100000751117 [0,2,0,0,0,0|2,0,0]=4 1101 B12R0.172 CC(=O)NCCNS(=O)(=O)CCBr 270084a_100000209853_100000731045 [0,2,0,0,0,0|2,0,0]=4 1102 B12R0.172 CC(=O)NCCNS(=O)(=O)CCBr 274078a_100000209853_100000731045 [0,2,0,0,0,0|2,0,0]=4 1103 B12R0.172 CC(=O)NCCNS(=O)(=O)CCCl 270084a_100000209853_100000184613 [0,2,0,0,0,0|2,0,0]=4 1104 B12R0.172 CC(=O)NCCNS(=O)(=O)CCCl 274078a_100000209853_100000184613 [0,2,0,0,0,0|2,0,0]=4 1105 B12R0.172 CCCS(=O)(=O)NCCNC(=O)C 270084a_100000209853_100000211391 [0,2,0,0,0,0|2,0,0]=4 1106 B12R0.172 CCCS(=O)(=O)NCCNC(=O)C 274078a_100000209853_100000211391 [0,2,0,0,0,0|2,0,0]=4 1107 B12R0.172 CCCS(=O)(=O)NCCNC(=O)C 40a_100000209853_100000054278 [0,2,0,0,0,0|2,0,0]=4 1108 B12R0.692 CC(=O)NCCNS(=O)(=O)C(C)C 270084a_100000209853_100000742656 [0,2,0,0,0,0|2,0,0]=4 1109 B12R0.692 CC(=O)NCCNS(=O)(=O)C(C)C 274078a_100000209853_100000742656 [0,2,0,0,0,0|2,0,0]=4 1110 B12R0.692 CC(=O)NCCNS(=O)(=O)C(Cl)Cl 270084a_100000209853_100000034607 [0,2,0,0,0,0|2,0,0]=4 1111 B12R0.692 CC(=O)NCCNS(=O)(=O)C(F)F 270084a_100000209853_100000737280 [0,2,0,0,0,0|2,0,0]=4 1112 B12R0.692 CC(=O)NCCNS(=O)(=O)C(F)F 274078a_100000209853_100000737280 [0,2,0,0,0,0|2,0,0]=4 1113 B10R1.95 CCNC1CCS(=O)(=O)C1 2230a_100000683523_100000210202 [1,0,0,1,0,0|1,0,1]=4 1114 B10R1.95 CCNC1CCS(=O)(=O)C1 34a_100000683523_100000210202 [1,0,0,1,0,0|1,0,1]=4 1115 B10R1.54 CC(=O)N[C@H]1CC[C@H](C1)O 1626a_100015195300_100015343762 [1,0,0,1,0,0|2,0,0]=4 1116 B10R1.54 CC(=O)N[C@H]1CC[C@H](C1)O 240690a_100015195300_100015343762 [1,0,0,1,0,0|2,0,0]=4 1117 B10R1.82 CC(=O)NCC1CC(C1)O 11a_100016992100_100015343762 [1,0,0,1,0,0|2,0,0]=4 1118 B10R1.82 CC(=O)NCC1CC(C1)O 240690a_100016992100_100015343762 [1,0,0,1,0,0|2,0,0]=4 1119 B10R1.113 CC(=O)C1CCNC(=O)C1 1458a_100000132800_200000210301 [1,0,0,1,0,0|2,0,0]=4 1120 B10R1.113 CC(=O)N1CCCC(C1)O 240690a_100000211013_100015343762 [1,0,0,1,0,0|2,0,0]=4 1121 B10R1.113 CC(=O)N1CCCC(C1)O 527a_100000211013_100103153847 [1,0,0,1,0,0|2,0,0]=4 1122 B10R1.113 [13CH3]C(=O)C1CCNC(=O)C1 1458a_100000132800_200025704644 [1,0,0,1,0,0|2,0,0]=4 1123 B10R1.361 CC(=O)N1CC[C@H]1C(=O)[13CH3] 1458a_200015362969_200025704644 [1,0,0,1,0,0|2,0,0]=4 1124 B10R1.361 CC(=O)[C@@H]1CCN1C(=O)C 1458a_200015362969_200000210301 [1,0,0,1,0,0|2,0,0]=4 1125 B10R1.55 CS(=O)(=O)N1CNC(=O)C1 40a_200000708111_100000738038 [0,0,0,1,1,0|2,0,0]=4 1126 B10R1.359 CC(=O)C1CCS(=O)(=O)C1 1458a_100000209820_200000210301 [0,0,0,1,1,0|1,0,0]=3 1127 B10R1.359 [13CH3]C(=O)C1CCS(=O)(=O)C1 1458a_100000209820_200025704644 [0,0,0,1,1,0|1,0,0]=3 1128 B10R1.371 CC(=O)NC1CS(=O)(=O)C1 11a_100000695474_100015343762 [0,0,0,1,1,0|1,0,0]=3 1129 B10R1.371 CC(=O)NC1CS(=O)(=O)C1 1626a_100000695474_100015343762 [0,0,0,1,1,0|1,0,0]=3 1130 B10R1.371 CC(=O)NC1CS(=O)(=O)C1 240690a_100000695474_100015343762 [0,0,0,1,1,0|1,0,0]=3 1131 B10R1.371 CC(=O)NC1CS(=O)(=O)C1 527a_100000695474_100103153847 [0,0,0,1,1,0|1,0,0]=3 1132 B12R1.119 CS(=O)(=O)NC1CCNC(=O)C1 40a_100016994916_100000738038 [0,0,0,1,0,1|1,0,0]=3 1133 B12R1.219 CS(=O)(=O)CCSC1CC(=O)C1 62a_100009894365_100000230027 [0,0,0,1,0,1|2,0,0]=4 1134 B12R1.219 NS(=O)(=O)CSCC1CC(=O)C1 62a_100000741382_100009874392 [0,0,0,1,0,1|2,0,0]=4 1135 B12R1.219 NS(=O)(=O)CSCC1CC(=O)C1 62a_100009874392_100000741382 [0,0,0,1,0,1|2,0,0]=4 1136 B12R1.219 O=C1CC(C1)COCS(=O)(=O)[O-] 34a_100000101936_100009817235 [0,0,0,1,0,1|1,0,1]=4 1137 B12R1.219 O=C1CC(C1)CSCS(=O)(=O)[O-] 