0 B10R1.18 C=C(C)CN1CCCOC1 2230a_100000131196_100000748629 [0,0,0,0,0,0|4,0,0]=4 1 B10R1.18 C=C(C)CN1CCCOC1 269982a_100000131196_100000748629 [0,0,0,0,0,0|4,0,0]=4 2 B10R1.18 C=C(C)CN1CCCOC1 34a_100000131196_100000748629 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.18 C=C(C)CN1CCOCC1 2230a_100015191051_100000748629 [0,0,0,0,0,0|4,0,0]=4 4 B10R1.18 C=C(C)CN1CCOCC1 269982a_100015191051_100000748629 [0,0,0,0,0,0|4,0,0]=4 5 B10R1.18 C=C(C)CN1CCOCC1 34a_100015191051_100000748629 [0,0,0,0,0,0|4,0,0]=4 6 B10R1.18 C=C(C)CN1CCSCC1 2230a_100000737611_100000748629 [0,0,0,0,0,0|4,0,0]=4 7 B10R1.18 C=C(C)CN1CCSCC1 269982a_100000737611_100000748629 [0,0,0,0,0,0|4,0,0]=4 8 B10R1.18 C=C(F)CN1CCCOC1 2230a_100000131196_100009893438 [0,0,0,0,0,0|4,0,0]=4 9 B10R1.18 C=C(F)CN1CCCOC1 269982a_100000131196_100009893438 [0,0,0,0,0,0|4,0,0]=4 10 B10R1.18 C=C(F)CN1CCCOC1 34a_100000131196_100009893438 [0,0,0,0,0,0|4,0,0]=4 11 B10R1.18 C=C(F)CN1CCOCC1 2230a_100015191051_100009893438 [0,0,0,0,0,0|4,0,0]=4 12 B10R1.18 C=C(F)CN1CCOCC1 269982a_100015191051_100009893438 [0,0,0,0,0,0|4,0,0]=4 13 B10R1.18 C=C(F)CN1CCOCC1 34a_100015191051_100009893438 [0,0,0,0,0,0|4,0,0]=4 14 B10R1.18 C=C(F)CN1CCSCC1 2230a_100000737611_100009893438 [0,0,0,0,0,0|4,0,0]=4 15 B10R1.18 C=C(F)CN1CCSCC1 269982a_100000737611_100009893438 [0,0,0,0,0,0|4,0,0]=4 16 B10R1.18 CC(=O)C=C1CCCCC1 1458a_100000743792_200000210301 [0,0,0,0,0,0|1,0,2]=3 17 B10R1.18 CC(=O)C=C1CCOCC1 1458a_100000761426_200000210301 [0,0,0,0,0,0|2,0,2]=4 18 B10R1.18 CC(=O)CC1=CCCCC1 1458a_100000039269_200000210301 [0,0,0,0,0,0|1,0,2]=3 19 B10R1.18 CC(=O)CC1CCCCC1 1458a_100000070787_100000211423 [0,0,0,0,0,0|1,0,0]=1 20 B10R1.18 CC(=O)CC1CCCCC1 1458a_100000211666_200000210301 [0,0,0,0,0,0|1,0,0]=1 21 B10R1.18 CC(=O)CC1CCCCO1 1458a_100000070787_100000211543 [0,0,0,0,0,0|2,0,0]=2 22 B10R1.18 CC(=O)CC1CCCCO1 1458a_100000238585_200000210301 [0,0,0,0,0,0|2,0,0]=2 23 B10R1.18 CC(=O)CC1CCCOC1 1458a_100000070787_100000741521 [0,0,0,0,0,0|2,0,0]=2 24 B10R1.18 CC(=O)CC1CCCOC1 1458a_100000741523_200000210301 [0,0,0,0,0,0|2,0,0]=2 25 B10R1.18 CC(=O)CC1CCOCC1 1458a_100000070787_100000754603 [0,0,0,0,0,0|2,0,0]=2 26 B10R1.18 CC(=O)CC1CCOCC1 1458a_100000757261_200000210301 [0,0,0,0,0,0|2,0,0]=2 27 B10R1.18 CC(=O)CN1CCCCC1 1458a_100000740322_200000210301 [0,0,0,0,0,0|2,0,0]=2 28 B10R1.18 CC(=O)CN1CCOCC1 1458a_100000740321_200000210301 [0,0,0,0,0,0|3,0,0]=3 29 B10R1.18 CC(=O)NC1CCCCC1 11a_100000182618_100015343762 [0,0,0,0,0,0|2,0,0]=2 30 B10R1.18 CC(=O)NC1CCCCC1 1626a_100000182618_100015343762 [0,0,0,0,0,0|2,0,0]=2 31 B10R1.18 CC(=O)NC1CCCCC1 240690a_100000182618_100015343762 [0,0,0,0,0,0|2,0,0]=2 32 B10R1.18 CC(=O)NC1CCCCC1 527a_100000182618_100103153847 [0,0,0,0,0,0|2,0,0]=2 33 B10R1.18 CC(=O)NC1CCCOC1 11a_100000719290_100015343762 [0,0,0,0,0,0|3,0,0]=3 34 B10R1.18 CC(=O)NC1CCCOC1 1626a_100000719290_100015343762 [0,0,0,0,0,0|3,0,0]=3 35 B10R1.18 CC(=O)NC1CCCOC1 240690a_100000719290_100015343762 [0,0,0,0,0,0|3,0,0]=3 36 B10R1.18 CC(=O)NC1CCCOC1 527a_100000719290_100103153847 [0,0,0,0,0,0|3,0,0]=3 37 B10R1.18 CC(=O)NC1CCOCC1 11a_100000741149_100015343762 [0,0,0,0,0,0|3,0,0]=3 38 B10R1.18 CC(=O)NC1CCOCC1 1626a_100000741149_100015343762 [0,0,0,0,0,0|3,0,0]=3 39 B10R1.18 CC(=O)NC1CCOCC1 240690a_100000741149_100015343762 [0,0,0,0,0,0|3,0,0]=3 40 B10R1.18 CC(=O)NC1CCOCC1 527a_100000741149_100103153847 [0,0,0,0,0,0|3,0,0]=3 41 B10R1.18 CC(=O)NC1CCSCC1 11a_100000748639_100015343762 [0,0,0,0,0,0|3,0,0]=3 42 B10R1.18 CC(=O)NC1CCSCC1 1626a_100000748639_100015343762 [0,0,0,0,0,0|3,0,0]=3 43 B10R1.18 CC(=O)NC1CCSCC1 240690a_100000748639_100015343762 [0,0,0,0,0,0|3,0,0]=3 44 B10R1.18 CC(=O)NC1CCSCC1 527a_100000748639_100103153847 [0,0,0,0,0,0|3,0,0]=3 45 B10R1.18 CC(C)NC1CCCCC1 2230a_100000182618_100000210206 [0,0,0,0,0,0|3,0,1]=4 46 B10R1.18 CC(C)NC1CCCCC1 34a_100000182618_100000210206 [0,0,0,0,0,0|3,0,1]=4 47 B10R1.18 CC(C)NC1CCCCC1 34a_100138425928_100000210327 [0,0,0,0,0,0|3,0,1]=4 48 B10R1.18 CC(C)OC1CCCCC1 34a_100000210231_100000210206 [0,0,0,0,0,0|3,0,1]=4 49 B10R1.18 CC(C)OC1CCCCC1 34a_100000212225_100000210327 [0,0,0,0,0,0|3,0,1]=4 50 B10R1.18 CC(C)OC1CCCCC1 7a_100000210231_100000210206 [0,0,0,0,0,0|3,0,1]=4 51 B10R1.18 CC(C)SC1CCCCC1 62a_100000210206_100000210327 [0,0,0,0,0,0|3,0,1]=4 52 B10R1.18 CC(C)SC1CCCCC1 62a_100000210327_100000210206 [0,0,0,0,0,0|3,0,1]=4 53 B10R1.18 CC(O)CN1CCCOC1 2230a_100000131196_100011218427 [0,0,0,0,0,0|3,0,1]=4 54 B10R1.18 CC(O)CN1CCCOC1 269982a_100000131196_100011218427 [0,0,0,0,0,0|3,0,1]=4 55 B10R1.18 CC(O)CN1CCCOC1 34a_100000131196_100011218427 [0,0,0,0,0,0|3,0,1]=4 56 B10R1.18 CC(O)CN1CCOCC1 2230a_100015191051_100011218427 [0,0,0,0,0,0|3,0,1]=4 57 B10R1.18 CC(O)CN1CCOCC1 269982a_100015191051_100011218427 [0,0,0,0,0,0|3,0,1]=4 58 B10R1.18 CC(O)CN1CCOCC1 34a_100015191051_100011218427 [0,0,0,0,0,0|3,0,1]=4 59 B10R1.18 CC(O)CN1CCSCC1 2230a_100000737611_100011218427 [0,0,0,0,0,0|3,0,1]=4 60 B10R1.18 CC(O)CN1CCSCC1 269982a_100000737611_100011218427 [0,0,0,0,0,0|3,0,1]=4 61 B10R1.18 CN(C)CC1CCCCC1 2230a_100000736448_200000210301 [0,0,0,0,0,0|3,0,0]=3 62 B10R1.18 CN(C)CC1CCCCC1 2230a_100102631434_100000211423 [0,0,0,0,0,0|3,0,0]=3 63 B10R1.18 CN(C)CC1CCCCC1 269982a_100000736448_200000210301 [0,0,0,0,0,0|3,0,0]=3 64 B10R1.18 CN(C)CC1CCCCC1 269982a_100102631434_100000211423 [0,0,0,0,0,0|3,0,0]=3 65 B10R1.18 CN(C)CC1CCCCC1 34a_100000736448_200000210301 [0,0,0,0,0,0|3,0,0]=3 66 B10R1.18 CN(C)CC1CCCCO1 2230a_100000225654_200000210301 [0,0,0,0,0,0|4,0,0]=4 67 B10R1.18 CN(C)CC1CCCCO1 2230a_100102631434_100000211543 [0,0,0,0,0,0|4,0,0]=4 68 B10R1.18 CN(C)CC1CCCCO1 269982a_100000225654_200000210301 [0,0,0,0,0,0|4,0,0]=4 69 B10R1.18 CN(C)CC1CCCCO1 269982a_100102631434_100000211543 [0,0,0,0,0,0|4,0,0]=4 70 B10R1.18 CN(C)CC1CCCCO1 34a_100000225654_200000210301 [0,0,0,0,0,0|4,0,0]=4 71 B10R1.18 CN(C)CC1CCCOC1 2230a_100102631434_100000741521 [0,0,0,0,0,0|4,0,0]=4 72 B10R1.18 CN(C)CC1CCCOC1 269982a_100102631434_100000741521 [0,0,0,0,0,0|4,0,0]=4 73 B10R1.18 CN(C)CC1CCOCC1 2230a_100025706683_200000210301 [0,0,0,0,0,0|4,0,0]=4 74 B10R1.18 CN(C)CC1CCOCC1 2230a_100102631434_100000754603 [0,0,0,0,0,0|4,0,0]=4 75 B10R1.18 CN(C)CC1CCOCC1 269982a_100025706683_200000210301 [0,0,0,0,0,0|4,0,0]=4 76 B10R1.18 CN(C)CC1CCOCC1 269982a_100102631434_100000754603 [0,0,0,0,0,0|4,0,0]=4 77 B10R1.18 CN(C)CC1CCOCC1 34a_100025706683_200000210301 [0,0,0,0,0,0|4,0,0]=4 78 B10R1.18 CN(C)CC1CCSCC1 2230a_100011935259_200000210301 [0,0,0,0,0,0|4,0,0]=4 79 B10R1.18 CN(C)CC1CCSCC1 269982a_100011935259_200000210301 [0,0,0,0,0,0|4,0,0]=4 80 B10R1.18 CN(C)CC1CCSCC1 270004a_100102631434_100000067145 [0,0,0,0,0,0|4,0,0]=4 81 B10R1.18 CN(C)CC1CCSCC1 34a_100011935259_200000210301 [0,0,0,0,0,0|4,0,0]=4 82 B10R1.18 CN([13CH3])CC1CCCCC1 2230a_100000736448_200025704644 [0,0,0,0,0,0|3,0,0]=3 83 B10R1.18 CN([13CH3])CC1CCCCC1 269982a_100000736448_200025704644 [0,0,0,0,0,0|3,0,0]=3 84 B10R1.18 CN([13CH3])CC1CCCCC1 34a_100000736448_200025704644 [0,0,0,0,0,0|3,0,0]=3 85 B10R1.18 CN([13CH3])CC1CCCCO1 2230a_100000225654_200025704644 [0,0,0,0,0,0|4,0,0]=4 86 B10R1.18 CN([13CH3])CC1CCCCO1 269982a_100000225654_200025704644 [0,0,0,0,0,0|4,0,0]=4 87 B10R1.18 CN([13CH3])CC1CCCCO1 34a_100000225654_200025704644 [0,0,0,0,0,0|4,0,0]=4 88 B10R1.18 CN([13CH3])CC1CCOCC1 2230a_100025706683_200025704644 [0,0,0,0,0,0|4,0,0]=4 89 B10R1.18 CN([13CH3])CC1CCOCC1 269982a_100025706683_200025704644 [0,0,0,0,0,0|4,0,0]=4 90 B10R1.18 CN([13CH3])CC1CCOCC1 34a_100025706683_200025704644 [0,0,0,0,0,0|4,0,0]=4 91 B10R1.18 CN([13CH3])CC1CCSCC1 2230a_100011935259_200025704644 [0,0,0,0,0,0|4,0,0]=4 92 B10R1.18 CN([13CH3])CC1CCSCC1 269982a_100011935259_200025704644 [0,0,0,0,0,0|4,0,0]=4 93 B10R1.18 CN([13CH3])CC1CCSCC1 34a_100011935259_200025704644 [0,0,0,0,0,0|4,0,0]=4 94 B10R1.18 C[C@@H](O)CN1CCCOC1 2230a_100000131196_100009817552 [0,0,0,0,0,0|3,0,1]=4 95 B10R1.18 C[C@@H](O)CN1CCCOC1 269982a_100000131196_100009817552 [0,0,0,0,0,0|3,0,1]=4 96 B10R1.18 C[C@@H](O)CN1CCCOC1 34a_100000131196_100009817552 [0,0,0,0,0,0|3,0,1]=4 97 B10R1.18 C[C@@H](O)CN1CCOCC1 2230a_100015191051_100009817552 [0,0,0,0,0,0|3,0,1]=4 98 B10R1.18 C[C@@H](O)CN1CCOCC1 269982a_100015191051_100009817552 [0,0,0,0,0,0|3,0,1]=4 99 B10R1.18 C[C@@H](O)CN1CCOCC1 34a_100015191051_100009817552 [0,0,0,0,0,0|3,0,1]=4 100 B10R1.18 C[C@@H](O)CN1CCSCC1 2230a_100000737611_100009817552 [0,0,0,0,0,0|3,0,1]=4 101 B10R1.18 C[C@@H](O)CN1CCSCC1 269982a_100000737611_100009817552 [0,0,0,0,0,0|3,0,1]=4 102 B10R1.18 NC(=O)CN1CC=CCC1 2230a_100000698166_100000747473 [0,0,0,0,0,0|2,0,2]=4 103 B10R1.18 NC(=O)CN1CC=CCC1 269982a_100000698166_100000187820 [0,0,0,0,0,0|2,0,2]=4 104 B10R1.18 NC(=O)CN1CC=CCC1 34a_100000698166_100000187820 [0,0,0,0,0,0|2,0,2]=4 105 