62a_100009817235_100009874392 [0,0,0,1,0,1|1,0,1]=4 1138 B12R1.219 O=C1CC(C1)CSCS(=O)(=O)[O-] 62a_100009874392_100009817235 [0,0,0,1,0,1|1,0,1]=4 1139 B12R1.219 O=C1CC(C1)SCCS(=O)(=O)[O-] 62a_100009894365_100000762736 [0,0,0,1,0,1|1,0,1]=4 1140 B12R1.263 CC(=O)C1CCCN1S(=O)(=O)C 1458a_100000165837_200000210301 [0,0,0,1,0,1|2,0,0]=4 1141 B12R1.263 CS(=O)(=O)N1CCCC1C(=O)[13CH3] 1458a_100000165837_200025704644 [0,0,0,1,0,1|2,0,0]=4 1142 B12R1.836 CS(=O)(=O)CCN1CNC(=O)C1 2230a_200000708111_100000731031 [0,0,0,1,0,1|1,0,0]=3 1143 B12R1.836 CS(=O)(=O)NCC1CNC(=O)C1 40a_100016993742_100000738038 [0,0,0,1,0,1|1,0,0]=3 1144 B12R1.836 O=C1CC(CN1)OCS(=O)(=O)[O-] 34a_100000690082_100009817235 [0,0,0,1,0,1|0,0,1]=3 1145 B12R1.836 O=C1CCC(C1)OCS(=O)(=O)[O-] 34a_100012614533_100009817235 [0,0,0,1,0,1|1,0,1]=4 1146 B12R1.836 O=C1CN(CN1)CCS(=O)(=O)[O-] 2230a_200000708111_100000737633 [0,0,0,1,0,1|0,0,1]=3 1147 B12R1.872 CS(=O)(=O)N1CCCNC(=O)C1 40a_100015190381_100000738038 [0,0,0,1,0,1|1,0,0]=3 1148 B12R1.1806 C=C(C)CNC1CCS(=O)(=O)C1 2230a_100000683523_100000748629 [0,0,0,1,0,1|2,0,0]=4 1149 B12R1.1806 C=C(C)CNC1CCS(=O)(=O)C1 34a_100000683523_100000748629 [0,0,0,1,0,1|2,0,0]=4 1150 B12R1.1806 CC(=O)CSC1CCS(=O)(=O)C1 1458a_100000204638_200000210301 [0,0,0,1,0,1|2,0,0]=4 1151 B12R1.1806 CC(=O)NCC1CCS(=O)(=O)C1 11a_100000737051_100015343762 [0,0,0,1,0,1|1,0,0]=3 1152 B12R1.1806 CC(=O)NCC1CCS(=O)(=O)C1 1626a_100000737051_100015343762 [0,0,0,1,0,1|1,0,0]=3 1153 B12R1.1806 CC(=O)NCC1CCS(=O)(=O)C1 240690a_100000737051_100015343762 [0,0,0,1,0,1|1,0,0]=3 1154 B12R1.1806 CC(=O)NCC1CCS(=O)(=O)C1 527a_100000737051_100103153847 [0,0,0,1,0,1|1,0,0]=3 1155 B12R1.1806 CC(=O)NN=C1CCS(=O)(=O)C1 4a_100000189765_100000182061 [0,0,0,1,0,1|1,0,1]=4 1156 B12R1.1806 CC(=O)NNC1CCS(=O)(=O)C1 22a_100000683518_100000070787 [0,0,0,1,0,1|1,0,0]=3 1157 B12R1.1806 NC(=O)CNC1CCS(=O)(=O)C1 2230a_100000683523_100000747473 [0,0,0,1,0,1|2,0,0]=4 1158 B12R1.1806 NC(=O)CNC1CCS(=O)(=O)C1 34a_100000683523_100000187820 [0,0,0,1,0,1|2,0,0]=4 1159 B12R1.1806 O=C([O-])CNC1CCS(=O)(=O)C1 34a_100000683523_100020667443 [0,0,0,1,0,1|2,0,0]=4 1160 B12R1.1806 [13CH3]C(=O)CSC1CCS(=O)(=O)C1 1458a_100000204638_200025704644 [0,0,0,1,0,1|2,0,0]=4 1161 B12R1.1810 CC(=O)CCOC1CS(=O)(=O)C1 7a_100000072295_100000053229 [0,0,0,1,0,1|2,0,0]=4 1162 B12R1.1810 CC(=O)OCNC1CS(=O)(=O)C1 34a_100000695474_100009813279 [0,0,0,1,0,1|2,0,0]=4 1163 B12R1.1810 CC(=O)OCOC1CS(=O)(=O)C1 34a_100000072295_100009813279 [0,0,0,1,0,1|2,0,0]=4 1164 B12R1.106 CS(=O)(=O)NC1CCC(=O)NC1 40a_100000748762_100000738038 [0,1,0,1,0,0|2,0,0]=4 1165 B12R1.1049 NS(=O)(=O)CC(=O)[C@@H]1CC(=O)N1 1458a_100016090685_100000741382 [0,1,0,1,0,0|1,0,1]=4 1166 B12R1.1049 O=C1C[C@H](N1)C(=O)CS(=O)(=O)[O-] 1458a_100016090685_100009817235 [0,1,0,1,0,0|0,0,2]=4 1167 B12R1.1381 CC(=O)N1CC(C1)CS(=O)(=O)C 11a_100132310312_100015343762 [0,1,0,1,0,0|1,0,0]=3 1168 B12R1.1381 CC(=O)N1CC(C1)CS(=O)(=O)C 1626a_100132310312_100015343762 [0,1,0,1,0,0|1,0,0]=3 1169 B12R1.1381 CC(=O)N1CC(C1)CS(=O)(=O)C 240690a_100132310312_100015343762 [0,1,0,1,0,0|1,0,0]=3 1170 B12R1.1381 CC(=O)N1CC(C1)CS(=O)(=O)C 527a_100132310312_100103153847 [0,1,0,1,0,0|1,0,0]=3 1171 B12R1.1381 CC(=O)N1CC(C1)NS(=O)(=O)C 1626a_100016991845_100015343762 [0,1,0,1,0,0|2,0,0]=4 1172 B12R1.1381 CC(=O)N1CC(C1)NS(=O)(=O)C 240690a_100016991845_100015343762 [0,1,0,1,0,0|2,0,0]=4 1173 B12R1.1381 CC(=O)N1CC(C1)NS(=O)(=O)C 40a_100102955437_100000738038 [0,1,0,1,0,0|2,0,0]=4 1174 B12R1.1381 CC(=O)N1CC(C1)NS(=O)(=O)C 527a_100016991845_100103153847 [0,1,0,1,0,0|2,0,0]=4 1175 B12R1.1381 CC(=O)N1CC(C1)OS(=O)(=O)C 11a_100102886914_100015343762 [0,1,0,1,0,0|2,0,0]=4 1176 B12R1.1381 CC(=O)N1CC(C1)OS(=O)(=O)C 1626a_100102886914_100015343762 [0,1,0,1,0,0|2,0,0]=4 1177 B12R1.1381 CC(=O)N1CC(C1)OS(=O)(=O)C 240690a_100102886914_100015343762 [0,1,0,1,0,0|2,0,0]=4 1178 B12R1.1381 CC(=O)N1CC(C1)OS(=O)(=O)C 527a_100102886914_100103153847 [0,1,0,1,0,0|2,0,0]=4 1179 B12R1.2789 CS(=O)(=O)NC1CCS(=O)(=O)C1 40a_100000683523_100000738038 [0,1,0,1,0,0|2,0,0]=4 1180 B12R1.254 CC(=O)N1CCC(C1)S(=O)(=O)C 11a_100000727209_100015343762 [0,1,0,1,0,0|1,0,0]=3 1181 B12R1.254 CC(=O)N1CCC(C1)S(=O)(=O)C 1626a_100000727209_100015343762 [0,1,0,1,0,0|1,0,0]=3 1182 B12R1.254 CC(=O)N1CCC(C1)S(=O)(=O)C 240690a_100000727209_100015343762 [0,1,0,1,0,0|1,0,0]=3 1183 B12R1.254 CC(=O)N1CCC(C1)S(=O)(=O)C 527a_100000727209_100103153847 [0,1,0,1,0,0|1,0,0]=3 1184 B12R1.1019 CS(=O)(=O)N1CCNC(=O)CC1 40a_100000698595_100000738038 [0,1,0,1,0,0|2,0,0]=4 1185 B12R1.1393 CC(=O)NC1CN(C1)S(=O)(=O)C 40a_100000716753_100000738038 [0,1,0,1,0,0|2,0,0]=4 1186 B12R1.1393 CC(=O)N[C@H]1C[C@@H](C1)S(=O)(=O)C 11a_200121570650_100015343762 [0,1,0,1,0,0|1,0,0]=3 1187 B12R1.1393 CC(=O)N[C@H]1C[C@@H](C1)S(=O)(=O)C 1626a_200121570650_100015343762 [0,1,0,1,0,0|1,0,0]=3 1188 B12R1.1393 CC(=O)N[C@H]1C[C@@H](C1)S(=O)(=O)C 240690a_200121570650_100015343762 [0,1,0,1,0,0|1,0,0]=3 1189 B12R1.1393 CC(=O)N[C@H]1C[C@@H](C1)S(=O)(=O)C 527a_200121570650_100103153847 [0,1,0,1,0,0|1,0,0]=3 1190 B12R1.228 CC1C(=O)NCCN1S(=O)(=O)C 40a_100000750721_100000738038 [0,1,0,1,0,0|2,0,0]=4 1191 B12R1.1673 C=CC(=O)NC1CCS(=O)(=O)C1 1626a_100000683523_100000185746 [0,1,0,1,0,0|1,0,1]=4 1192 B12R1.1673 C=CC(=O)NC1CCS(=O)(=O)C1 240690a_100000683523_200121576911 [0,1,0,1,0,0|1,0,1]=4 1193 B12R1.1673 CCC(=O)CC1CCS(=O)(=O)C1 1458a_100000186120_100000210202 [0,1,0,1,0,0|2,0,0]=4 1194 B12R1.1673 CCC(=O)NC1CCS(=O)(=O)C1 11a_100000683523_100000210414 [0,1,0,1,0,0|1,0,0]=3 1195 B12R1.1673 CCC(=O)NC1CCS(=O)(=O)C1 1626a_100000683523_100000210414 [0,1,0,1,0,0|1,0,0]=3 1196 B12R1.1673 CCC(=O)NC1CCS(=O)(=O)C1 240690a_100000683523_100000210414 [0,1,0,1,0,0|1,0,0]=3 1197 B12R1.1673 CCC(=O)NC1CCS(=O)(=O)C1 527a_100000683523_100000210414 [0,1,0,1,0,0|1,0,0]=3 1198 B12R1.1673 CNC(=O)CC1CCS(=O)(=O)C1 11a_106832991635_100000186120 [0,1,0,1,0,0|2,0,0]=4 1199 B12R1.1673 CNC(=O)CC1CCS(=O)(=O)C1 1626a_100102657272_100000186120 [0,1,0,1,0,0|2,0,0]=4 1200 B12R1.1673 CNC(=O)CC1CCS(=O)(=O)C1 240690a_100102657272_100000186120 [0,1,0,1,0,0|2,0,0]=4 1201 B12R1.1673 CNC(=O)CC1CCS(=O)(=O)C1 527a_100102657272_100000186120 [0,1,0,1,0,0|2,0,0]=4 1202 B12R1.1673 CNC(=O)NC1CCS(=O)(=O)C1 2708a_100000683523_106832991635 [0,1,0,1,0,0|1,0,0]=3 1203 B12R1.1673 CNC(=O)NC1CCS(=O)(=O)C1 2708a_100102657272_100000683523 [0,1,0,1,0,0|1,0,0]=3 1204 B12R1.1673 CNC(=O)NC1CCS(=O)(=O)C1 273464a_100000683523_100102657272 [0,1,0,1,0,0|1,0,0]=3 1205 B12R1.1673 CNC(=O)NC1CCS(=O)(=O)C1 273464a_100102657272_100000683523 [0,1,0,1,0,0|1,0,0]=3 1206 B12R1.1673 CNC(=O)NC1CCS(=O)(=O)C1 512a_100000683523_100102657272 [0,1,0,1,0,0|1,0,0]=3 1207 B12R1.1673 CNC(=O)NC1CCS(=O)(=O)C1 512a_106832991638_100000683523 [0,1,0,1,0,0|1,0,0]=3 1208 B12R1.1673 O=C(CF)CC1CCS(=O)(=O)C1 1458a_100000186120_100015361967 [0,1,0,1,0,0|2,0,0]=4 1209 B12R1.1673 O=C(CO)NC1CCS(=O)(=O)C1 