B10R1.18 NC(=O)CN1CCCOC1 2230a_100000131196_100000747473 [0,0,0,0,0,0|3,0,0]=3 106 B10R1.18 NC(=O)CN1CCCOC1 269982a_100000131196_100000187820 [0,0,0,0,0,0|3,0,0]=3 107 B10R1.18 NC(=O)CN1CCCOC1 34a_100000131196_100000187820 [0,0,0,0,0,0|3,0,0]=3 108 B10R1.18 NC(=O)CN1CCOCC1 2230a_100015191051_100000747473 [0,0,0,0,0,0|3,0,0]=3 109 B10R1.18 NC(=O)CN1CCOCC1 269982a_100015191051_100000187820 [0,0,0,0,0,0|3,0,0]=3 110 B10R1.18 NC(=O)CN1CCOCC1 34a_100015191051_100000187820 [0,0,0,0,0,0|3,0,0]=3 111 B10R1.18 NC(=O)CN1CCSCC1 2230a_100000737611_100000747473 [0,0,0,0,0,0|3,0,0]=3 112 B10R1.18 NC(=O)CN1CCSCC1 269982a_100000737611_100000187820 [0,0,0,0,0,0|3,0,0]=3 113 B10R1.18 O=C([O-])CN1CC=CCC1 269982a_100000698166_100020667443 [0,0,0,0,0,0|1,0,3]=4 114 B10R1.18 O=C([O-])CN1CC=CCC1 34a_100000698166_100020667443 [0,0,0,0,0,0|1,0,3]=4 115 B10R1.18 O=C([O-])CN1CCCOC1 269982a_100000131196_100020667443 [0,0,0,0,0,0|2,0,1]=3 116 B10R1.18 O=C([O-])CN1CCCOC1 34a_100000131196_100020667443 [0,0,0,0,0,0|2,0,1]=3 117 B10R1.18 O=C([O-])CN1CCOCC1 269982a_100015191051_100020667443 [0,0,0,0,0,0|2,0,1]=3 118 B10R1.18 O=C([O-])CN1CCOCC1 34a_100015191051_100020667443 [0,0,0,0,0,0|2,0,1]=3 119 B10R1.18 O=C([O-])CN1CCSCC1 269982a_100000737611_100020667443 [0,0,0,0,0,0|2,0,1]=3 120 B10R1.18 O=[N+]([O-])CN1CCCOC1 269982a_100000131196_100000761209 [0,0,0,0,0,0|3,0,1]=4 121 B10R1.18 O=[N+]([O-])CN1CCCOC1 34a_100000131196_100000761209 [0,0,0,0,0,0|3,0,1]=4 122 B10R1.18 O=[N+]([O-])CN1CCOCC1 269982a_100015191051_100000761209 [0,0,0,0,0,0|3,0,1]=4 123 B10R1.18 O=[N+]([O-])CN1CCOCC1 34a_100015191051_100000761209 [0,0,0,0,0,0|3,0,1]=4 124 B10R1.18 O=[N+]([O-])CN1CCSCC1 269982a_100000737611_100000761209 [0,0,0,0,0,0|3,0,1]=4 125 B10R1.18 [13CH3]C(=O)C=C1CCCCC1 1458a_100000743792_200025704644 [0,0,0,0,0,0|1,0,2]=3 126 B10R1.18 [13CH3]C(=O)C=C1CCOCC1 1458a_100000761426_200025704644 [0,0,0,0,0,0|2,0,2]=4 127 B10R1.18 [13CH3]C(=O)CC1=CCCCC1 1458a_100000039269_200025704644 [0,0,0,0,0,0|1,0,2]=3 128 B10R1.18 [13CH3]C(=O)CC1CCCCC1 1458a_100000211666_200025704644 [0,0,0,0,0,0|1,0,0]=1 129 B10R1.18 [13CH3]C(=O)CC1CCCCO1 1458a_100000238585_200025704644 [0,0,0,0,0,0|2,0,0]=2 130 B10R1.18 [13CH3]C(=O)CC1CCCOC1 1458a_100000741523_200025704644 [0,0,0,0,0,0|2,0,0]=2 131 B10R1.18 [13CH3]C(=O)CC1CCOCC1 1458a_100000757261_200025704644 [0,0,0,0,0,0|2,0,0]=2 132 B10R1.18 [13CH3]C(=O)CN1CCCCC1 1458a_100000740322_200025704644 [0,0,0,0,0,0|2,0,0]=2 133 B10R1.18 [13CH3]C(=O)CN1CCOCC1 1458a_100000740321_200025704644 [0,0,0,0,0,0|3,0,0]=3 134 B9R1.8 C=CCN1CCCOC1 2230a_100000131196_100000210623 [1,0,0,0,0,0|3,0,0]=4 135 B9R1.8 C=CCN1CCCOC1 269982a_100000131196_100000210623 [1,0,0,0,0,0|3,0,0]=4 136 B9R1.8 C=CCN1CCCOC1 34a_100000131196_100015514636 [1,0,0,0,0,0|3,0,0]=4 137 B9R1.8 C=CCN1CCOCC1 2230a_100015191051_100000210623 [1,0,0,0,0,0|3,0,0]=4 138 B9R1.8 C=CCN1CCOCC1 269982a_100015191051_100000210623 [1,0,0,0,0,0|3,0,0]=4 139 B9R1.8 C=CCN1CCOCC1 34a_100015191051_100015514636 [1,0,0,0,0,0|3,0,0]=4 140 B9R1.8 C=CCN1CCSCC1 2230a_100000737611_100000210623 [1,0,0,0,0,0|3,0,0]=4 141 B9R1.8 C=CCN1CCSCC1 269982a_100000737611_100000210623 [1,0,0,0,0,0|3,0,0]=4 142 B9R1.8 CCNC1CCCCC1 2230a_100000182618_100000210202 [1,0,0,0,0,0|2,0,1]=4 143 B9R1.8 CCNC1CCCCC1 270004a_100015525214_100000210434 [1,0,0,0,0,0|2,0,1]=4 144 B9R1.8 CCNC1CCCCC1 34a_100000182618_100000210202 [1,0,0,0,0,0|2,0,1]=4 145 B9R1.8 CCOC1CCCCC1 34a_100000210231_100000210202 [1,0,0,0,0,0|2,0,1]=4 146 B9R1.8 CCOC1CCCCC1 34a_100121572206_100000210327 [1,0,0,0,0,0|2,0,1]=4 147 B9R1.8 CCOC1CCCCC1 7a_100000210231_100000210202 [1,0,0,0,0,0|2,0,1]=4 148 B9R1.8 CCSC1CCCCC1 62a_100000210202_100000210327 [1,0,0,0,0,0|2,0,1]=4 149 B9R1.8 CCSC1CCCCC1 62a_100000210327_100000210202 [1,0,0,0,0,0|2,0,1]=4 150 B9R1.8 CNCC1CCCCC1 2230a_100000210473_200000210301 [1,0,0,0,0,0|2,0,0]=3 151 B9R1.8 CNCC1CCCCC1 2230a_106832991635_100000211423 [1,0,0,0,0,0|2,0,0]=3 152 B9R1.8 CNCC1CCCCC1 269862a_106832991636_100000211278 [1,0,0,0,0,0|2,0,0]=3 153 B9R1.8 CNCC1CCCCC1 34a_100000210473_200000210301 [1,0,0,0,0,0|2,0,0]=3 154 B9R1.8 CNCC1CCCCC1 34a_100102657272_100000211423 [1,0,0,0,0,0|2,0,0]=3 155 B9R1.8 CNCC1CCCCC1 7a_106832991635_100000211423 [1,0,0,0,0,0|2,0,0]=3 156 B9R1.8 CNCC1CCCCO1 2230a_100000174945_200000210301 [1,0,0,0,0,0|3,0,0]=4 157 B9R1.8 CNCC1CCCCO1 2230a_106832991635_100000211543 [1,0,0,0,0,0|3,0,0]=4 158 B9R1.8 CNCC1CCCCO1 34a_100000174945_200000210301 [1,0,0,0,0,0|3,0,0]=4 159 B9R1.8 CNCC1CCCCO1 34a_100102657272_100000211543 [1,0,0,0,0,0|3,0,0]=4 160 B9R1.8 CNCC1CCCCO1 7a_106832991635_100000211543 [1,0,0,0,0,0|3,0,0]=4 161 B9R1.8 CNCC1CCCOC1 2230a_100000720124_200000210301 [1,0,0,0,0,0|3,0,0]=4 162 B9R1.8 CNCC1CCCOC1 2230a_106832991635_100000741521 [1,0,0,0,0,0|3,0,0]=4 163 B9R1.8 CNCC1CCCOC1 34a_100000720124_200000210301 [1,0,0,0,0,0|3,0,0]=4 164 B9R1.8 CNCC1CCCOC1 34a_100102657272_100000741521 [1,0,0,0,0,0|3,0,0]=4 165 B9R1.8 CNCC1CCCOC1 7a_106832991635_100000741521 [1,0,0,0,0,0|3,0,0]=4 166 B9R1.8 CNCC1CCOCC1 2230a_100000746373_200000210301 [1,0,0,0,0,0|3,0,0]=4 167 B9R1.8 CNCC1CCOCC1 2230a_106832991635_100000754603 [1,0,0,0,0,0|3,0,0]=4 168 B9R1.8 CNCC1CCOCC1 269862a_106832991636_100000749017 [1,0,0,0,0,0|3,0,0]=4 169 B9R1.8 CNCC1CCOCC1 34a_100000746373_200000210301 [1,0,0,0,0,0|3,0,0]=4 170 B9R1.8 CNCC1CCOCC1 34a_100102657272_100000754603 [1,0,0,0,0,0|3,0,0]=4 171 B9R1.8 CNCC1CCOCC1 7a_106832991635_100000754603 [1,0,0,0,0,0|3,0,0]=4 172 B9R1.8 CNCC1CCSCC1 2230a_100015188806_200000210301 [1,0,0,0,0,0|3,0,0]=4 173 B9R1.8 CNCC1CCSCC1 269862a_106832991636_100000067145 [1,0,0,0,0,0|3,0,0]=4 174 B9R1.8 CNCC1CCSCC1 270004a_106832991635_100000067145 [1,0,0,0,0,0|3,0,0]=4 175 B9R1.8 CNCC1CCSCC1 34a_100015188806_200000210301 [1,0,0,0,0,0|3,0,0]=4 176 B9R1.8 COCC1CCCCC1 34a_100000212181_200000210301 [1,0,0,0,0,0|2,0,0]=3 177 B9R1.8 COCC1CCCCC1 34a_100138415774_100000211423 [1,0,0,0,0,0|2,0,0]=3 178 B9R1.8 COCC1CCCCC1 7a_100000212181_200000210301 [1,0,0,0,0,0|2,0,0]=3 179 B9R1.8 COCC1CCCCN1 34a_100000210821_200000210301 [1,0,0,0,0,0|3,0,0]=4 180 B9R1.8 COCC1CCCCO1 34a_100000211370_200000210301 [1,0,0,0,0,0|3,0,0]=4 181 B9R1.8 COCC1CCCCO1 34a_100138415774_100000211543 [1,0,0,0,0,0|3,0,0]=4 182 B9R1.8 COCC1CCCCO1 7a_100000211370_200000210301 [1,0,0,0,0,0|3,0,0]=4 183 B9R1.8 COCC1CCCNC1 34a_100000211344_200000210301 [1,0,0,0,0,0|3,0,0]=4 184 B9R1.8 COCC1CCCOC1 34a_100000741520_200000210301 [1,0,0,0,0,0|3,0,0]=4 185 B9R1.8 COCC1CCCOC1 34a_100138415774_100000741521 [1,0,0,0,0,0|3,0,0]=4 186 B9R1.8 COCC1CCNCC1 34a_100000738675_200000210301 [1,0,0,0,0,0|3,0,0]=4 187 B9R1.8 COCC1CCOCC1 34a_100000749013_200000210301 [1,0,0,0,0,0|3,0,0]=4 188 B9R1.8 COCC1CCOCC1 34a_100138415774_100000754603 [1,0,0,0,0,0|3,0,0]=4 189 B9R1.8 COCC1CCSCC1 34a_100000070558_200000210301 [1,0,0,0,0,0|3,0,0]=4 190 B9R1.8 COCC1CCSCC1 7a_100000070558_200000210301 [1,0,0,0,0,0|3,0,0]=4 191 B9R1.8 CSCC1CCCCC1 62a_100000211423_200000210301 [1,0,0,0,0,0|2,0,0]=3 192 B9R1.8 CSCC1CCCCC1 62a_200000210301_100000211423 [1,0,0,0,0,0|2,0,0]=3 193 B9R1.8 CSCC1CCCCO1 62a_100000211543_200000210301 [1,0,0,0,0,0|3,0,0]=4 194 B9R1.8 CSCC1CCCCO1 62a_200000210301_100000211543 [1,0,0,0,0,0|3,0,0]=4 195 B9R1.8 CSCC1CCCOC1 62a_100000741521_200000210301 [1,0,0,0,0,0|3,0,0]=4 196 B9R1.8 CSCC1CCCOC1 62a_200000210301_100000741521 [1,0,0,0,0,0|3,0,0]=4 197 B9R1.8 CSCC1CCOCC1 62a_100000754603_200000210301 [1,0,0,0,0,0|3,0,0]=4 198 B9R1.8 CSCC1CCOCC1 62a_200000210301_100000749018 [1,0,0,0,0,0|3,0,0]=4 199 B9R1.8 FCNC1CCCCC1 34a_100000182618_100015361967 [1,0,0,0,0,0|2,0,1]=4 200 B9R1.8 FCOC1CCCCC1 34a_100000210231_100015361967 [1,0,0,0,0,0|2,0,1]=4 201 B9R1.8 FCOC1CCCCC1 7a_100000210231_100015361967 [1,0,0,0,0,0|2,0,1]=4 202 B9R1.8 FCSC1CCCCC1 62a_100000210327_100015361967 [1,0,0,0,0,0|2,0,1]=4 203 B9R1.8 FCSC1CCCCC1 62a_100015361967_100000210327 [1,0,0,0,0,0|2,0,1]=4 204 B9R1.8 O=CCN1CC=CCC1 2230a_100000698166_200015260668 [1,0,0,0,0,0|1,0,2]=4 205 B9R1.8 O=CCN1CC=CCC1 269982a_100000698166_200015260668 [1,0,0,0,0,0|1,0,2]=4 206 B9R1.8 O=CCN1CC=CCC1 34a_100000698166_200009817547 [1,0,0,0,0,0|1,0,2]=4 207 B9R1.8 O=CCN1CCCOC1 2230a_100000131196_200015260668 [1,0,0,0,0,0|2,0,0]=3 208 B9R1.8 O=CCN1CCCOC1 269982a_100000131196_200015260668 [1,0,0,0,0,0|2,0,0]=3 209 B9R1.8 O=CCN1CCCOC1 34a_100000131196_200009817547 [1,0,0,0,0,0|2,0,0]=3 210 B9R1.8 O=CCN1CCOCC1 2230a_100015191051_200015260668 [1,0,0,0,0,0|2,0,0]=3 211 B9R1.8 O=CCN1CCOCC1 269982a_100015191051_200015260668 [1,0,0,0,0,0|2,0,0]=3 212 B9R1.8 O=CCN1CCOCC1 34a_100015191051_200009817547 [1,0,0,0,0,0|2,0,0]=3 213 B9R1.8 O=CCN1CCSCC1 2230a_100000737611_200015260668 [1,0,0,0,0,0|2,0,0]=3 214 B9R1.8 O=CCN1CCSCC1 269982a_100000737611_200015260668 [1,0,0,0,0,0|2,0,0]=3 215 B9R1.8 OCCN1CCCOC1 2230a_100000131196_100000211926 [1,0,0,0,0,0|2,0,1]=4 216 B9R1.8 OCCN1CCCOC1 269982a_100000131196_100000211926 [1,0,0,0,0,0|2,0,1]=4 217 B9R1.8 OCCN1CCCOC1 34a_100000131196_100000211926 [1,0,0,0,0,0|2,0,1]=4 218 B9R1.8 OCCN1CCOCC1 2230a_100015191051_100000211926 [1,0,0,0,0,0|2,0,1]=4 219 B9R1.8 OCCN1CCOCC1 269982a_100015191051_100000211926 [1,0,0,0,0,0|2,0,1]=4 220 B9R1.8 OCCN1CCOCC1 34a_100015191051_100000211926 [1,0,0,0,0,0|2,0,1]=4 221 B9R1.8 OCCN1CCSCC1 2230a_100000737611_100000211926 [1,0,0,0,0,0|2,0,1]=4 222 B9R1.8 OCCN1CCSCC1 269982a_100000737611_100000211926 [1,0,0,0,0,0|2,0,1]=4 223 B9R1.8 [13CH3]NCC1CCCCC1 2230a_100000210473_200025704644 [1,0,0,0,0,0|2,0,0]=3 224 B9R1.8 [13CH3]NCC1CCCCC1 34a_100000210473_200025704644 [1,0,0,0,0,0|2,0,0]=3 225 B9R1.8 [13CH3]NCC1CCCCO1 2230a_100000174945_200025704644 [1,0,0,0,0,0|3,0,0]=4 226 B9R1.8 [13CH3]NCC1CCCCO1 34a_100000174945_200025704644 [1,0,0,0,0,0|3,0,0]=4 227 B9R1.8 [13CH3]NCC1CCCOC1 2230a_100000720124_200025704644 [1,0,0,0,0,0|3,0,0]=4 228 B9R1.8 [13CH3]NCC1CCCOC1 34a_100000720124_200025704644 [1,0,0,0,0,0|3,0,0]=4 229 B9R1.8 [13CH3]NCC1CCOCC1 2230a_100000746373_200025704644 [1,0,0,0,0,0|3,0,0]=4 230 B9R1.8 [13CH3]NCC1CCOCC1 34a_100000746373_200025704644 [1,0,0,0,0,0|3,0,0]=4 231 B9R1.8 [13CH3]NCC1CCSCC1 2230a_100015188806_200025704644 [1,0,0,0,0,0|3,0,0]=4 232 B9R1.8 [13CH3]NCC1CCSCC1 34a_100015188806_200025704644 [1,0,0,0,0,0|3,0,0]=4 233 B9R1.8 [13CH3]OCC1CCCCC1 34a_100000212181_200025704644 [1,0,0,0,0,0|2,0,0]=3 234 B9R1.8 [13CH3]OCC1CCCCC1 7a_100000212181_200025704644 [1,0,0,0,0,0|2,0,0]=3 235 B9R1.8 [13CH3]OCC1CCCCN1 34a_100000210821_200025704644 [1,0,0,0,0,0|3,0,0]=4 236 B9R1.8 [13CH3]OCC1CCCCO1 34a_100000211370_200025704644 [1,0,0,0,0,0|3,0,0]=4 237 B9R1.8 [13CH3]OCC1CCCCO1 7a_100000211370_200025704644 [1,0,0,0,0,0|3,0,0]=4 238 B9R1.8 [13CH3]OCC1CCCNC1 34a_100000211344_200025704644 [1,0,0,0,0,0|3,0,0]=4 239 B9R1.8 [13CH3]OCC1CCCOC1 34a_100000741520_200025704644 [1,0,0,0,0,0|3,0,0]=4 240 B9R1.8 [13CH3]OCC1CCNCC1 34a_100000738675_200025704644 [1,0,0,0,0,0|3,0,0]=4 241 B9R1.8 [13CH3]OCC1CCOCC1 34a_100000749013_200025704644 [1,0,0,0,0,0|3,0,0]=4 242 B9R1.8 [13CH3]OCC1CCSCC1 34a_100000070558_200025704644 [1,0,0,0,0,0|3,0,0]=4 243 B9R1.8 [13CH3]OCC1CCSCC1 7a_100000070558_200025704644 [1,0,0,0,0,0|3,0,0]=4 244 B9R1.8 [13CH3]SCC1CCCCC1 62a_100000211423_200025704644 [1,0,0,0,0,0|2,0,0]=3 245 B9R1.8 [13CH3]SCC1CCCCC1 62a_200025704644_100000211423 [1,0,0,0,0,0|2,0,0]=3 246 B9R1.8 [13CH3]SCC1CCCCO1 62a_100000211543_200025704644 [1,0,0,0,0,0|3,0,0]=4 247 B9R1.8 [13CH3]SCC1CCCCO1 62a_200025704644_100000211543 [1,0,0,0,0,0|3,0,0]=4 248 B9R1.8 [13CH3]SCC1CCCOC1 62a_100000741521_200025704644 [1,0,0,0,0,0|3,0,0]=4 249 B9R1.8 [13CH3]SCC1CCCOC1 62a_200025704644_100000741521 [1,0,0,0,0,0|3,0,0]=4 250 B9R1.8 [13CH3]SCC1CCOCC1 62a_100000754603_200025704644 [1,0,0,0,0,0|3,0,0]=4 251 B9R1.8 [13CH3]SCC1CCOCC1 62a_200025704644_100000749018 [1,0,0,0,0,0|3,0,0]=4 252 B11R1.20 C=C(C)CN1CCC(CC1)C 2230a_100000188429_100000748629 [0,1,0,0,0,0|3,0,0]=4 253 B11R1.20 C=C(C)CN1CCC(CC1)C 269982a_100000188429_100000748629 [0,1,0,0,0,0|3,0,0]=4 254 B11R1.20 C=C(C)CN1CCC(CC1)C 34a_100000188429_100000748629 [0,1,0,0,0,0|3,0,0]=4 255 B11R1.20 C=C(C)CN1CCC(CC1)F 2230a_100015193889_100000748629 [0,1,0,0,0,0|3,0,0]=4 256 B11R1.20 C=C(C)CN1CCC(CC1)F 269982a_100015193889_100000748629 [0,1,0,0,0,0|3,0,0]=4 257 B11R1.20 C=C(C)CN1CCC(CC1)F 34a_100015193889_100000748629 [0,1,0,0,0,0|3,0,0]=4 258 B11R1.20 C=C(C)CN1CCC(CC1)O 2230a_100025773856_100000748629 [0,1,0,0,0,0|3,0,0]=4 259 B11R1.20 C=C(C)CN1CCC(CC1)O 269982a_100025773856_100000748629 [0,1,0,0,0,0|3,0,0]=4 260 B11R1.20 C=C(F)CN1CCC(CC1)C 2230a_100000188429_100009893438 [0,1,0,0,0,0|3,0,0]=4 261 B11R1.20 C=C(F)CN1CCC(CC1)C 269982a_100000188429_100009893438 [0,1,0,0,0,0|3,0,0]=4 262 B11R1.20 C=C(F)CN1CCC(CC1)C 34a_100000188429_100009893438 [0,1,0,0,0,0|3,0,0]=4 263 B11R1.20 C=C(F)CN1CCC(CC1)F 2230a_100015193889_100009893438 [0,1,0,0,0,0|3,0,0]=4 264 B11R1.20 C=C(F)CN1CCC(CC1)F 269982a_100015193889_100009893438 [0,1,0,0,0,0|3,0,0]=4 265 B11R1.20 C=C(F)CN1CCC(CC1)F 34a_100015193889_100009893438 [0,1,0,0,0,0|3,0,0]=4 266 B11R1.20 C=C(F)CN1CCC(CC1)O 2230a_100025773856_100009893438 [0,1,0,0,0,0|3,0,0]=4 267 B11R1.20 C=C(F)CN1CCC(CC1)O 269982a_100025773856_100009893438 [0,1,0,0,0,0|3,0,0]=4 268 B11R1.20 C=C1CCN(CC1)CC(=O)N 2230a_100000752442_100000747473 [0,1,0,0,0,0|2,0,1]=4 269 B11R1.20 C=C1CCN(CC1)CC(=O)N 269982a_100000752442_100000187820 [0,1,0,0,0,0|2,0,1]=4 270 B11R1.20 C=C1CCN(CC1)CC(=O)N 34a_100000752442_100000187820 [0,1,0,0,0,0|2,0,1]=4 271 B11R1.20 C=C1CCN(CC1)CC(=O)[O-] 269982a_100000752442_100020667443 [0,1,0,0,0,0|1,0,2]=4 272 B11R1.20 C=C1CCN(CC1)CC(=O)[O-] 34a_100000752442_100020667443 [0,1,0,0,0,0|1,0,2]=4 273 B11R1.20 CC(=O)C=C1CCC(CC1)C 1458a_100000756110_200000210301 [0,1,0,0,0,0|1,0,2]=4 274 B11R1.20 CC(=O)CC1CCC(CC1)C 1458a_100011215564_200000210301 [0,1,0,0,0,0|1,0,0]=2 275 B11R1.20 CC(=O)CC1CCC(CC1)O 1458a_100012184027_200000210301 [0,1,0,0,0,0|1,0,0]=2 276 B11R1.20 CC(=O)CC1CCN(CC1)C 1458a_100000700355_200000210301 [0,1,0,0,0,0|2,0,0]=3 277 B11R1.20 CC(=O)CN1CCC(CC1)C 1458a_100000238061_200000210301 [0,1,0,0,0,0|2,0,0]=3 278 B11R1.20 CC(=O)CN1CCN(CC1)C 1458a_100000753313_200000210301 [0,1,0,0,0,0|3,0,0]=4 279 B11R1.20 CC(=O)NC1CCN(CC1)C 11a_100000198570_100015343762 [0,1,0,0,0,0|3,0,0]=4 280 B11R1.20 CC(=O)NC1CCN(CC1)C 2230a_100000747453_200000210301 [0,1,0,0,0,0|3,0,0]=4 281 B11R1.20 CC(=O)NC1CCN(CC1)C 240690a_100000198570_100015343762 [0,1,0,0,0,0|3,0,0]=4 282 B11R1.20 CC(=O)NC1CCN(CC1)C 269982a_100000747453_200000210301 [0,1,0,0,0,0|3,0,0]=4 283 B11R1.20 CC(=O)NC1CCN(CC1)C 527a_100000198570_100103153847 [0,1,0,0,0,0|3,0,0]=4 284 B11R1.20 CC(=O)NC1CCN(CC1)[13CH3] 2230a_100000747453_200025704644 [0,1,0,0,0,0|3,0,0]=4 285 B11R1.20 CC(=O)NC1CCN(CC1)[13CH3] 269982a_100000747453_200025704644 [0,1,0,0,0,0|3,0,0]=4 286 B11R1.20 CC(=O)N[C@H]1CC[C@@H](CC1)C 1626a_100020625639_100015343762 [0,1,0,0,0,0|2,0,0]=3 287 B11R1.20 CC(=O)N[C@H]1CC[C@@H](CC1)C 240690a_100020625639_100015343762 [0,1,0,0,0,0|2,0,0]=3 288 B11R1.20 CC(=O)N[C@H]1CC[C@@H](CC1)C 527a_100020625639_100103153847 [0,1,0,0,0,0|2,0,0]=3 289 B11R1.20 CC(=O)N[C@H]1CC[C@H](CC1)O 1626a_100020628982_100015343762 [0,1,0,0,0,0|2,0,0]=3 290 B11R1.20 CC(=O)N[C@H]1CC[C@H](CC1)O 240690a_100020628982_100015343762 [0,1,0,0,0,0|2,0,0]=3 291 B11R1.20 CC(O)CN1CCC(CC1)C 2230a_100000188429_100011218427 [0,1,0,0,0,0|2,0,1]=4 292 B11R1.20 CC(O)CN1CCC(CC1)C 269982a_100000188429_100011218427 [0,1,0,0,0,0|2,0,1]=4 293 B11R1.20 CC(O)CN1CCC(CC1)C 34a_100000188429_100011218427 [0,1,0,0,0,0|2,0,1]=4 294 B11R1.20 CC(O)CN1CCC(CC1)F 2230a_100015193889_100011218427 [0,1,0,0,0,0|2,0,1]=4 295 B11R1.20 CC(O)CN1CCC(CC1)F 269982a_100015193889_100011218427 [0,1,0,0,0,0|2,0,1]=4 296 B11R1.20 CC(O)CN1CCC(CC1)F 34a_100015193889_100011218427 [0,1,0,0,0,0|2,0,1]=4 297 B11R1.20 CC(O)CN1CCC(CC1)O 2230a_100025773856_100011218427 [0,1,0,0,0,0|2,0,1]=4 298 B11R1.20 CC(O)CN1CCC(CC1)O 269982a_100025773856_100011218427 [0,1,0,0,0,0|2,0,1]=4 299 B11R1.20 CC1CCC(=CC(=O)[13CH3])CC1 1458a_100000756110_200025704644 [0,1,0,0,0,0|1,0,2]=4 300 B11R1.20 CC1CCC(CC1)CC(=O)[13CH3] 1458a_100011215564_200025704644 [0,1,0,0,0,0|1,0,0]=2 301 B11R1.20 CC1CCN(CC1)CC(=O)N 2230a_100000188429_100000747473 [0,1,0,0,0,0|2,0,0]=3 302 B11R1.20 CC1CCN(CC1)CC(=O)N 269982a_100000188429_100000187820 [0,1,0,0,0,0|2,0,0]=3 303 B11R1.20 CC1CCN(CC1)CC(=O)N 34a_100000188429_100000187820 [0,1,0,0,0,0|2,0,0]=3 304 B11R1.20 CC1CCN(CC1)CC(=O)[13CH3] 1458a_100000238061_200025704644 [0,1,0,0,0,0|2,0,0]=3 305 B11R1.20 CC1CCN(CC1)CC(=O)[O-] 269982a_100000188429_100020667443 [0,1,0,0,0,0|1,0,1]=3 306 B11R1.20 CC1CCN(CC1)CC(=O)[O-] 34a_100000188429_100020667443 [0,1,0,0,0,0|1,0,1]=3 307 B11R1.20 CC1CCN(CC1)C[C@@H](C)O 2230a_100000188429_100009817552 [0,1,0,0,0,0|2,0,1]=4 308 B11R1.20 CC1CCN(CC1)C[C@@H](C)O 269982a_100000188429_100009817552 [0,1,0,0,0,0|2,0,1]=4 309 B11R1.20 CC1CCN(CC1)C[C@@H](C)O 34a_100000188429_100009817552 [0,1,0,0,0,0|2,0,1]=4 310 B11R1.20 CC1CCN(CC1)C[N+](=O)[O-] 269982a_100000188429_100000761209 [0,1,0,0,0,0|2,0,1]=4 311 B11R1.20 CC1CCN(CC1)C[N+](=O)[O-] 34a_100000188429_100000761209 [0,1,0,0,0,0|2,0,1]=4 312 B11R1.20 CN1CCC(CC1)CC(=O)N 2230a_100011221598_200000210301 [0,1,0,0,0,0|2,0,0]=3 313 B11R1.20 CN1CCC(CC1)CC(=O)N 34a_100011221598_200000210301 [0,1,0,0,0,0|2,0,0]=3 314 B11R1.20 CN1CCC(CC1)CC(=O)[13CH3] 1458a_100000700355_200025704644 [0,1,0,0,0,0|2,0,0]=3 315 B11R1.20 CN1CCC(CC1)NC(=O)N 2230a_100000751166_200000210301 [0,1,0,0,0,0|3,0,0]=4 316 B11R1.20 CN1CCN(CC1)CC(=O)N 2230a_100000188432_100000747473 [0,1,0,0,0,0|3,0,0]=4 317 