240690a_100000683523_100000210174 [0,1,0,1,0,0|1,0,0]=3 1210 B12R1.1673 O=C(CO)NC1CCS(=O)(=O)C1 527a_100000683523_100000210174 [0,1,0,1,0,0|1,0,0]=3 1211 B12R1.1707 CCC(=O)[C@@H]1CCCS(=O)(=O)C1 1458a_200009923180_100000210202 [0,1,0,1,0,0|2,0,0]=4 1212 B12R1.1707 CNC(=O)[C@@H]1CCCS(=O)(=O)C1 11a_106832991635_200009923180 [0,1,0,1,0,0|2,0,0]=4 1213 B12R1.1707 CNC(=O)[C@@H]1CCCS(=O)(=O)C1 1626a_100102657272_200009923180 [0,1,0,1,0,0|2,0,0]=4 1214 B12R1.1707 CNC(=O)[C@@H]1CCCS(=O)(=O)C1 240690a_100102657272_200009923180 [0,1,0,1,0,0|2,0,0]=4 1215 B12R1.1707 O=C(CF)[C@@H]1CCCS(=O)(=O)C1 1458a_200009923180_100015361967 [0,1,0,1,0,0|2,0,0]=4 1216 B12R1.10 CCS(=O)(=O)N1CCNC(=O)C1 270084a_100000184651_100000211323 [0,1,0,1,0,0|2,0,0]=4 1217 B12R1.10 CCS(=O)(=O)N1CCNC(=O)C1 274078a_100000184651_100000211323 [0,1,0,1,0,0|2,0,0]=4 1218 B12R1.10 CCS(=O)(=O)N1CCNC(=O)C1 40a_100000184651_100000053943 [0,1,0,1,0,0|2,0,0]=4 1219 B12R1.10 O=C1CN(CCN1)S(=O)(=O)CCl 270084a_100000184651_100000031410 [0,1,0,1,0,0|2,0,0]=4 1220 B12R1.10 O=C1CN(CCN1)S(=O)(=O)CCl 274078a_100000184651_100000031410 [0,1,0,1,0,0|2,0,0]=4 1221 B12R1.193 CCS(=O)(=O)NC1CNC(=O)C1 270084a_100000697751_100000211323 [0,1,0,1,0,0|2,0,0]=4 1222 B12R1.193 CCS(=O)(=O)NC1CNC(=O)C1 274078a_100000697751_100000211323 [0,1,0,1,0,0|2,0,0]=4 1223 B12R1.193 CCS(=O)(=O)NC1CNC(=O)C1 40a_100000697751_100000053943 [0,1,0,1,0,0|2,0,0]=4 1224 B12R1.193 O=C1CC(CN1)NS(=O)(=O)CCl 270084a_100000697751_100000031410 [0,1,0,1,0,0|2,0,0]=4 1225 B12R1.193 O=C1CC(CN1)NS(=O)(=O)CCl 274078a_100000697751_100000031410 [0,1,0,1,0,0|2,0,0]=4 1226 B12R1.1819 CC(=O)NC1CCS(=O)(=O)CC1 11a_100000739226_100015343762 [0,1,0,1,0,0|1,0,0]=3 1227 B12R1.1819 CC(=O)NC1CCS(=O)(=O)CC1 1626a_100000739226_100015343762 [0,1,0,1,0,0|1,0,0]=3 1228 B12R1.1819 CC(=O)NC1CCS(=O)(=O)CC1 240690a_100000739226_100015343762 [0,1,0,1,0,0|1,0,0]=3 1229 B12R1.1819 CC(=O)NC1CCS(=O)(=O)CC1 527a_100000739226_100103153847 [0,1,0,1,0,0|1,0,0]=3 1230 B12R1.23 CN1CCN(CC1=O)S(=O)(=O)C 40a_100000187256_100000738038 [0,1,0,1,0,0|2,0,0]=4 1231 B12R1.847 CN1CC(CC1=O)NS(=O)(=O)C 40a_100000748898_100000738038 [0,1,0,1,0,0|2,0,0]=4 1232 B12R1.2203 CC(=O)N(C)C1CCS(=O)(=O)C1 11a_100000184735_100015343762 [0,1,0,1,0,0|1,0,0]=3 1233 B12R1.2203 CC(=O)N(C)C1CCS(=O)(=O)C1 1626a_100000184735_100015343762 [0,1,0,1,0,0|1,0,0]=3 1234 B12R1.2203 CC(=O)N(C)C1CCS(=O)(=O)C1 240690a_100000184735_100015343762 [0,1,0,1,0,0|1,0,0]=3 1235 B12R1.2203 CC(=O)N(C)C1CCS(=O)(=O)C1 527a_100000184735_100103153847 [0,1,0,1,0,0|1,0,0]=3 1236 B12R1.1831 CC(=O)NC1(CCS(=O)(=O)C1)C 11a_100000684085_100015343762 [0,1,0,1,0,0|1,0,0]=3 1237 B12R1.1831 CC(=O)NC1(CCS(=O)(=O)C1)C 1626a_100000684085_100015343762 [0,1,0,1,0,0|1,0,0]=3 1238 B12R1.1831 CC(=O)NC1(CCS(=O)(=O)C1)C 240690a_100000684085_100015343762 [0,1,0,1,0,0|1,0,0]=3 1239 B12R1.1831 CC(=O)NC1(CCS(=O)(=O)C1)C 527a_100000684085_100103153847 [0,1,0,1,0,0|1,0,0]=3 1240 B8R0.28 CC(=O)CCCC(=O)C 1458a_100000070787_100011215641 [1,0,0,0,1,0|2,0,0]=4 1241 B8R0.28 CC(=O)CCCC(=O)N 1458a_100000070787_100102525003 [1,0,0,0,1,0|2,0,0]=4 1242 B8R0.28 CC(=O)CCCC(C)O 1458a_100000070787_200000718107 [1,0,0,0,1,0|2,0,0]=4 1243 B8R0.28 CC(=O)CCC[N+](=O)[O-] 1458a_100016109205_200000210301 [1,0,0,0,1,0|1,0,1]=4 1244 B8R0.28 CC(=O)CCNC(=O)C 1458a_100000070787_100000189650 [1,0,0,0,1,0|2,0,0]=4 1245 B8R0.28 CC(=O)CCNC(=O)C 1458a_100000183196_200000210301 [1,0,0,0,1,0|2,0,0]=4 1246 B8R0.28 CC(=O)NCCC(=O)N 11a_100000740010_100015343762 [1,0,0,0,1,0|2,0,0]=4 1247 B8R0.28 CC(=O)NCCC(=O)N 240690a_100000740010_100015343762 [1,0,0,0,1,0|2,0,0]=4 1248 B8R0.28 CC(=O)NCCC(=O)N 527a_100000740010_100103153847 [1,0,0,0,1,0|2,0,0]=4 1249 B8R0.28 CC(=O)NCCC(=O)[13CH3] 1458a_100000183196_200025704644 [1,0,0,0,1,0|2,0,0]=4 1250 B8R0.28 CC(=O)NCCC(C)O 240690a_200000755665_100015343762 [1,0,0,0,1,0|2,0,0]=4 1251 B8R0.28 CC(=O)NCCC(C)O 527a_200000755665_100103153847 [1,0,0,0,1,0|2,0,0]=4 1252 B8R0.28 [13CH3]C(=O)CCC[N+](=O)[O-] 1458a_100016109205_200025704644 [1,0,0,0,1,0|1,0,1]=4 1253 B8R0.29 CC(=O)CCS(=O)(=O)C 1458a_100000070787_100000731031 [0,0,0,0,2,0|1,0,0]=3 1254 B8R0.29 CC(=O)CCS(=O)(=O)C 1458a_100000737124_200000210301 [0,0,0,0,2,0|1,0,0]=3 1255 B8R0.29 CC(=O)CCS(=O)(=O)N 1458a_100000737202_200000210301 [0,0,0,0,2,0|1,0,0]=3 1256 B8R0.29 CC(=O)CCS(=O)(=O)[O-] 1458a_100000070787_100000762736 [0,0,0,0,2,0|0,0,1]=3 1257 B8R0.29 CC(=O)CNS(=O)(=O)C 1458a_100000737300_200000210301 [0,0,0,0,2,0|2,0,0]=4 1258 B8R0.29 CC(=O)NNS(=O)(=O)C 40a_100000189765_100000738038 [0,0,0,0,2,0|2,0,0]=4 1259 B8R0.29 CS(=O)(=O)CCC(=O)[13CH3] 1458a_100000737124_200025704644 [0,0,0,0,2,0|1,0,0]=3 1260 B8R0.29 CS(=O)(=O)NCC(=O)[13CH3] 1458a_100000737300_200025704644 [0,0,0,0,2,0|2,0,0]=4 1261 B8R0.29 [13CH3]C(=O)CCS(=O)(=O)N 1458a_100000737202_200025704644 [0,0,0,0,2,0|1,0,0]=3 1262 B10R0.97 CC(=O)CCCNCC(=O)O 269956a_100016091260_100011215641 [1,0,0,0,0,1|2,0,0]=4 1263 B10R0.97 CC(=O)NCCCCC(=O)N 11a_100000696515_100015343762 [1,0,0,0,0,1|2,0,0]=4 1264 B10R0.97 CC(=O)NCCCCC(=O)N 1626a_100000696515_100015343762 [1,0,0,0,0,1|2,0,0]=4 1265 B10R0.97 CC(=O)NCCCCC(=O)N 240690a_100000696515_100015343762 [1,0,0,0,0,1|2,0,0]=4 1266 B10R0.97 CC(=O)NCCCCC(=O)N 527a_100000696515_100103153847 [1,0,0,0,0,1|2,0,0]=4 1267 B10R0.97 CC(=O)NCCCNC(=O)C 11a_100000736810_100015343762 [1,0,0,0,0,1|2,0,0]=4 1268 B10R0.97 CC(=O)NCCCNC(=O)C 240690a_100000736810_100015343762 [1,0,0,0,0,1|2,0,0]=4 1269 B10R0.97 CC(=O)NCCCNC(=O)C 527a_100000736810_100103153847 [1,0,0,0,0,1|2,0,0]=4 1270 B10R0.97 CC(=O)NCCNCC(=O)N 2230a_100000209853_100000747473 [1,0,0,0,0,1|2,0,0]=4 1271 B10R0.97 CC(=O)NCCNCC(=O)N 2230a_100000711301_100000189650 [1,0,0,0,0,1|2,0,0]=4 1272 B10R0.97 CC(=O)NCCNCC(=O)O 269956a_100016091260_100000189650 [1,0,0,0,0,1|1,0,0]=3 1273 B10R0.97 CC(=O)NCCNCC(C)O 2230a_100000209853_100011218427 [1,0,0,0,0,1|2,0,0]=4 1274 B10R0.97 CC(=O)NCCNCC(C)O 2230a_100000210904_100000189650 [1,0,0,0,0,1|2,0,0]=4 1275 B10R0.97 CC(=O)NCCNC[C@@H](C)O 2230a_100000209853_100009817552 [1,0,0,0,0,1|2,0,0]=4 1276 B10R0.97 CC(=O)NCCOCC(=O)N 34a_100000158858_100000187820 [1,0,0,0,0,1|2,0,0]=4 1277 B10R0.97 CC(=O)NCCOCC(=O)[O-] 34a_100000158858_100020667443 [1,0,0,0,0,1|1,0,1]=4 1278 B10R0.97 CC(=O)NCCOCC(C)O 34a_100000158858_100011218427 [1,0,0,0,0,1|2,0,0]=4 1279 B10R0.97 CC(=O)NCCOC[C@@H](C)O 34a_100000158858_100009817552 [1,0,0,0,0,1|2,0,0]=4 1280 B10R0.97 CC(=O)NCCOC[N+](=O)[O-] 34a_100000158858_100000761209 [1,0,0,0,0,1|1,0,1]=4 1281 B10R0.97 CC(=O)NCCSCC(=O)N 62a_100000189650_100000747473 [1,0,0,0,0,1|2,0,0]=4 1282 B10R0.97 CC(=O)NCCSCC(=O)N 62a_100000747473_100000189650 [1,0,0,0,0,1|2,0,0]=4 1283 B10R0.97 CC(=O)NCCSCC(=O)[O-] 62a_100000189650_100020667443 [1,0,0,0,0,1|1,0,1]=4 1284 B10R0.97 CC(=O)NCCSCC(=O)[O-] 62a_100020667443_100000189650 [1,0,0,0,0,1|1,0,1]=4 1285 B10R0.97 CC(=O)NCCSCC(C)O 