B11R1.20 CN1CCN(CC1)CC(=O)N 2230a_100000688366_200000210301 [0,1,0,0,0,0|3,0,0]=4 318 B11R1.20 CN1CCN(CC1)CC(=O)N 269982a_100000188432_100000187820 [0,1,0,0,0,0|3,0,0]=4 319 B11R1.20 CN1CCN(CC1)CC(=O)N 269982a_100000688366_200000210301 [0,1,0,0,0,0|3,0,0]=4 320 B11R1.20 CN1CCN(CC1)CC(=O)[13CH3] 1458a_100000753313_200025704644 [0,1,0,0,0,0|3,0,0]=4 321 B11R1.20 CN1CCN(CC1)CC(=O)[O-] 269982a_100000188432_100020667443 [0,1,0,0,0,0|2,0,1]=4 322 B11R1.20 C[C@@H](O)CN1CCC(CC1)F 2230a_100015193889_100009817552 [0,1,0,0,0,0|2,0,1]=4 323 B11R1.20 C[C@@H](O)CN1CCC(CC1)F 269982a_100015193889_100009817552 [0,1,0,0,0,0|2,0,1]=4 324 B11R1.20 C[C@@H](O)CN1CCC(CC1)F 34a_100015193889_100009817552 [0,1,0,0,0,0|2,0,1]=4 325 B11R1.20 C[C@@H](O)CN1CCC(CC1)O 2230a_100025773856_100009817552 [0,1,0,0,0,0|2,0,1]=4 326 B11R1.20 C[C@@H](O)CN1CCC(CC1)O 269982a_100025773856_100009817552 [0,1,0,0,0,0|2,0,1]=4 327 B11R1.20 NC(=O)CN1CCC(CC1)F 2230a_100015193889_100000747473 [0,1,0,0,0,0|2,0,0]=3 328 B11R1.20 NC(=O)CN1CCC(CC1)F 269982a_100015193889_100000187820 [0,1,0,0,0,0|2,0,0]=3 329 B11R1.20 NC(=O)CN1CCC(CC1)F 34a_100015193889_100000187820 [0,1,0,0,0,0|2,0,0]=3 330 B11R1.20 NC(=O)CN1CCC(CC1)O 2230a_100025773856_100000747473 [0,1,0,0,0,0|2,0,0]=3 331 B11R1.20 NC(=O)CN1CCC(CC1)O 269982a_100025773856_100000187820 [0,1,0,0,0,0|2,0,0]=3 332 B11R1.20 NC(=O)CN1CCS(=O)CC1 2230a_100000752083_100000747473 [0,1,0,0,0,0|3,0,0]=4 333 B11R1.20 NC(=O)CN1CCS(=O)CC1 269982a_100000752083_100000187820 [0,1,0,0,0,0|3,0,0]=4 334 B11R1.20 O=C([O-])CN1CCC(CC1)F 269982a_100015193889_100020667443 [0,1,0,0,0,0|1,0,1]=3 335 B11R1.20 O=C([O-])CN1CCC(CC1)F 34a_100015193889_100020667443 [0,1,0,0,0,0|1,0,1]=3 336 B11R1.20 O=C([O-])CN1CCC(CC1)O 269982a_100025773856_100020667443 [0,1,0,0,0,0|1,0,1]=3 337 B11R1.20 O=C([O-])CN1CCS(=O)CC1 269982a_100000752083_100020667443 [0,1,0,0,0,0|2,0,1]=4 338 B11R1.20 O=[N+]([O-])CN1CCC(CC1)F 269982a_100015193889_100000761209 [0,1,0,0,0,0|2,0,1]=4 339 B11R1.20 O=[N+]([O-])CN1CCC(CC1)F 34a_100015193889_100000761209 [0,1,0,0,0,0|2,0,1]=4 340 B11R1.20 O=[N+]([O-])CN1CCC(CC1)O 269982a_100025773856_100000761209 [0,1,0,0,0,0|2,0,1]=4 341 B11R1.20 [13CH3]C(=O)CC1CCC(CC1)O 1458a_100012184027_200025704644 [0,1,0,0,0,0|1,0,0]=2 342 B11R1.20 [13CH3]N1CCC(CC1)CC(=O)N 2230a_100011221598_200025704644 [0,1,0,0,0,0|2,0,0]=3 343 B11R1.20 [13CH3]N1CCC(CC1)CC(=O)N 34a_100011221598_200025704644 [0,1,0,0,0,0|2,0,0]=3 344 B11R1.20 [13CH3]N1CCC(CC1)NC(=O)N 2230a_100000751166_200025704644 [0,1,0,0,0,0|3,0,0]=4 345 B11R1.20 [13CH3]N1CCN(CC1)CC(=O)N 2230a_100000688366_200025704644 [0,1,0,0,0,0|3,0,0]=4 346 B11R1.20 [13CH3]N1CCN(CC1)CC(=O)N 269982a_100000688366_200025704644 [0,1,0,0,0,0|3,0,0]=4 347 B11R1.36 C=C(C)C(=O)C1CCCCC1 1458a_100000185857_100000210327 [0,1,0,0,0,0|2,0,1]=4 348 B11R1.36 CC(=O)C(=O)N1CCCCC1 1458a_200011297168_200000210301 [0,1,0,0,0,0|2,0,1]=4 349 B11R1.36 CC(=O)C(C)C1CCCCC1 1458a_100011435303_200000210301 [0,1,0,0,0,0|1,0,0]=2 350 B11R1.36 CC(=O)C(C)N1CCCOC1 2230a_100000131196_100009814033 [0,1,0,0,0,0|3,0,0]=4 351 B11R1.36 CC(=O)C(C)N1CCCOC1 269982a_100000131196_100009814033 [0,1,0,0,0,0|3,0,0]=4 352 B11R1.36 CC(=O)C(C)N1CCOCC1 2230a_100015191051_100009814033 [0,1,0,0,0,0|3,0,0]=4 353 B11R1.36 CC(=O)C(C)N1CCOCC1 269982a_100015191051_100009814033 [0,1,0,0,0,0|3,0,0]=4 354 B11R1.36 CC(=O)C(C)N1CCSCC1 2230a_100000737611_100009814033 [0,1,0,0,0,0|3,0,0]=4 355 B11R1.36 CC(=O)C(C)N1CCSCC1 269982a_100000737611_100009814033 [0,1,0,0,0,0|3,0,0]=4 356 B11R1.36 CC(=O)C(O)C1CCCCC1 1458a_100000242593_200000210301 [0,1,0,0,0,0|1,0,0]=2 357 B11R1.36 CC(=O)N(C)C1CCCCC1 11a_100000207522_100015343762 [0,1,0,0,0,0|2,0,0]=3 358 B11R1.36 CC(=O)N(C)C1CCCCC1 1626a_100000207522_100015343762 [0,1,0,0,0,0|2,0,0]=3 359 B11R1.36 CC(=O)N(C)C1CCCCC1 240690a_100000207522_100015343762 [0,1,0,0,0,0|2,0,0]=3 360 B11R1.36 CC(=O)N(C)C1CCCCC1 527a_100000207522_100103153847 [0,1,0,0,0,0|2,0,0]=3 361 B11R1.36 CC(=O)N(C)C1CCOCC1 11a_100020587155_100015343762 [0,1,0,0,0,0|3,0,0]=4 362 B11R1.36 CC(=O)N(C)C1CCOCC1 1626a_100020587155_100015343762 [0,1,0,0,0,0|3,0,0]=4 363 B11R1.36 CC(=O)N(C)C1CCOCC1 240690a_100020587155_100015343762 [0,1,0,0,0,0|3,0,0]=4 364 B11R1.36 CC(=O)N(C)C1CCOCC1 527a_100020587155_100103153847 [0,1,0,0,0,0|3,0,0]=4 365 B11R1.36 CC(=O)N(C)C1CCSCC1 11a_100015184757_100015343762 [0,1,0,0,0,0|3,0,0]=4 366 B11R1.36 CC(=O)N(C)C1CCSCC1 240690a_100015184757_100015343762 [0,1,0,0,0,0|3,0,0]=4 367 B11R1.36 CC(=O)N(C)C1CCSCC1 527a_100015184757_100103153847 [0,1,0,0,0,0|3,0,0]=4 368 B11R1.36 CC(=O)[C@H](C)N1CCOCC1 1458a_100000729938_200000210301 [0,1,0,0,0,0|3,0,0]=4 369 B11R1.36 CC(C(=O)N)N1CCCOC1 2230a_100000131196_100000702099 [0,1,0,0,0,0|3,0,0]=4 370 B11R1.36 CC(C(=O)N)N1CCCOC1 269982a_100000131196_100000184083 [0,1,0,0,0,0|3,0,0]=4 371 B11R1.36 CC(C(=O)N)N1CCCOC1 34a_100000131196_100000702099 [0,1,0,0,0,0|3,0,0]=4 372 B11R1.36 CC(C(=O)N)N1CCOCC1 2230a_100015191051_100000702099 [0,1,0,0,0,0|3,0,0]=4 373 B11R1.36 CC(C(=O)N)N1CCOCC1 269982a_100015191051_100000184083 [0,1,0,0,0,0|3,0,0]=4 374 B11R1.36 CC(C(=O)N)N1CCOCC1 34a_100015191051_100000702099 [0,1,0,0,0,0|3,0,0]=4 375 B11R1.36 CC(C(=O)N)N1CCSCC1 2230a_100000737611_100000702099 [0,1,0,0,0,0|3,0,0]=4 376 B11R1.36 CC(C(=O)N)N1CCSCC1 269982a_100000737611_100000184083 [0,1,0,0,0,0|3,0,0]=4 377 B11R1.36 CC(C(=O)[13CH3])C1CCCCC1 1458a_100011435303_200025704644 [0,1,0,0,0,0|1,0,0]=2 378 B11R1.36 C[C@@H](C(=O)[13CH3])N1CCOCC1 1458a_100000729938_200025704644 [0,1,0,0,0,0|3,0,0]=4 379 B11R1.36 C[C@@H](O)C(=O)C1CCCCC1 1458a_100000717761_100000210327 [0,1,0,0,0,0|1,0,2]=4 380 B11R1.36 C[C@H](O)C(=O)C1CCCCC1 1458a_217856618621_100000210327 [0,1,0,0,0,0|1,0,2]=4 381 B11R1.36 NC(=O)C(F)N1CCCOC1 2230a_100000131196_100009813875 [0,1,0,0,0,0|3,0,0]=4 382 B11R1.36 NC(=O)C(F)N1CCCOC1 269982a_100000131196_100009813875 [0,1,0,0,0,0|3,0,0]=4 383 B11R1.36 NC(=O)C(F)N1CCCOC1 34a_100000131196_100009813875 [0,1,0,0,0,0|3,0,0]=4 384 B11R1.36 NC(=O)C(F)N1CCOCC1 2230a_100015191051_100009813875 [0,1,0,0,0,0|3,0,0]=4 385 B11R1.36 NC(=O)C(F)N1CCOCC1 269982a_100015191051_100009813875 [0,1,0,0,0,0|3,0,0]=4 386 B11R1.36 NC(=O)C(F)N1CCOCC1 34a_100015191051_100009813875 [0,1,0,0,0,0|3,0,0]=4 387 B11R1.36 NC(=O)C(F)N1CCSCC1 2230a_100000737611_100009813875 [0,1,0,0,0,0|3,0,0]=4 388 B11R1.36 NC(=O)C(F)N1CCSCC1 269982a_100000737611_100009813875 [0,1,0,0,0,0|3,0,0]=4 389 B11R1.36 O=C(C(O)O)C1CCCCC1 1458a_100000233687_100000210327 [0,1,0,0,0,0|0,0,3]=4 390 B11R1.36 O=C([O-])C(F)N1CCCOC1 34a_100000131196_100020610796 [0,1,0,0,0,0|2,0,1]=4 391 B11R1.36 O=C([O-])C(F)N1CCOCC1 34a_100015191051_100020610796 [0,1,0,0,0,0|2,0,1]=4 392 B11R1.36 [13CH3]C(=O)C(=O)N1CCCCC1 1458a_200011297168_200025704644 [0,1,0,0,0,0|2,0,1]=4 393 B11R1.36 [13CH3]C(=O)C(O)C1CCCCC1 1458a_100000242593_200025704644 [0,1,0,0,0,0|1,0,0]=2 394 B11R1.40 C#CC(=O)CC1CCCCC1 1458a_100000211873_100000211423 [0,1,0,0,0,0|1,0,0]=2 395 B11R1.40 C#CC(=O)CC1CCCCO1 1458a_100000211873_100000211543 [0,1,0,0,0,0|2,0,0]=3 396 B11R1.40 C#CC(=O)CC1CCCOC1 1458a_100000211873_100000741521 [0,1,0,0,0,0|2,0,0]=3 397 B11R1.40 C#CC(=O)CC1CCOCC1 1458a_100000211873_100000754603 [0,1,0,0,0,0|2,0,0]=3 398 B11R1.40 C=CC(=O)CC1CCCCC1 1458a_100000185746_100000211423 [0,1,0,0,0,0|1,0,0]=2 399 B11R1.40 C=CC(=O)CC1CCCCO1 1458a_100000185746_100000211543 [0,1,0,0,0,0|2,0,0]=3 400 B11R1.40 C=CC(=O)CC1CCCOC1 1458a_100000185746_100000741521 [0,1,0,0,0,0|2,0,0]=3 401 B11R1.40 C=CC(=O)CC1CCOCC1 1458a_100000185746_100000754603 [0,1,0,0,0,0|2,0,0]=3 402 B11R1.40 C=CC(=O)NC1CCCCC1 1626a_100000182618_100000185746 [0,1,0,0,0,0|2,0,0]=3 403 B11R1.40 C=CC(=O)NC1CCCCC1 240690a_100000182618_200121576911 [0,1,0,0,0,0|2,0,0]=3 404 B11R1.40 C=CC(=O)NC1CCCOC1 1626a_100000719290_100000185746 [0,1,0,0,0,0|3,0,0]=4 405 B11R1.40 C=CC(=O)NC1CCCOC1 240690a_100000719290_200121576911 [0,1,0,0,0,0|3,0,0]=4 406 B11R1.40 C=CC(=O)NC1CCOCC1 1626a_100000741149_100000185746 [0,1,0,0,0,0|3,0,0]=4 407 B11R1.40 C=CC(=O)NC1CCOCC1 240690a_100000741149_200121576911 [0,1,0,0,0,0|3,0,0]=4 408 B11R1.40 C=CC(=O)NC1CCSCC1 1626a_100000748639_100000185746 [0,1,0,0,0,0|3,0,0]=4 409 B11R1.40 C=CC(=O)NC1CCSCC1 240690a_100000748639_200121576911 [0,1,0,0,0,0|3,0,0]=4 410 B11R1.40 CC(CO)NC1CCCCC1 2230a_100000182618_100012180447 [0,1,0,0,0,0|2,0,1]=4 411 B11R1.40 CC(CO)NC1CCCCC1 34a_100000182618_100012180447 [0,1,0,0,0,0|2,0,1]=4 412 B11R1.40 CC(CO)OC1CCCCC1 34a_100000210231_100012180447 [0,1,0,0,0,0|2,0,1]=4 413 B11R1.40 CC(CO)OC1CCCCC1 7a_100000210231_100012180447 [0,1,0,0,0,0|2,0,1]=4 414 B11R1.40 CC(CO)SC1CCCCC1 62a_100012180447_100000210327 [0,1,0,0,0,0|2,0,1]=4 415 B11R1.40 CCC(=O)C=C1CCCCC1 1458a_100000743792_100000210202 [0,1,0,0,0,0|1,0,2]=4 416 B11R1.40 CCC(=O)CC1=CCCCC1 1458a_100000039269_100000210202 [0,1,0,0,0,0|1,0,2]=4 417 B11R1.40 CCC(=O)CC1CCCCC1 1458a_100000210414_100000211423 [0,1,0,0,0,0|1,0,0]=2 418 B11R1.40 CCC(=O)CC1CCCCC1 1458a_100000211666_100000210202 [0,1,0,0,0,0|1,0,0]=2 419 B11R1.40 CCC(=O)CC1CCCCO1 1458a_100000210414_100000211543 [0,1,0,0,0,0|2,0,0]=3 420 B11R1.40 CCC(=O)CC1CCCCO1 1458a_100000238585_100000210202 [0,1,0,0,0,0|2,0,0]=3 421 B11R1.40 CCC(=O)CC1CCCOC1 1458a_100000210414_100000741521 [0,1,0,0,0,0|2,0,0]=3 422 B11R1.40 CCC(=O)CC1CCCOC1 1458a_100000741523_100000210202 [0,1,0,0,0,0|2,0,0]=3 423 B11R1.40 CCC(=O)CC1CCOCC1 1458a_100000210414_100000754603 [0,1,0,0,0,0|2,0,0]=3 424 B11R1.40 CCC(=O)CC1CCOCC1 1458a_100000757261_100000210202 [0,1,0,0,0,0|2,0,0]=3 425 B11R1.40 CCC(=O)CN1CCCCC1 1458a_100000740322_100000210202 [0,1,0,0,0,0|2,0,0]=3 426 B11R1.40 CCC(=O)CN1CCCOC1 269982a_100000131196_100000747405 [0,1,0,0,0,0|3,0,0]=4 427 B11R1.40 CCC(=O)CN1CCOCC1 1458a_100000740321_100000210202 [0,1,0,0,0,0|3,0,0]=4 428 B11R1.40 CCC(=O)CN1CCOCC1 269982a_100015191051_100000747405 [0,1,0,0,0,0|3,0,0]=4 429 B11R1.40 CCC(=O)CN1CCSCC1 269982a_100000737611_100000747405 [0,1,0,0,0,0|3,0,0]=4 430 B11R1.40 CCC(=O)NC1CCCCC1 11a_100000182618_100000210414 [0,1,0,0,0,0|2,0,0]=3 431 B11R1.40 CCC(=O)NC1CCCCC1 1626a_100000182618_100000210414 [0,1,0,0,0,0|2,0,0]=3 432 B11R1.40 CCC(=O)NC1CCCCC1 240690a_100000182618_100000210414 [0,1,0,0,0,0|2,0,0]=3 433 B11R1.40 CCC(=O)NC1CCCCC1 527a_100000182618_100000210414 [0,1,0,0,0,0|2,0,0]=3 434 B11R1.40 CCC(=O)NC1CCCOC1 11a_100000719290_100000210414 [0,1,0,0,0,0|3,0,0]=4 435 B11R1.40 CCC(=O)NC1CCCOC1 1626a_100000719290_100000210414 [0,1,0,0,0,0|3,0,0]=4 436 B11R1.40 CCC(=O)NC1CCCOC1 240690a_100000719290_100000210414 [0,1,0,0,0,0|3,0,0]=4 437 B11R1.40 CCC(=O)NC1CCCOC1 527a_100000719290_100000210414 [0,1,0,0,0,0|3,0,0]=4 438 B11R1.40 CCC(=O)NC1CCOCC1 11a_100000741149_100000210414 [0,1,0,0,0,0|3,0,0]=4 439 B11R1.40 CCC(=O)NC1CCOCC1 1626a_100000741149_100000210414 [0,1,0,0,0,0|3,0,0]=4 440 B11R1.40 CCC(=O)NC1CCOCC1 240690a_100000741149_100000210414 [0,1,0,0,0,0|3,0,0]=4 441 B11R1.40 CCC(=O)NC1CCOCC1 527a_100000741149_100000210414 [0,1,0,0,0,0|3,0,0]=4 442 B11R1.40 CCC(=O)NC1CCSCC1 11a_100000748639_100000210414 [0,1,0,0,0,0|3,0,0]=4 443 B11R1.40 CCC(=O)NC1CCSCC1 1626a_100000748639_100000210414 [0,1,0,0,0,0|3,0,0]=4 444 B11R1.40 CCC(=O)NC1CCSCC1 240690a_100000748639_100000210414 [0,1,0,0,0,0|3,0,0]=4 445 B11R1.40 CCC(=O)NC1CCSCC1 527a_100000748639_100000210414 [0,1,0,0,0,0|3,0,0]=4 446 B11R1.40 CCN(C)CC1CCCCC1 2230a_100000225621_100000211423 [0,1,0,0,0,0|3,0,0]=4 447 B11R1.40 CCN(C)CC1CCCCC1 2230a_100000736448_100000210202 [0,1,0,0,0,0|3,0,0]=4 448 B11R1.40 CCN(C)CC1CCCCC1 269982a_100000225621_100000211423 [0,1,0,0,0,0|3,0,0]=4 449 B11R1.40 CCN(C)CC1CCCCC1 269982a_100000736448_100000204670 [0,1,0,0,0,0|3,0,0]=4 450 B11R1.40 CCN(C)CC1CCCCC1 34a_100000736448_100000210202 [0,1,0,0,0,0|3,0,0]=4 451 B11R1.40 CN(CF)CC1CCCCC1 269982a_100000736448_100015361967 [0,1,0,0,0,0|3,0,0]=4 452 B11R1.40 CN(CF)CC1CCCCC1 34a_100000736448_100015361967 [0,1,0,0,0,0|3,0,0]=4 453 B11R1.40 CNC(=O)C=C1CCCCC1 11a_106832991635_100000743792 [0,1,0,0,0,0|1,0,2]=4 454 B11R1.40 CNC(=O)C=C1CCCCC1 1626a_100102657272_100000743792 [0,1,0,0,0,0|1,0,2]=4 455 B11R1.40 CNC(=O)C=C1CCCCC1 240690a_100102657272_100000743792 [0,1,0,0,0,0|1,0,2]=4 456 B11R1.40 CNC(=O)CC1=CCCCC1 11a_106832991635_100000039269 [0,1,0,0,0,0|1,0,2]=4 457 B11R1.40 CNC(=O)CC1=CCCCC1 1626a_100102657272_100000039269 [0,1,0,0,0,0|1,0,2]=4 458 B11R1.40 CNC(=O)CC1=CCCCC1 240690a_100102657272_100000039269 [0,1,0,0,0,0|1,0,2]=4 459 B11R1.40 CNC(=O)CC1=CCCCC1 527a_100102657272_100000039269 [0,1,0,0,0,0|1,0,2]=4 460 B11R1.40 CNC(=O)CC1CCCCC1 11a_106832991635_100000211666 [0,1,0,0,0,0|1,0,0]=2 461 B11R1.40 CNC(=O)CC1CCCCC1 1626a_100102657272_100000211666 [0,1,0,0,0,0|1,0,0]=2 462 B11R1.40 CNC(=O)CC1CCCCC1 240690a_100102657272_100000211666 [0,1,0,0,0,0|1,0,0]=2 463 B11R1.40 CNC(=O)CC1CCCCC1 527a_100102657272_100000211666 [0,1,0,0,0,0|1,0,0]=2 464 B11R1.40 CNC(=O)CC1CCCCO1 11a_106832991635_100000238585 [0,1,0,0,0,0|2,0,0]=3 465 B11R1.40 CNC(=O)CC1CCCCO1 1626a_100102657272_100000238585 [0,1,0,0,0,0|2,0,0]=3 466 B11R1.40 CNC(=O)CC1CCCCO1 240690a_100102657272_100000238585 [0,1,0,0,0,0|2,0,0]=3 467 B11R1.40 CNC(=O)CC1CCCCO1 527a_100102657272_100000238585 [0,1,0,0,0,0|2,0,0]=3 468 B11R1.40 CNC(=O)CC1CCCOC1 11a_106832991635_100000741523 [0,1,0,0,0,0|2,0,0]=3 469 B11R1.40 CNC(=O)CC1CCCOC1 1626a_100102657272_100000741523 [0,1,0,0,0,0|2,0,0]=3 470 B11R1.40 CNC(=O)CC1CCCOC1 240690a_100102657272_100000741523 [0,1,0,0,0,0|2,0,0]=3 471 B11R1.40 CNC(=O)CC1CCCOC1 527a_100102657272_100000741523 [0,1,0,0,0,0|2,0,0]=3 472 B11R1.40 CNC(=O)CC1CCOCC1 11a_106832991635_100000757261 [0,1,0,0,0,0|2,0,0]=3 473 B11R1.40 CNC(=O)CC1CCOCC1 1626a_100102657272_100000757261 [0,1,0,0,0,0|2,0,0]=3 474 B11R1.40 CNC(=O)CC1CCOCC1 240690a_100102657272_100000757261 [0,1,0,0,0,0|2,0,0]=3 475 B11R1.40 CNC(=O)CC1CCOCC1 527a_100102657272_100000757261 [0,1,0,0,0,0|2,0,0]=3 476 B11R1.40 CNC(=O)CN1CCCCC1 11a_106832991635_100000740322 [0,1,0,0,0,0|2,0,0]=3 477 B11R1.40 CNC(=O)CN1CCCCC1 240690a_100102657272_100000740322 [0,1,0,0,0,0|2,0,0]=3 478 B11R1.40 CNC(=O)CN1CCCCC1 527a_100102657272_100000740322 [0,1,0,0,0,0|2,0,0]=3 479 B11R1.40 CNC(=O)CN1CCCOC1 2230a_100000131196_100000183359 [0,1,0,0,0,0|3,0,0]=4 480 B11R1.40 CNC(=O)CN1CCCOC1 269982a_100000131196_100000183359 [0,1,0,0,0,0|3,0,0]=4 481 B11R1.40 CNC(=O)CN1CCCOC1 34a_100000131196_100000183359 [0,1,0,0,0,0|3,0,0]=4 482 B11R1.40 CNC(=O)CN1CCOCC1 11a_106832991635_100000740321 [0,1,0,0,0,0|3,0,0]=4 483 B11R1.40 CNC(=O)CN1CCOCC1 2230a_100015191051_100000183359 [0,1,0,0,0,0|3,0,0]=4 484 B11R1.40 CNC(=O)CN1CCOCC1 240690a_100102657272_100000740321 [0,1,0,0,0,0|3,0,0]=4 485 B11R1.40 CNC(=O)CN1CCOCC1 269982a_100015191051_100000183359 [0,1,0,0,0,0|3,0,0]=4 486 B11R1.40 CNC(=O)CN1CCOCC1 34a_100015191051_100000183359 [0,1,0,0,0,0|3,0,0]=4 487 B11R1.40 CNC(=O)CN1CCOCC1 527a_100102657272_100000740321 [0,1,0,0,0,0|3,0,0]=4 488 B11R1.40 CNC(=O)CN1CCSCC1 2230a_100000737611_100000183359 [0,1,0,0,0,0|3,0,0]=4 489 B11R1.40 CNC(=O)CN1CCSCC1 269982a_100000737611_100000183359 [0,1,0,0,0,0|3,0,0]=4 490 B11R1.40 CNC(=O)NC1CCCCC1 2708a_100000182618_106832991635 [0,1,0,0,0,0|2,0,0]=3 491 B11R1.40 CNC(=O)NC1CCCCC1 2708a_100102657272_100000182618 [0,1,0,0,0,0|2,0,0]=3 492 B11R1.40 CNC(=O)NC1CCCCC1 273464a_100000182618_100102657272 [0,1,0,0,0,0|2,0,0]=3 493 B11R1.40 CNC(=O)NC1CCCCC1 273464a_100102657272_100000182618 [0,1,0,0,0,0|2,0,0]=3 494 B11R1.40 CNC(=O)NC1CCCOC1 2708a_100000719290_106832991635 [0,1,0,0,0,0|3,0,0]=4 495 B11R1.40 CNC(=O)NC1CCCOC1 2708a_100102657272_100000719290 [0,1,0,0,0,0|3,0,0]=4 496 B11R1.40 CNC(=O)NC1CCCOC1 273464a_100000719290_100102657272 [0,1,0,0,0,0|3,0,0]=4 497 B11R1.40 CNC(=O)NC1CCCOC1 273464a_100102657272_100000719290 [0,1,0,0,0,0|3,0,0]=4 498 B11R1.40 CNC(=O)NC1CCCOC1 512a_100000719290_100102657272 [0,1,0,0,0,0|3,0,0]=4 499 B11R1.40 CNC(=O)NC1CCCOC1 512a_106832991638_100000719290 [0,1,0,0,0,0|3,0,0]=4 500 B11R1.40 CNC(=O)NC1CCOCC1 2708a_100000741149_106832991635 [0,1,0,0,0,0|3,0,0]=4 501 B11R1.40 CNC(=O)NC1CCOCC1 2708a_100102657272_100000741149 [0,1,0,0,0,0|3,0,0]=4 502 B11R1.40 CNC(=O)NC1CCOCC1 273464a_100000741149_100102657272 [0,1,0,0,0,0|3,0,0]=4 503 B11R1.40 CNC(=O)NC1CCOCC1 273464a_100102657272_100000741149 [0,1,0,0,0,0|3,0,0]=4 504 B11R1.40 CNC(=O)NC1CCOCC1 512a_100000741149_100102657272 [0,1,0,0,0,0|3,0,0]=4 505 B11R1.40 CNC(=O)NC1CCOCC1 512a_106832991638_100000741149 [0,1,0,0,0,0|3,0,0]=4 506 B11R1.40 CNC(=O)NC1CCSCC1 2708a_100000748639_106832991635 [0,1,0,0,0,0|3,0,0]=4 507 B11R1.40 CNC(=O)NC1CCSCC1 2708a_100102657272_100000748639 [0,1,0,0,0,0|3,0,0]=4 508 B11R1.40 CNC(=O)NC1CCSCC1 273464a_100000748639_100102657272 [0,1,0,0,0,0|3,0,0]=4 509 B11R1.40 CNC(=O)NC1CCSCC1 273464a_100102657272_100000748639 [0,1,0,0,0,0|3,0,0]=4 510 B11R1.40 CNC(=O)NC1CCSCC1 512a_100000748639_100102657272 [0,1,0,0,0,0|3,0,0]=4 511 B11R1.40 CNC(=O)NC1CCSCC1 512a_106832991638_100000748639 [0,1,0,0,0,0|3,0,0]=4 512 B11R1.40 CNC(C)CC1CCCCC1 270004a_106832991635_100011215996 [0,1,0,0,0,0|2,0,1]=4 513 B11R1.40 COC(=O)CN1CC=CCC1 2230a_100000698166_100000747449 [0,1,0,0,0,0|1,0,2]=4 514 B11R1.40 COC(=O)CN1CC=CCC1 269982a_100000698166_100000747449 [0,1,0,0,0,0|1,0,2]=4 515 B11R1.40 COC(=O)CN1CC=CCC1 34a_100000698166_100000747449 [0,1,0,0,0,0|1,0,2]=4 516 B11R1.40 COC(=O)CN1CCCOC1 2230a_100000131196_100000747449 [0,1,0,0,0,0|2,0,0]=3 517 B11R1.40 COC(=O)CN1CCCOC1 269982a_100000131196_100000747449 [0,1,0,0,0,0|2,0,0]=3 518 B11R1.40 COC(=O)CN1CCCOC1 34a_100000131196_100000747449 [0,1,0,0,0,0|2,0,0]=3 519 B11R1.40 COC(=O)CN1CCOCC1 2230a_100015191051_100000747449 [0,1,0,0,0,0|2,0,0]=3 