62a_100000189650_100011218427 [1,0,0,0,0,1|2,0,0]=4 1286 B10R0.97 CC(=O)NCCSCC(C)O 62a_100011218427_100000189650 [1,0,0,0,0,1|2,0,0]=4 1287 B10R0.97 CC(=O)NCCSC[C@@H](C)O 62a_100000189650_100009817552 [1,0,0,0,0,1|2,0,0]=4 1288 B10R0.97 CC(=O)NCCSC[C@@H](C)O 62a_100009817552_100000189650 [1,0,0,0,0,1|2,0,0]=4 1289 B10R0.97 CC(=O)NCCSC[N+](=O)[O-] 62a_100000189650_100000761209 [1,0,0,0,0,1|1,0,1]=4 1290 B10R0.97 CC(=O)OCCNCC(=O)O 269956a_100016091260_100009814007 [1,0,0,0,0,1|2,0,0]=4 1291 B10R0.97 NC(=O)NCCNCC(=O)O 269956a_100016091260_200000034859 [1,0,0,0,0,1|2,0,0]=4 1292 B12R0.137 C=C(C)CCNCCCS(=O)(=O)C 2230a_100000742409_100000730704 [0,0,0,0,0,2|2,0,0]=4 1293 B12R0.137 C=C(C)CCNCCCS(=O)(=O)C 34a_100000742409_100000730704 [0,0,0,0,0,2|2,0,0]=4 1294 B12R0.137 C=C(C)CNCCCNS(=O)(=O)C 34a_100000736790_100000748629 [0,0,0,0,0,2|2,0,0]=4 1295 B12R0.137 CC(=CCNCCCS(=O)(=O)C)C 2230a_100000742409_100000761012 [0,0,0,0,0,2|2,0,0]=4 1296 B12R0.137 CC(=CCNCCCS(=O)(=O)C)C 34a_100000718196_100000754308 [0,0,0,0,0,2|2,0,0]=4 1297 B12R0.137 CC(=CCNCCCS(=O)(=O)C)C 34a_100000742409_100000761012 [0,0,0,0,0,2|2,0,0]=4 1298 B12R0.137 CC(=CCNCCCS(=O)(=O)N)C 34a_100000718196_100000750626 [0,0,0,0,0,2|2,0,0]=4 1299 B12R0.137 CC(=CCNCCCS(=O)(=O)[O-])C 34a_100000718196_100009813499 [0,0,0,0,0,2|1,0,1]=4 1300 B12R0.137 CC(=O)CCCCSCS(=O)(=O)N 62a_100000735457_100000741382 [0,0,0,0,0,2|2,0,0]=4 1301 B12R0.137 CC(=O)CCCCSCS(=O)(=O)N 62a_100000741382_100000735457 [0,0,0,0,0,2|2,0,0]=4 1302 B12R0.137 CC(=O)CCCCSCS(=O)(=O)[O-] 62a_100000735457_100009817235 [0,0,0,0,0,2|1,0,1]=4 1303 B12R0.137 CC(=O)CCCCSCS(=O)(=O)[O-] 62a_100009817235_100000735457 [0,0,0,0,0,2|1,0,1]=4 1304 B12R0.137 CC(=O)CCCNCCS(=O)(=O)C 34a_100000740961_100000685027 [0,0,0,0,0,2|2,0,0]=4 1305 B12R0.137 CC(=O)CCCNCCS(=O)(=O)N 34a_100000738205_100000685027 [0,0,0,0,0,2|2,0,0]=4 1306 B12R0.137 CC(=O)CCCOCCS(=O)(=O)C 34a_100000211924_100000685027 [0,0,0,0,0,2|2,0,0]=4 1307 B12R0.137 CC(=O)CCCOCCS(=O)(=O)C 34a_100000759063_100000731031 [0,0,0,0,0,2|2,0,0]=4 1308 B12R0.137 CC(=O)CCCOCCS(=O)(=O)C 7a_100000211924_100011215641 [0,0,0,0,0,2|2,0,0]=4 1309 B12R0.137 CC(=O)CCCOCCS(=O)(=O)C 7a_100000759063_100000230027 [0,0,0,0,0,2|2,0,0]=4 1310 B12R0.137 CC(=O)CCCOCCS(=O)(=O)N 34a_100012334274_100000685027 [0,0,0,0,0,2|2,0,0]=4 1311 B12R0.137 CC(=O)CCCOCCS(=O)(=O)[O-] 34a_100000759063_100000762736 [0,0,0,0,0,2|1,0,1]=4 1312 B12R0.137 CC(=O)CCCSCCS(=O)(=O)C 62a_100000731031_100011215641 [0,0,0,0,0,2|2,0,0]=4 1313 B12R0.137 CC(=O)CCCSCCS(=O)(=O)C 62a_100011215641_100000230027 [0,0,0,0,0,2|2,0,0]=4 1314 B12R0.137 CC(=O)CCCSCCS(=O)(=O)[O-] 62a_100000762736_100011215641 [0,0,0,0,0,2|1,0,1]=4 1315 B12R0.137 CC(=O)CCCSCCS(=O)(=O)[O-] 62a_100011215641_100000762736 [0,0,0,0,0,2|1,0,1]=4 1316 B12R0.137 CC(=O)CCOCCCS(=O)(=O)C 34a_100000759926_100000754308 [0,0,0,0,0,2|2,0,0]=4 1317 B12R0.137 CC(=O)CCOCCCS(=O)(=O)C 7a_100000689940_100000053229 [0,0,0,0,0,2|2,0,0]=4 1318 B12R0.137 CC(=O)CCOCCCS(=O)(=O)C 7a_100000759926_100000754308 [0,0,0,0,0,2|2,0,0]=4 1319 B12R0.137 CC(=O)CCOCCCS(=O)(=O)N 34a_100000759926_100000750626 [0,0,0,0,0,2|2,0,0]=4 1320 B12R0.137 CC(=O)CCOCCCS(=O)(=O)N 7a_100000759926_100000750626 [0,0,0,0,0,2|2,0,0]=4 1321 B12R0.137 CC(=O)CCOCCCS(=O)(=O)[O-] 34a_100000759926_100009813499 [0,0,0,0,0,2|1,0,1]=4 1322 B12R0.137 CC(=O)CCOCCNS(=O)(=O)C 7a_100000759926_100000754112 [0,0,0,0,0,2|2,0,0]=4 1323 B12R0.137 