520 B11R1.40 COC(=O)CN1CCOCC1 269982a_100015191051_100000747449 [0,1,0,0,0,0|2,0,0]=3 521 B11R1.40 COC(=O)CN1CCOCC1 34a_100015191051_100000747449 [0,1,0,0,0,0|2,0,0]=3 522 B11R1.40 COC(=O)CN1CCSCC1 2230a_100000737611_100000747449 [0,1,0,0,0,0|2,0,0]=3 523 B11R1.40 COC(=O)CN1CCSCC1 269982a_100000737611_100000747449 [0,1,0,0,0,0|2,0,0]=3 524 B11R1.40 COC(C)SC1CCCCC1 62a_100000210327_100009879195 [0,1,0,0,0,0|2,0,1]=4 525 B11R1.40 COC(C)SC1CCCCC1 62a_100009879195_100000210327 [0,1,0,0,0,0|2,0,1]=4 526 B11R1.40 C[C@H](CO)NC1CCCCC1 270004a_100000737577_100000210434 [0,1,0,0,0,0|2,0,1]=4 527 B11R1.40 C[C@H](CO)SC1CCCCC1 62a_100000210327_100016084084 [0,1,0,0,0,0|2,0,1]=4 528 B11R1.40 C[C@H](CO)SC1CCCCC1 62a_100016084084_100000210327 [0,1,0,0,0,0|2,0,1]=4 529 B11R1.40 O=C(C=C1CCCCC1)CF 1458a_100000743792_100015361967 [0,1,0,0,0,0|1,0,2]=4 530 B11R1.40 O=C(CF)CC1=CCCCC1 1458a_100000039269_100015361967 [0,1,0,0,0,0|1,0,2]=4 531 B11R1.40 O=C(CF)CC1CCCCC1 1458a_100000211666_100015361967 [0,1,0,0,0,0|1,0,0]=2 532 B11R1.40 O=C(CF)CC1CCCCO1 1458a_100000238585_100015361967 [0,1,0,0,0,0|2,0,0]=3 533 B11R1.40 O=C(CF)CC1CCCOC1 1458a_100000741523_100015361967 [0,1,0,0,0,0|2,0,0]=3 534 B11R1.40 O=C(CF)CC1CCOCC1 1458a_100000757261_100015361967 [0,1,0,0,0,0|2,0,0]=3 535 B11R1.40 O=C(CF)CN1CCCCC1 1458a_100000740322_100015361967 [0,1,0,0,0,0|2,0,0]=3 536 B11R1.40 O=C(CF)CN1CCOCC1 1458a_100000740321_100015361967 [0,1,0,0,0,0|3,0,0]=4 537 B11R1.40 O=C(CO)CC1CCCCC1 1458a_100000210174_100000211423 [0,1,0,0,0,0|0,0,0]=1 538 B11R1.40 O=C(CO)CC1CCCCO1 1458a_100000210174_100000211543 [0,1,0,0,0,0|1,0,0]=2 539 B11R1.40 O=C(CO)CC1CCCOC1 1458a_100000210174_100000741521 [0,1,0,0,0,0|1,0,0]=2 540 B11R1.40 O=C(CO)CC1CCOCC1 1458a_100000210174_100000754603 [0,1,0,0,0,0|1,0,0]=2 541 B11R1.40 O=C(CO)NC1CCCCC1 240690a_100000182618_100000210174 [0,1,0,0,0,0|1,0,0]=2 542 B11R1.40 O=C(CO)NC1CCCCC1 527a_100000182618_100000210174 [0,1,0,0,0,0|1,0,0]=2 543 B11R1.40 O=C(CO)NC1CCCOC1 240690a_100000719290_100000210174 [0,1,0,0,0,0|2,0,0]=3 544 B11R1.40 O=C(CO)NC1CCCOC1 527a_100000719290_100000210174 [0,1,0,0,0,0|2,0,0]=3 545 B11R1.40 O=C(CO)NC1CCOCC1 240690a_100000741149_100000210174 [0,1,0,0,0,0|2,0,0]=3 546 B11R1.40 O=C(CO)NC1CCOCC1 527a_100000741149_100000210174 [0,1,0,0,0,0|2,0,0]=3 547 B11R1.40 O=C(CO)NC1CCSCC1 240690a_100000748639_100000210174 [0,1,0,0,0,0|2,0,0]=3 548 B11R1.40 O=C(CO)NC1CCSCC1 527a_100000748639_100000210174 [0,1,0,0,0,0|2,0,0]=3 549 B11R1.86 C=C(C)CN1CCCCC1C 2230a_100000211376_100000748629 [0,1,0,0,0,0|3,0,0]=4 550 B11R1.86 C=C(C)CN1CCCCC1C 269982a_100000211376_100000748629 [0,1,0,0,0,0|3,0,0]=4 551 B11R1.86 C=C(C)CN1CCCCC1C 34a_100000211376_100000748629 [0,1,0,0,0,0|3,0,0]=4 552 B11R1.86 C=C(F)CN1CCCCC1C 2230a_100000211376_100009893438 [0,1,0,0,0,0|3,0,0]=4 553 B11R1.86 C=C(F)CN1CCCCC1C 269982a_100000211376_100009893438 [0,1,0,0,0,0|3,0,0]=4 554 B11R1.86 C=C(F)CN1CCCCC1C 34a_100000211376_100009893438 [0,1,0,0,0,0|3,0,0]=4 555 B11R1.86 CC(=O)CC1CCCCN1C 1458a_100000070787_100015185383 [0,1,0,0,0,0|2,0,0]=3 556 B11R1.86 CC(=O)NC1CCCCC1C 11a_100000211402_100015343762 [0,1,0,0,0,0|2,0,0]=3 557 B11R1.86 CC(=O)NC1CCCCC1C 1626a_100000211402_100015343762 [0,1,0,0,0,0|2,0,0]=3 558 B11R1.86 CC(=O)NC1CCCCC1C 240690a_100000211402_100015343762 [0,1,0,0,0,0|2,0,0]=3 559 B11R1.86 CC(=O)NC1CCCCC1C 527a_100000211402_100103153847 [0,1,0,0,0,0|2,0,0]=3 560 B11R1.86 CC(=O)N[C@@H]1CCCC[C@@H]1O 240690a_100015191688_100015343762 [0,1,0,0,0,0|2,0,0]=3 561 B11R1.86 CC(=O)N[C@@H]1CCCC[C@@H]1O 527a_100015191688_100103153847 [0,1,0,0,0,0|2,0,0]=3 562 B11R1.86 CC(=O)N[C@@H]1CCCC[C@H]1F 11a_100015195156_100015343762 [0,1,0,0,0,0|2,0,0]=3 563 B11R1.86 CC(=O)N[C@@H]1CCCC[C@H]1F 1626a_100015195156_100015343762 [0,1,0,0,0,0|2,0,0]=3 564 B11R1.86 CC(=O)N[C@@H]1CCCC[C@H]1F 240690a_100015195156_100015343762 [0,1,0,0,0,0|2,0,0]=3 565 B11R1.86 CC(=O)N[C@@H]1CCCC[C@H]1F 527a_100015195156_100103153847 [0,1,0,0,0,0|2,0,0]=3 566 B11R1.86 CC(=O)N[C@@H]1CCOC[C@@H]1O 11a_100016994285_100015343762 [0,1,0,0,0,0|3,0,0]=4 567 B11R1.86 CC(=O)N[C@@H]1CCOC[C@@H]1O 240690a_100016994285_100015343762 [0,1,0,0,0,0|3,0,0]=4 568 B11R1.86 CC(=O)N[C@@H]1CCOC[C@@H]1O 527a_100016994285_100103153847 [0,1,0,0,0,0|3,0,0]=4 569 B11R1.86 CC(=O)N[C@H]1CCOC[C@@H]1F 11a_100016994078_100015343762 [0,1,0,0,0,0|3,0,0]=4 570 B11R1.86 CC(=O)N[C@H]1CCOC[C@@H]1F 1626a_100016994078_100015343762 [0,1,0,0,0,0|3,0,0]=4 571 B11R1.86 CC(=O)N[C@H]1CCOC[C@@H]1F 240690a_100016994078_100015343762 [0,1,0,0,0,0|3,0,0]=4 572 B11R1.86 CC(=O)N[C@H]1CCOC[C@@H]1F 527a_100016994078_100103153847 [0,1,0,0,0,0|3,0,0]=4 573 B11R1.86 CC(=O)N[C@H]1COCC[C@@H]1O 11a_100015739063_100015343762 [0,1,0,0,0,0|3,0,0]=4 574 B11R1.86 CC(=O)N[C@H]1COCC[C@@H]1O 240690a_100015739063_100015343762 [0,1,0,0,0,0|3,0,0]=4 575 B11R1.86 CC(O)CN1CCCCC1C 2230a_100000211376_100011218427 [0,1,0,0,0,0|2,0,1]=4 576 B11R1.86 CC(O)CN1CCCCC1C 269982a_100000211376_100011218427 [0,1,0,0,0,0|2,0,1]=4 577 B11R1.86 CC(O)CN1CCCCC1C 34a_100000211376_100011218427 [0,1,0,0,0,0|2,0,1]=4 578 B11R1.86 CC1CCCCN1CC(=O)N 2230a_100000211376_100000747473 [0,1,0,0,0,0|2,0,0]=3 579 B11R1.86 CC1CCCCN1CC(=O)N 269982a_100000211376_100000187820 [0,1,0,0,0,0|2,0,0]=3 580 B11R1.86 CC1CCCCN1CC(=O)N 34a_100000211376_100000187820 [0,1,0,0,0,0|2,0,0]=3 581 B11R1.86 CC1CCCCN1CC(=O)[O-] 269982a_100000211376_100020667443 [0,1,0,0,0,0|1,0,1]=3 582 B11R1.86 CC1CCCCN1CC(=O)[O-] 34a_100000211376_100020667443 [0,1,0,0,0,0|1,0,1]=3 583 B11R1.86 CC1CCCCN1C[C@@H](C)O 2230a_100000211376_100009817552 [0,1,0,0,0,0|2,0,1]=4 584 B11R1.86 CC1CCCCN1C[C@@H](C)O 269982a_100000211376_100009817552 [0,1,0,0,0,0|2,0,1]=4 585 B11R1.86 CC1CCCCN1C[C@@H](C)O 34a_100000211376_100009817552 [0,1,0,0,0,0|2,0,1]=4 586 B11R1.86 CC1CCCCN1C[N+](=O)[O-] 269982a_100000211376_100000761209 [0,1,0,0,0,0|2,0,1]=4 587 B11R1.86 CC1CCCCN1C[N+](=O)[O-] 34a_100000211376_100000761209 [0,1,0,0,0,0|2,0,1]=4 588 B11R1.86 CN1CCCCC1CC(=O)N 2230a_100015184752_200000210301 [0,1,0,0,0,0|2,0,0]=3 589 B11R1.86 CN1CCCCC1CC(=O)N 269982a_100015184752_200000210301 [0,1,0,0,0,0|2,0,0]=3 590 B11R1.86 CN1CCCCC1CC(=O)N 34a_100015184752_200000210301 [0,1,0,0,0,0|2,0,0]=3 591 B11R1.86 C[C@H]1COCCN1CC(=O)N 2230a_100009815349_100000747473 [0,1,0,0,0,0|3,0,0]=4 592 B11R1.86 C[C@H]1COCCN1CC(=O)N 269982a_100009815349_100000187820 [0,1,0,0,0,0|3,0,0]=4 593 B11R1.86 C[C@H]1COCCN1CC(=O)N 34a_100009815349_100000187820 [0,1,0,0,0,0|3,0,0]=4 594 B11R1.86 C[C@H]1COCCN1CC(=O)[O-] 269982a_100009815349_100020667443 [0,1,0,0,0,0|2,0,1]=4 595 B11R1.86 C[C@H]1COCCN1CC(=O)[O-] 34a_100009815349_100020667443 [0,1,0,0,0,0|2,0,1]=4 596 B11R1.86 [13CH3]N1CCCCC1CC(=O)N 2230a_100015184752_200025704644 [0,1,0,0,0,0|2,0,0]=3 597 B11R1.86 [13CH3]N1CCCCC1CC(=O)N 269982a_100015184752_200025704644 [0,1,0,0,0,0|2,0,0]=3 598 B11R1.86 [13CH3]N1CCCCC1CC(=O)N 34a_100015184752_200025704644 [0,1,0,0,0,0|2,0,0]=3 599 B11R1.157 C=C(C)CN1CCCC(C1)F 2230a_100000697950_100000748629 [0,1,0,0,0,0|3,0,0]=4 600 B11R1.157 C=C(C)CN1CCCC(C1)F 269982a_100000697950_100000748629 [0,1,0,0,0,0|3,0,0]=4 601 B11R1.157 C=C(C)CN1CCCC(C1)F 34a_100000697950_100000748629 [0,1,0,0,0,0|3,0,0]=4 602 B11R1.157 C=C(C)CN1CCCC(C1)O 2230a_100000211013_100000748629 [0,1,0,0,0,0|3,0,0]=4 603 B11R1.157 C=C(C)CN1CCCC(C1)O 269982a_100000211013_100000748629 [0,1,0,0,0,0|3,0,0]=4 604 B11R1.157 C=C(C)CN1CCC[C@@H](C1)C 2230a_100000717927_100000748629 [0,1,0,0,0,0|3,0,0]=4 605 B11R1.157 C=C(C)CN1CCC[C@@H](C1)C 269982a_100000717927_100000748629 [0,1,0,0,0,0|3,0,0]=4 606 B11R1.157 C=C(C)CN1CCC[C@@H](C1)C 34a_100000717927_100000748629 [0,1,0,0,0,0|3,0,0]=4 607 B11R1.157 C=C(F)CN1CCCC(C1)F 2230a_100000697950_100009893438 [0,1,0,0,0,0|3,0,0]=4 608 B11R1.157 C=C(F)CN1CCCC(C1)F 269982a_100000697950_100009893438 [0,1,0,0,0,0|3,0,0]=4 609 B11R1.157 C=C(F)CN1CCCC(C1)F 34a_100000697950_100009893438 [0,1,0,0,0,0|3,0,0]=4 610 B11R1.157 C=C(F)CN1CCCC(C1)O 2230a_100000211013_100009893438 [0,1,0,0,0,0|3,0,0]=4 611 B11R1.157 C=C(F)CN1CCCC(C1)O 269982a_100000211013_100009893438 [0,1,0,0,0,0|3,0,0]=4 612 B11R1.157 C=C(F)CN1CCC[C@@H](C1)C 2230a_100000717927_100009893438 [0,1,0,0,0,0|3,0,0]=4 613 B11R1.157 C=C(F)CN1CCC[C@@H](C1)C 269982a_100000717927_100009893438 [0,1,0,0,0,0|3,0,0]=4 614 B11R1.157 C=C(F)CN1CCC[C@@H](C1)C 34a_100000717927_100009893438 [0,1,0,0,0,0|3,0,0]=4 615 B11R1.157 CC(=O)CC1CCCC(C1)C 1458a_100000748788_200000210301 [0,1,0,0,0,0|1,0,0]=2 616 B11R1.157 CC(=O)CC1CCCN(C1)C 1458a_100000070787_100015183302 [0,1,0,0,0,0|2,0,0]=3 617 B11R1.157 CC(=O)NC1CCCC(C1)C 11a_100011194320_100015343762 [0,1,0,0,0,0|2,0,0]=3 618 B11R1.157 CC(=O)NC1CCCC(C1)C 1626a_100011194320_100015343762 [0,1,0,0,0,0|2,0,0]=3 619 B11R1.157 CC(=O)NC1CCCC(C1)C 240690a_100011194320_100015343762 [0,1,0,0,0,0|2,0,0]=3 620 B11R1.157 CC(=O)NC1CCCC(C1)C 527a_100011194320_100103153847 [0,1,0,0,0,0|2,0,0]=3 621 B11R1.157 CC(=O)NC1CCCC(C1)O 1626a_100015190357_100015343762 [0,1,0,0,0,0|2,0,0]=3 622 B11R1.157 CC(=O)NC1CCCC(C1)O 240690a_100015190357_100015343762 [0,1,0,0,0,0|2,0,0]=3 623 B11R1.157 CC(=O)NC1CCCN(C1)C 2230a_106657272119_200000210301 [0,1,0,0,0,0|3,0,0]=4 624 B11R1.157 CC(=O)NC1CCCN(C1)C 269982a_106657272119_200000210301 [0,1,0,0,0,0|3,0,0]=4 625 B11R1.157 CC(=O)NC1CCCN(C1)[13CH3] 2230a_106657272119_200025704644 [0,1,0,0,0,0|3,0,0]=4 626 B11R1.157 CC(=O)NC1CCCN(C1)[13CH3] 269982a_106657272119_200025704644 [0,1,0,0,0,0|3,0,0]=4 627 B11R1.157 CC(=O)N[C@H]1CCCN(C1)C 240690a_100016992120_100015343762 [0,1,0,0,0,0|3,0,0]=4 628 B11R1.157 CC(=O)N[C@H]1CCCN(C1)C 527a_100016992120_100103153847 [0,1,0,0,0,0|3,0,0]=4 629 B11R1.157 CC(O)CN1CCCC(C1)F 2230a_100000697950_100011218427 [0,1,0,0,0,0|2,0,1]=4 630 B11R1.157 CC(O)CN1CCCC(C1)F 269982a_100000697950_100011218427 [0,1,0,0,0,0|2,0,1]=4 631 B11R1.157 CC(O)CN1CCCC(C1)F 34a_100000697950_100011218427 [0,1,0,0,0,0|2,0,1]=4 632 B11R1.157 CC(O)CN1CCCC(C1)O 2230a_100000211013_100011218427 [0,1,0,0,0,0|2,0,1]=4 633 B11R1.157 CC(O)CN1CCCC(C1)O 269982a_100000211013_100011218427 [0,1,0,0,0,0|2,0,1]=4 634 B11R1.157 CC(O)CN1CCC[C@@H](C1)C 2230a_100000717927_100011218427 [0,1,0,0,0,0|2,0,1]=4 635 B11R1.157 CC(O)CN1CCC[C@@H](C1)C 269982a_100000717927_100011218427 [0,1,0,0,0,0|2,0,1]=4 636 B11R1.157 CC(O)CN1CCC[C@@H](C1)C 34a_100000717927_100011218427 [0,1,0,0,0,0|2,0,1]=4 637 B11R1.157 CC1CCCC(C1)CC(=O)[13CH3] 1458a_100000748788_200025704644 [0,1,0,0,0,0|1,0,0]=2 638 B11R1.157 CC1CN(CCO1)CC(=O)N 2230a_100000729577_100000747473 [0,1,0,0,0,0|3,0,0]=4 639 B11R1.157 CC1CN(CCO1)CC(=O)N 269982a_100000729577_100000187820 [0,1,0,0,0,0|3,0,0]=4 640 B11R1.157 CC1CN(CCO1)CC(=O)N 34a_100000729577_100000187820 [0,1,0,0,0,0|3,0,0]=4 641 B11R1.157 CC1CN(CCO1)CC(=O)[O-] 269982a_100000729577_100020667443 [0,1,0,0,0,0|2,0,1]=4 642 B11R1.157 CC1CN(CCO1)CC(=O)[O-] 34a_100000729577_100020667443 [0,1,0,0,0,0|2,0,1]=4 643 B11R1.157 CN1CCCC(C1)CC(=O)O 269956a_100015207179_200000210301 [0,1,0,0,0,0|1,0,0]=2 644 B11R1.157 CN1CCOC(C1)CC(=O)O 269956a_100015183369_200000210301 [0,1,0,0,0,0|2,0,0]=3 645 B11R1.157 C[C@@H](O)CN1CCCC(C1)F 2230a_100000697950_100009817552 [0,1,0,0,0,0|2,0,1]=4 646 B11R1.157 C[C@@H](O)CN1CCCC(C1)F 269982a_100000697950_100009817552 [0,1,0,0,0,0|2,0,1]=4 647 B11R1.157 C[C@@H](O)CN1CCCC(C1)F 34a_100000697950_100009817552 [0,1,0,0,0,0|2,0,1]=4 648 B11R1.157 C[C@@H](O)CN1CCCC(C1)O 2230a_100000211013_100009817552 [0,1,0,0,0,0|2,0,1]=4 649 B11R1.157 C[C@@H](O)CN1CCCC(C1)O 269982a_100000211013_100009817552 [0,1,0,0,0,0|2,0,1]=4 650 B11R1.157 C[C@H]1CCCN(C1)CC(=O)N 2230a_100000717927_100000747473 [0,1,0,0,0,0|2,0,0]=3 651 B11R1.157 C[C@H]1CCCN(C1)CC(=O)N 269982a_100000717927_100000187820 [0,1,0,0,0,0|2,0,0]=3 652 B11R1.157 C[C@H]1CCCN(C1)CC(=O)N 34a_100000717927_100000187820 [0,1,0,0,0,0|2,0,0]=3 653 B11R1.157 C[C@H]1CCCN(C1)CC(=O)[O-] 269982a_100000717927_100020667443 [0,1,0,0,0,0|1,0,1]=3 654 B11R1.157 C[C@H]1CCCN(C1)CC(=O)[O-] 34a_100000717927_100020667443 [0,1,0,0,0,0|1,0,1]=3 655 B11R1.157 C[C@H]1CCCN(C1)C[C@@H](C)O 2230a_100000717927_100009817552 [0,1,0,0,0,0|2,0,1]=4 656 B11R1.157 C[C@H]1CCCN(C1)C[C@@H](C)O 269982a_100000717927_100009817552 [0,1,0,0,0,0|2,0,1]=4 657 B11R1.157 C[C@H]1CCCN(C1)C[C@@H](C)O 34a_100000717927_100009817552 [0,1,0,0,0,0|2,0,1]=4 658 B11R1.157 C[C@H]1CCCN(C1)C[N+](=O)[O-] 269982a_100000717927_100000761209 [0,1,0,0,0,0|2,0,1]=4 659 B11R1.157 C[C@H]1CCCN(C1)C[N+](=O)[O-] 34a_100000717927_100000761209 [0,1,0,0,0,0|2,0,1]=4 660 B11R1.157 NC(=O)CN1CCCC(C1)F 2230a_100000697950_100000747473 [0,1,0,0,0,0|2,0,0]=3 661 B11R1.157 NC(=O)CN1CCCC(C1)F 269982a_100000697950_100000187820 [0,1,0,0,0,0|2,0,0]=3 662 B11R1.157 NC(=O)CN1CCCC(C1)F 34a_100000697950_100000187820 [0,1,0,0,0,0|2,0,0]=3 663 B11R1.157 NC(=O)CN1CCCC(C1)O 2230a_100000211013_100000747473 [0,1,0,0,0,0|2,0,0]=3 664 B11R1.157 NC(=O)CN1CCCC(C1)O 269982a_100000211013_100000187820 [0,1,0,0,0,0|2,0,0]=3 665 B11R1.157 NC(=O)CN1CCOC(C1)O 2230a_100000688207_100000747473 [0,1,0,0,0,0|3,0,0]=4 666 B11R1.157 NC(=O)CN1CCOC(C1)O 269982a_100000688207_100000187820 [0,1,0,0,0,0|3,0,0]=4 667 B11R1.157 O=C([O-])CN1CCCC(C1)F 269982a_100000697950_100020667443 [0,1,0,0,0,0|1,0,1]=3 668 B11R1.157 O=C([O-])CN1CCCC(C1)F 34a_100000697950_100020667443 [0,1,0,0,0,0|1,0,1]=3 669 B11R1.157 O=C([O-])CN1CCCC(C1)O 269982a_100000211013_100020667443 [0,1,0,0,0,0|1,0,1]=3 670 B11R1.157 O=C([O-])CN1CCOC(C1)O 269982a_100000688207_100020667443 [0,1,0,0,0,0|2,0,1]=4 671 B11R1.157 O=[N+]([O-])CN1CCCC(C1)F 269982a_100000697950_100000761209 [0,1,0,0,0,0|2,0,1]=4 672 B11R1.157 O=[N+]([O-])CN1CCCC(C1)F 34a_100000697950_100000761209 [0,1,0,0,0,0|2,0,1]=4 673 B11R1.157 O=[N+]([O-])CN1CCCC(C1)O 269982a_100000211013_100000761209 [0,1,0,0,0,0|2,0,1]=4 674 B11R1.157 [13CH3]N1CCCC(C1)CC(=O)O 269956a_100015207179_200025704644 [0,1,0,0,0,0|1,0,0]=2 675 B11R1.157 [13CH3]N1CCOC(C1)CC(=O)O 269956a_100015183369_200025704644 [0,1,0,0,0,0|2,0,0]=3 676 B11R1.509 CS(=O)(=O)NC1CCCCC1 40a_100000182618_100000738038 [0,1,0,0,0,0|2,0,1]=4 677 B11R1.928 CC(=O)CC1(CCCCC1)O 1458a_100000755886_200000210301 [0,1,0,0,0,0|1,0,0]=2 678 B11R1.928 CC(=O)NC1(CCCCC1)C 11a_100000741114_100015343762 [0,1,0,0,0,0|2,0,0]=3 679 B11R1.928 CC(=O)NC1(CCCCC1)C 1626a_100000741114_100015343762 [0,1,0,0,0,0|2,0,0]=3 680 B11R1.928 CC(=O)NC1(CCCCC1)C 240690a_100000741114_100015343762 [0,1,0,0,0,0|2,0,0]=3 681 B11R1.928 CC(=O)NC1(CCCCC1)C 527a_100000741114_100103153847 [0,1,0,0,0,0|2,0,0]=3 682 B11R1.928 CC(=O)NC1(CCOCC1)C 11a_100000692449_100015343762 [0,1,0,0,0,0|3,0,0]=4 683 B11R1.928 CC(=O)NC1(CCOCC1)C 1626a_100000692449_100015343762 [0,1,0,0,0,0|3,0,0]=4 684 B11R1.928 CC(=O)NC1(CCOCC1)C 240690a_100000692449_100015343762 [0,1,0,0,0,0|3,0,0]=4 685 B11R1.928 CC(=O)NC1(CCOCC1)C 527a_100000692449_100103153847 [0,1,0,0,0,0|3,0,0]=4 686 B11R1.928 [13CH3]C(=O)CC1(CCCCC1)O 1458a_100000755886_200025704644 [0,1,0,0,0,0|1,0,0]=2 687 B9R0.2 C#CCCCCCC(=O)C 1458a_100000070787_100012094781 [0,0,1,0,0,0|1,0,2]=4 688 B9R0.2 C#CCCCCCC(=O)C 1458a_100000694772_200000210301 [0,0,1,0,0,0|1,0,2]=4 689 B9R0.2 C#CCCCCCC(=O)[13CH3] 1458a_100000694772_200025704644 [0,0,1,0,0,0|1,0,2]=4 690 B9R0.2 C#CCCCNCC(=O)O 269956a_100016091260_100011215417 [0,0,1,0,0,0|1,0,2]=4 691 B9R0.2 C=C(Br)CCOCCCC 34a_100009813270_100000210210 [0,0,1,0,0,0|3,0,0]=4 692 B9R0.2 C=C(C)CCNCCCC 2230a_100000102301_100000730704 [0,0,1,0,0,0|3,0,0]=4 693 B9R0.2 C=C(C)CCNCCCC 7a_106832991798_100000730704 [0,0,1,0,0,0|3,0,0]=4 694 B9R0.2 C=C(C)CCOCCCC 34a_100000210227_100000730704 [0,0,1,0,0,0|3,0,0]=4 695 B9R0.2 C=C(C)CCOCCCC 34a_100000764851_100000210210 [0,0,1,0,0,0|3,0,0]=4 696 B9R0.2 C=C(C)CCOCCCC 7a_100000210227_100000730704 [0,0,1,0,0,0|3,0,0]=4 697 B9R0.2 C=C(C)CCSCCCC 62a_100000210211_100000730704 [0,0,1,0,0,0|3,0,0]=4 698 B9R0.2 C=C(C)CCSCCCC 62a_100000730704_100000210210 [0,0,1,0,0,0|3,0,0]=4 699 B9R0.2 C=C(C)CNCCCCC 2230a_100000209983_100000748629 [0,0,1,0,0,0|3,0,0]=4 700 B9R0.2 C=C(C)COCCCCC 34a_100000210245_100000718602 [0,0,1,0,0,0|3,0,0]=4 701 B9R0.2 C=C(C)COCCCCC 34a_100000210253_100000748629 [0,0,1,0,0,0|3,0,0]=4 702 B9R0.2 C=C(C)COCCCCC 7a_100000210253_100000748629 [0,0,1,0,0,0|3,0,0]=4 703 B9R0.2 C=C(C)CSCCCCC 62a_100000210326_100000211660 [0,0,1,0,0,0|3,0,0]=4 704 B9R0.2 C=C(C)CSCCCCC 62a_100000748629_100000210326 [0,0,1,0,0,0|3,0,0]=4 705 B9R0.2 C=C(F)CNCCCCC 2230a_100000209983_100009893438 [0,0,1,0,0,0|3,0,0]=4 706 B9R0.2 C=C(F)COCCCCC 34a_100000210253_100009893438 [0,0,1,0,0,0|3,0,0]=4 707 B9R0.2 C=C(F)COCCCCC 34a_200010262243_100000718602 [0,0,1,0,0,0|3,0,0]=4 708 B9R0.2 C=C(F)COCCCCC 7a_100000210253_100000042424 [0,0,1,0,0,0|3,0,0]=4 709 B9R0.2 C=C(F)CSCCCCC 62a_100000042424_100000210326 [0,0,1,0,0,0|3,0,0]=4 710 B9R0.2 C=C(F)CSCCCCC 62a_100000210326_100000042424 [0,0,1,0,0,0|3,0,0]=4 711 B9R0.2 C=CCCCCCC(=O)C 1458a_100000070787_100000700193 [0,0,1,0,0,0|1,0,2]=4 712 B9R0.2 C=CCCCCCC(=O)C 1458a_100011934241_200000210301 [0,0,1,0,0,0|1,0,2]=4 713 B9R0.2 C=CCCCCCC(=O)[13CH3] 1458a_100011934241_200025704644 [0,0,1,0,0,0|1,0,2]=4 714 B9R0.2 C=CCCCNCC(=O)O 269956a_100016091260_100011713584 [0,0,1,0,0,0|1,0,2]=4 715 B9R0.2 CC(=O)CCCCCC#N 1458a_100000070787_100009813376 [0,0,1,0,0,0|2,0,1]=4 716 B9R0.2 CC(=O)CCCCCCF 1458a_100000070787_100015922095 [0,0,1,0,0,0|2,0,0]=3 717 B9R0.2 CC(=O)CCCCCCO 1458a_100000070787_100000766143 [0,0,1,0,0,0|2,0,0]=3 718 B9R0.2 CC(=O)CCCCCCO 1458a_100011996774_200000210301 [0,0,1,0,0,0|2,0,0]=3 719 B9R0.2 CC(=O)CCCCSCF 62a_100000735457_100015361967 [0,0,1,0,0,0|3,0,0]=4 720 B9R0.2 CC(=O)CCCCSCF 