CC(=O)CCOCCOS(=O)(=O)C 1458a_100000070787_100015571617 [0,0,0,0,0,2|2,0,0]=4 1324 B12R0.137 CC(=O)CCOCCOS(=O)(=O)C 34a_100000759926_200000036756 [0,0,0,0,0,2|2,0,0]=4 1325 B12R0.137 CC(=O)CCOCCOS(=O)(=O)C 7a_100000759926_200000036756 [0,0,0,0,0,2|2,0,0]=4 1326 B12R0.137 CC(=O)CCSCCCS(=O)(=O)C 62a_100000053229_100000754308 [0,0,0,0,0,2|2,0,0]=4 1327 B12R0.137 CC(=O)CCSCCCS(=O)(=O)C 62a_100000754308_100000053229 [0,0,0,0,0,2|2,0,0]=4 1328 B12R0.137 CC(=O)CCSCCCS(=O)(=O)N 62a_100000053229_100000750626 [0,0,0,0,0,2|2,0,0]=4 1329 B12R0.137 CC(=O)CCSCCCS(=O)(=O)N 62a_100000750626_100000053229 [0,0,0,0,0,2|2,0,0]=4 1330 B12R0.137 CC(=O)CCSCCCS(=O)(=O)[O-] 62a_100000053229_100009813499 [0,0,0,0,0,2|1,0,1]=4 1331 B12R0.137 CC(=O)CCSCCCS(=O)(=O)[O-] 62a_100009813499_100000053229 [0,0,0,0,0,2|1,0,1]=4 1332 B12R0.137 CC(=O)CCSCCNS(=O)(=O)C 62a_100000053229_100000754112 [0,0,0,0,0,2|2,0,0]=4 1333 B12R0.137 CC(=O)CCSCCNS(=O)(=O)C 62a_100000754112_100000053229 [0,0,0,0,0,2|2,0,0]=4 1334 B12R0.137 CC(=O)CCSCCOS(=O)(=O)C 62a_100000053229_200000036756 [0,0,0,0,0,2|2,0,0]=4 1335 B12R0.137 CC(=O)CCSCCOS(=O)(=O)C 62a_200000036756_100000053229 [0,0,0,0,0,2|2,0,0]=4 1336 B12R0.137 CC(=O)NCCCCNS(=O)(=O)C 40a_200011368371_100000738038 [0,0,0,0,0,2|1,0,0]=3 1337 B12R0.137 CC(=O)NCCCNCS(=O)(=O)[O-] 34a_100000736810_100009817235 [0,0,0,0,0,2|0,0,1]=3 1338 B12R0.137 CC(=O)NCCCOCS(=O)(=O)[O-] 34a_100000752032_100009817235 [0,0,0,0,0,2|0,0,1]=3 1339 B12R0.137 CC(=O)NCCNCCS(=O)(=O)C 2230a_100000209853_100000731031 [0,0,0,0,0,2|1,0,0]=3 1340 B12R0.137 CC(=O)NCCNCCS(=O)(=O)C 2230a_100000740961_100000189650 [0,0,0,0,0,2|1,0,0]=3 1341 B12R0.137 CC(=O)NCCNCCS(=O)(=O)N 2230a_100000738205_100000189650 [0,0,0,0,0,2|1,0,0]=3 1342 B12R0.137 CC(=O)NCCNCCS(=O)(=O)[O-] 2230a_100000209853_100000737633 [0,0,0,0,0,2|0,0,1]=3 1343 B12R0.137 CC(=O)NCCOCCS(=O)(=O)C 34a_100000158858_100000731031 [0,0,0,0,0,2|1,0,0]=3 1344 B12R0.137 CC(=O)NCCOCCS(=O)(=O)C 7a_100000211924_100000189650 [0,0,0,0,0,2|1,0,0]=3 1345 B12R0.137 CC(=O)NCCOCCS(=O)(=O)[O-] 34a_100000158858_100000762736 [0,0,0,0,0,2|0,0,1]=3 1346 B12R0.137 CC(=O)NCCSCCS(=O)(=O)C 62a_100000189650_100000230027 [0,0,0,0,0,2|1,0,0]=3 1347 B12R0.137 CC(=O)NCCSCCS(=O)(=O)C 62a_100000731031_100000189650 [0,0,0,0,0,2|1,0,0]=3 1348 B12R0.137 CC(=O)NCCSCCS(=O)(=O)[O-] 62a_100000189650_100000762736 [0,0,0,0,0,2|0,0,1]=3 1349 B12R0.137 CC(=O)NCCSCCS(=O)(=O)[O-] 62a_100000762736_100000189650 [0,0,0,0,0,2|0,0,1]=3 1350 B12R0.137 CC(=O)OCCCSCS(=O)(=O)N 62a_100000042594_100000741382 [0,0,0,0,0,2|2,0,0]=4 1351 B12R0.137 CC(=O)OCCCSCS(=O)(=O)N 62a_100000741382_100000042594 [0,0,0,0,0,2|2,0,0]=4 1352 B12R0.137 CC(=O)OCCCSCS(=O)(=O)[O-] 62a_100000042594_100009817235 [0,0,0,0,0,2|1,0,1]=4 1353 B12R0.137 CC(=O)OCCCSCS(=O)(=O)[O-] 62a_100009817235_100000042594 [0,0,0,0,0,2|1,0,1]=4 1354 B12R0.137 CC(=O)OCCNCCS(=O)(=O)C 34a_100000740961_100009814007 [0,0,0,0,0,2|2,0,0]=4 1355 B12R0.137 CC(=O)OCCNCCS(=O)(=O)N 34a_100000738205_100009814007 [0,0,0,0,0,2|2,0,0]=4 1356 B12R0.137 CC(=O)OCCOCCS(=O)(=O)C 34a_100000211924_100009814007 [0,0,0,0,0,2|2,0,0]=4 1357 B12R0.137 CC(=O)OCCOCCS(=O)(=O)C 7a_100000211924_100009814007 [0,0,0,0,0,2|2,0,0]=4 1358 B12R0.137 CC(=O)OCCOCCS(=O)(=O)N 34a_100012334274_100009814007 [0,0,0,0,0,2|2,0,0]=4 1359 B12R0.137 CC(=O)OCCSCCS(=O)(=O)C 62a_100000731031_100009814007 [0,0,0,0,0,2|2,0,0]=4 1360 B12R0.137 CC(=O)OCCSCCS(=O)(=O)C 62a_100009814007_100000230027 [0,0,0,0,0,2|2,0,0]=4 1361 B12R0.137 CC(=O)OCCSCCS(=O)(=O)[O-] 62a_100000762736_100009814007 [0,0,0,0,0,2|1,0,1]=4 1362 B12R0.137 CC(=O)OCCSCCS(=O)(=O)[O-] 62a_100009814007_100000762736 [0,0,0,0,0,2|1,0,1]=4 1363 B12R0.137 CC(=O)OCNCCCS(=O)(=O)C 34a_100000742409_100009813279 [0,0,0,0,0,2|1,0,0]=3 1364 B12R0.137 CC(=O)OCNCCNS(=O)(=O)C 34a_100000752411_100009813279 [0,0,0,0,0,2|2,0,0]=4 1365 B12R0.137 CC(=O)OCOCCCS(=O)(=O)C 34a_100000689940_100009813279 [0,0,0,0,0,2|2,0,0]=4 1366 B12R0.137 CC(=O)OCSCCCS(=O)(=O)C 62a_100000076356_100000754308 [0,0,0,0,0,2|2,0,0]=4 1367 B12R0.137 CC(=O)OCSCCCS(=O)(=O)C 62a_100000754308_100000076356 [0,0,0,0,0,2|2,0,0]=4 1368 B12R0.137 CC(=O)OCSCCCS(=O)(=O)N 62a_100000076356_100000750626 [0,0,0,0,0,2|2,0,0]=4 1369 B12R0.137 CC(=O)OCSCCCS(=O)(=O)N 62a_100000750626_100000076356 [0,0,0,0,0,2|2,0,0]=4 1370 B12R0.137 CC(=O)OCSCCCS(=O)(=O)[O-] 62a_100000076356_100009813499 [0,0,0,0,0,2|1,0,1]=4 1371 B12R0.137 CC(=O)OCSCCCS(=O)(=O)[O-] 62a_100009813499_100000076356 [0,0,0,0,0,2|1,0,1]=4 1372 B12R0.137 CC(=O)OCSCCNS(=O)(=O)C 62a_100000076356_100000754112 [0,0,0,0,0,2|2,0,0]=4 1373 B12R0.137 CC(=O)OCSCCNS(=O)(=O)C 62a_100000754112_100000076356 [0,0,0,0,0,2|2,0,0]=4 1374 B12R0.137 CC(=O)OCSCCOS(=O)(=O)C 62a_100000076356_200000036756 [0,0,0,0,0,2|2,0,0]=4 1375 B12R0.137 CC(=O)OCSCCOS(=O)(=O)C 62a_200000036756_100000076356 [0,0,0,0,0,2|2,0,0]=4 1376 B12R0.137 CC(=O)SCCCSCS(=O)(=O)N 62a_100000038929_100000741382 [0,0,0,0,0,2|2,0,0]=4 1377 B12R0.137 CC(=O)SCCCSCS(=O)(=O)N 62a_100000741382_100000038929 [0,0,0,0,0,2|2,0,0]=4 1378 B12R0.137 CC(=O)SCCCSCS(=O)(=O)[O-] 62a_100000038929_100009817235 [0,0,0,0,0,2|1,0,1]=4 1379 B12R0.137 CC(=O)SCCCSCS(=O)(=O)[O-] 62a_100009817235_100000038929 [0,0,0,0,0,2|1,0,1]=4 1380 B12R0.137 CS(=O)(=O)CCCNCCC(=O)N 2230a_100000742409_100000744528 [0,0,0,0,0,2|2,0,0]=4 1381 B12R0.137 CS(=O)(=O)CCCNCCC(=O)N 34a_100000742409_100000731001 [0,0,0,0,0,2|2,0,0]=4 1382 B12R0.137 CS(=O)(=O)CCCNOCC(=O)O 269956a_100000106656_100000754308 [0,0,0,0,0,2|2,0,0]=4 1383 B12R0.137 CS(=O)(=O)CCNCCNC(=O)N 2230a_100000740961_200000034859 [0,0,0,0,0,2|2,0,0]=4 1384 B12R0.137 CS(=O)(=O)CCNCCNC(=O)N 34a_100020590234_100000731031 [0,0,0,0,0,2|2,0,0]=4 1385 B12R0.137 CS(=O)(=O)CCOCCNC(=O)N 34a_100000181757_100000731031 [0,0,0,0,0,2|2,0,0]=4 1386 B12R0.137 CS(=O)(=O)CCOCCNC(=O)N 7a_100000211924_200000034859 [0,0,0,0,0,2|2,0,0]=4 1387 B12R0.137 CS(=O)(=O)CCSCCNC(=O)N 62a_100000731031_200000034859 [0,0,0,0,0,2|2,0,0]=4 1388 B12R0.137 CS(=O)(=O)CCSCCNC(=O)N 62a_200000034859_100000230027 [0,0,0,0,0,2|2,0,0]=4 1389 B12R0.137 CS(=O)(=O)NCCCNCC(=O)N 34a_100000736790_100000187820 [0,0,0,0,0,2|2,0,0]=4 1390 B12R0.137 CS(=O)(=O)NCCCNCC(=O)[O-] 34a_100000736790_100020667443 [0,0,0,0,0,2|2,0,0]=4 1391 B12R0.137 NC(=O)NCCNCCS(=O)(=O)N 2230a_100000738205_200000034859 [0,0,0,0,0,2|2,0,0]=4 1392 B12R0.137 NC(=O)NCCNCCS(=O)(=O)[O-] 34a_100020590234_100000762736 [0,0,0,0,0,2|1,0,1]=4 1393 B12R0.137 NC(=O)NCCOCCS(=O)(=O)[O-] 34a_100000181757_100000762736 [0,0,0,0,0,2|1,0,1]=4 1394 B12R0.137 NC(=O)NCCSCCS(=O)(=O)[O-] 62a_100000762736_200000034859 [0,0,0,0,0,2|1,0,1]=4 1395 B12R0.137 NC(=O)NCCSCCS(=O)(=O)[O-] 62a_200000034859_100000762736 [0,0,0,0,0,2|1,0,1]=4 1396 B12R0.137 NS(=O)(=O)CCCNOCC(=O)O 269956a_100000106656_100000750626 [0,0,0,0,0,2|2,0,0]=4 1397 B12R0.137 O=C(O)CONCCCS(=O)(=O)[O-] 269956a_100000106656_100009813499 [0,0,0,0,0,2|1,0,1]=4