62a_100015361967_100000735457 [0,0,1,0,0,0|3,0,0]=4 721 B9R0.2 CC(=O)CCCNCCF 34a_100000724931_100000685027 [0,0,1,0,0,0|3,0,0]=4 722 B9R0.2 CC(=O)CCCNCCO 34a_100016990907_100000685027 [0,0,1,0,0,0|3,0,0]=4 723 B9R0.2 CC(=O)CCCOCCBr 34a_100000211926_100000685027 [0,0,1,0,0,0|3,0,0]=4 724 B9R0.2 CC(=O)CCCOCCF 34a_100000759063_100011217306 [0,0,1,0,0,0|3,0,0]=4 725 B9R0.2 CC(=O)CCCOCCF 7a_100000759063_100011217306 [0,0,1,0,0,0|3,0,0]=4 726 B9R0.2 CC(=O)CCCOCCN 34a_100000210304_100000685027 [0,0,1,0,0,0|3,0,0]=4 727 B9R0.2 CC(=O)CCCOCCO 34a_100000759063_100000211926 [0,0,1,0,0,0|3,0,0]=4 728 B9R0.2 CC(=O)CCCOCCO 7a_100000759063_100000211926 [0,0,1,0,0,0|3,0,0]=4 729 B9R0.2 CC(=O)CCCSCCF 62a_100011215641_100011217306 [0,0,1,0,0,0|3,0,0]=4 730 B9R0.2 CC(=O)CCCSCCF 62a_100011217306_100011215641 [0,0,1,0,0,0|3,0,0]=4 731 B9R0.2 CC(=O)CCCSCCO 62a_100000211926_100011215641 [0,0,1,0,0,0|3,0,0]=4 732 B9R0.2 CC(=O)CCCSCCO 62a_100011215641_100000211926 [0,0,1,0,0,0|3,0,0]=4 733 B9R0.2 CC(=O)CCOCCCF 34a_100000759926_100011934791 [0,0,1,0,0,0|3,0,0]=4 734 B9R0.2 CC(=O)CCOCCCF 7a_100000759926_100011934791 [0,0,1,0,0,0|3,0,0]=4 735 B9R0.2 CC(=O)CCOCCCO 34a_100000759926_100000230001 [0,0,1,0,0,0|3,0,0]=4 736 B9R0.2 CC(=O)CCOCCCO 7a_100000759926_100011215043 [0,0,1,0,0,0|3,0,0]=4 737 B9R0.2 CC(=O)CCSCCCF 62a_100000053229_100011934791 [0,0,1,0,0,0|3,0,0]=4 738 B9R0.2 CC(=O)CCSCCCF 62a_100011934791_100000053229 [0,0,1,0,0,0|3,0,0]=4 739 B9R0.2 CC(=O)CCSCCCO 62a_100000053229_100011215043 [0,0,1,0,0,0|3,0,0]=4 740 B9R0.2 CC(=O)CCSCCCO 62a_100011215043_100000053229 [0,0,1,0,0,0|3,0,0]=4 741 B9R0.2 CC(=O)COCCCCF 34a_100000211253_100000729493 [0,0,1,0,0,0|3,0,0]=4 742 B9R0.2 CC(=O)COCCCCO 34a_100000211253_100011216708 [0,0,1,0,0,0|3,0,0]=4 743 B9R0.2 CC(=O)NCCCCCO 240690a_100000762737_100015343762 [0,0,1,0,0,0|3,0,0]=4 744 B9R0.2 CC(=O)NCCCCN[13CH3] 2230a_200011368371_200025704644 [0,0,1,0,0,0|3,0,0]=4 745 B9R0.2 CC(=O)NCCCCN[13CH3] 34a_200011368371_200025704644 [0,0,1,0,0,0|3,0,0]=4 746 B9R0.2 CC(=O)OCCCCO[13CH3] 34a_100000073216_200025704644 [0,0,1,0,0,0|3,0,0]=4 747 B9R0.2 CC(=O)OCCCCO[13CH3] 7a_100000073216_200025704644 [0,0,1,0,0,0|3,0,0]=4 748 B9R0.2 CC(=O)OCCCCS[13CH3] 62a_100000033659_200025704644 [0,0,1,0,0,0|3,0,0]=4 749 B9R0.2 CC(=O)OCCCCS[13CH3] 62a_200025704644_100000033659 [0,0,1,0,0,0|3,0,0]=4 750 B9R0.2 CC(=O)SCCCCS[13CH3] 62a_200010402107_200025704644 [0,0,1,0,0,0|3,0,0]=4 751 B9R0.2 CC(=O)SCCCCS[13CH3] 62a_200025704644_200010402107 [0,0,1,0,0,0|3,0,0]=4 752 B9R0.2 CC/C=C\CNCC(=O)O 269956a_100016091260_100103147603 [0,0,1,0,0,0|1,0,2]=4 753 B9R0.2 CCC#CCNCC(=O)O 269956a_100016091260_100009813939 [0,0,1,0,0,0|1,0,2]=4 754 B9R0.2 CCCC/C=C/CC(=O)C 1458a_200016282684_200000210301 [0,0,1,0,0,0|1,0,2]=4 755 B9R0.2 CCCC/C=C/CC(=O)[13CH3] 1458a_200016282684_200025704644 [0,0,1,0,0,0|1,0,2]=4 756 B9R0.2 CCCCCC#CC(=O)C 1458a_100011215388_200000210301 [0,0,1,0,0,0|1,0,2]=4 757 B9R0.2 CCCCCC#CC(=O)[13CH3] 1458a_100011215388_200025704644 [0,0,1,0,0,0|1,0,2]=4 758 B9R0.2 CCCCCC=CC(=O)C 1458a_100016263427_200000210301 [0,0,1,0,0,0|1,0,2]=4 759 B9R0.2 CCCCCC=CC(=O)[13CH3] 1458a_100016263427_200025704644 [0,0,1,0,0,0|1,0,2]=4 760 B9R0.2 CCCCCCCC(=O)C 1458a_100000070787_100000210614 [0,0,1,0,0,0|1,0,0]=2 761 B9R0.2 CCCCCCCC(=O)C 1458a_100000211969_200000210301 [0,0,1,0,0,0|1,0,0]=2 762 B9R0.2 CCCCCCCC(=O)[13CH3] 1458a_100000211969_200025704644 [0,0,1,0,0,0|1,0,0]=2 763 B9R0.2 CCCCCCCN(C)C 2230a_100000228206_200000210301 [0,0,1,0,0,0|3,0,0]=4 764 B9R0.2 CCCCCCCN(C)C 2230a_100102631434_100000210681 [0,0,1,0,0,0|3,0,0]=4 765 B9R0.2 CCCCCCCN(C)C 269982a_100000228206_200000210301 [0,0,1,0,0,0|3,0,0]=4 766 B9R0.2 CCCCCCCN(C)C 269982a_100102631434_100000210681 [0,0,1,0,0,0|3,0,0]=4 767 B9R0.2 CCCCCCCN(C)[13CH3] 2230a_100000228206_200025704644 [0,0,1,0,0,0|3,0,0]=4 768 B9R0.2 CCCCCCCN(C)[13CH3] 269982a_100000228206_200025704644 [0,0,1,0,0,0|3,0,0]=4 769 B9R0.2 CCCCCCNC(=O)C 11a_100000210581_100015343762 [0,0,1,0,0,0|2,0,0]=3 770 B9R0.2 CCCCCCNC(=O)C 1626a_100000210581_100015343762 [0,0,1,0,0,0|2,0,0]=3 771 B9R0.2 CCCCCCNC(=O)C 240690a_100000210581_100015343762 [0,0,1,0,0,0|2,0,0]=3 772 B9R0.2 CCCCCCNC(=O)C 527a_100000210581_100103153847 [0,0,1,0,0,0|2,0,0]=3 773 B9R0.2 CCCCCNCC(=O)N 2230a_100000209983_100000747473 [0,0,1,0,0,0|2,0,0]=3 774 B9R0.2 CCCCCNCC(=O)N 2230a_100000711301_100000210326 [0,0,1,0,0,0|2,0,0]=3 775 B9R0.2 CCCCCNCC(=O)O 269956a_100016091260_100000210326 [0,0,1,0,0,0|1,0,0]=2 776 B9R0.2 CCCCCNCC(C)O 2230a_100000209983_100011218427 [0,0,1,0,0,0|2,0,1]=4 777 B9R0.2 CCCCCNCC(C)O 2230a_100000210904_100000210326 [0,0,1,0,0,0|2,0,1]=4 778 B9R0.2 CCCCCNCC(C)O 34a_100000210904_100000718602 [0,0,1,0,0,0|2,0,1]=4 779 B9R0.2 CCCCCNC[C@@H](C)O 2230a_100000209983_100009817552 [0,0,1,0,0,0|2,0,1]=4 780 B9R0.2 CCCCCNNC(=O)C 22a_100000694160_100000070787 [0,0,1,0,0,0|3,0,0]=4 781 B9R0.2 CCCCCOCC(=O)C 34a_100000211253_100000718602 [0,0,1,0,0,0|2,0,0]=3 782 B9R0.2 CCCCCOCC(=O)N 34a_100000210253_100000187820 [0,0,1,0,0,0|2,0,0]=3 783 B9R0.2 CCCCCOCC(=O)N 7a_100000210253_100000187820 [0,0,1,0,0,0|2,0,0]=3 784 B9R0.2 CCCCCOCC(=O)[O-] 34a_100000210253_100020667443 [0,0,1,0,0,0|1,0,1]=3 785 B9R0.2 CCCCCOCC(C)O 34a_100000210253_100011218427 [0,0,1,0,0,0|2,0,1]=4 786 B9R0.2 CCCCCOCC(C)O 7a_100000210253_100011218427 [0,0,1,0,0,0|2,0,1]=4 787 B9R0.2 CCCCCOC[C@@H](C)O 34a_100000210253_100009817552 [0,0,1,0,0,0|2,0,1]=4 788 B9R0.2 CCCCCOC[C@@H](C)O 7a_100000210253_100009817552 [0,0,1,0,0,0|2,0,1]=4 789 B9R0.2 CCCCCOC[N+](=O)[O-] 34a_100000210253_100000761209 [0,0,1,0,0,0|2,0,1]=4 790 B9R0.2 CCCCCSCC(=O)N 62a_100000210326_100000747473 [0,0,1,0,0,0|2,0,0]=3 791 B9R0.2 CCCCCSCC(=O)N 62a_100000747473_100000210326 [0,0,1,0,0,0|2,0,0]=3 792 B9R0.2 CCCCCSCC(=O)[O-] 62a_100000210326_100020667443 [0,0,1,0,0,0|1,0,1]=3 793 B9R0.2 CCCCCSCC(=O)[O-] 62a_100020667443_100000210326 [0,0,1,0,0,0|1,0,1]=3 794 B9R0.2 CCCCCSCC(C)O 62a_100000210326_100011218427 [0,0,1,0,0,0|2,0,1]=4 795 B9R0.2 CCCCCSCC(C)O 62a_100011218427_100000210326 [0,0,1,0,0,0|2,0,1]=4 796 B9R0.2 CCCCCSC[C@@H](C)O 62a_100000210326_100009817552 [0,0,1,0,0,0|2,0,1]=4 797 B9R0.2 CCCCCSC[C@@H](C)O 62a_100009817552_100000210326 [0,0,1,0,0,0|2,0,1]=4 798 B9R0.2 CCCCCSC[N+](=O)[O-] 62a_100000210326_100000761209 [0,0,1,0,0,0|2,0,1]=4 799 B9R0.2 CCCCNCCC(=O)C 7a_106832991798_100000053229 [0,0,1,0,0,0|2,0,0]=3 800 B9R0.2 CCCCNCCC(=O)N 2230a_100000102301_100000744528 [0,0,1,0,0,0|2,0,0]=3 801 B9R0.2 CCCCNCCC(=O)N 7a_106832991798_100000744528 [0,0,1,0,0,0|2,0,0]=3 802 B9R0.2 CCCCNCCC(C)O 2230a_100000102301_100012276601 [0,0,1,0,0,0|2,0,1]=4 803 B9R0.2 CCCCNCCC(C)O 2230a_200000755665_100000210211 [0,0,1,0,0,0|2,0,1]=4 804 B9R0.2 CCCCNCCC(C)O 7a_106832991798_100012276601 [0,0,1,0,0,0|2,0,1]=4 805 B9R0.2 CCCCNOCC(=O)O 269956a_100000106656_100000210211 [0,0,1,0,0,0|2,0,0]=3 806 B9R0.2 CCCCOCCC(=O)C 1458a_100000070787_100000743108 [0,0,1,0,0,0|2,0,0]=3 807 B9R0.2 CCCCOCCC(=O)C 34a_100000759926_100000210210 [0,0,1,0,0,0|2,0,0]=3 808 B9R0.2 CCCCOCCC(=O)C 7a_100000210227_100000053229 [0,0,1,0,0,0|2,0,0]=3 809 B9R0.2 CCCCOCCC(=O)C 7a_100000759926_100000210211 [0,0,1,0,0,0|2,0,0]=3 810 B9R0.2 CCCCOCCC(=O)N 34a_100000210227_100000731001 [0,0,1,0,0,0|2,0,0]=3 811 B9R0.2 CCCCOCCC(=O)N 34a_100000757172_100000210210 [0,0,1,0,0,0|2,0,0]=3 812 B9R0.2 CCCCOCCC(=O)N 7a_100000210227_100000744528 [0,0,1,0,0,0|2,0,0]=3 813 B9R0.2 CCCCOCCC(=O)N 7a_100000757172_100000210211 [0,0,1,0,0,0|2,0,0]=3 814 B9R0.2 CCCCOCCC(C)O 34a_100000210227_100012276601 [0,0,1,0,0,0|2,0,1]=4 815 B9R0.2 CCCCOCCC(C)O 7a_100000210227_100012276601 [0,0,1,0,0,0|2,0,1]=4 816 B9R0.2 CCCCOCOC(=O)C 34a_100000210227_100009813279 [0,0,1,0,0,0|3,0,0]=4 817 B9R0.2 CCCCSCCC(=O)C 62a_100000053229_100000210210 [0,0,1,0,0,0|2,0,0]=3 818 B9R0.2 CCCCSCCC(=O)C 62a_100000210211_100000053229 [0,0,1,0,0,0|2,0,0]=3 819 B9R0.2 CCCCSCCC(=O)N 62a_100000210211_100000744528 [0,0,1,0,0,0|2,0,0]=3 820 B9R0.2 CCCCSCCC(=O)N 62a_100000744528_100000210210 [0,0,1,0,0,0|2,0,0]=3 821 B9R0.2 CCCCSCCC(C)O 62a_100000210211_100012276601 [0,0,1,0,0,0|2,0,1]=4 822 B9R0.2 CCCCSCCC(C)O 62a_100012276601_100000210210 [0,0,1,0,0,0|2,0,1]=4 823 B9R0.2 CCCCSCOC(=O)C 62a_100000076356_100000210210 [0,0,1,0,0,0|3,0,0]=4 824 B9R0.2 CCCCSCOC(=O)C 62a_100000210211_100000076356 [0,0,1,0,0,0|3,0,0]=4 825 B9R0.2 CCCNCCCC(=O)N 34a_100000739312_100000210303 [0,0,1,0,0,0|2,0,0]=3 826 B9R0.2 CCCNCCCS(=O)C 2230a_200000753449_100000210303 [0,0,1,0,0,0|3,0,0]=4 827 B9R0.2 CCCNCCNC(=O)C 2230a_100000209853_100000210303 [0,0,1,0,0,0|3,0,0]=4 828 B9R0.2 CCCNCCNC(=O)N 34a_100020590234_100000210303 [0,0,1,0,0,0|3,0,0]=4 829 B9R0.2 CCCOCCCC(=O)C 34a_100000210258_100000685027 [0,0,1,0,0,0|2,0,0]=3 830 B9R0.2 CCCOCCCC(=O)C 34a_100000759063_100000210303 [0,0,1,0,0,0|2,0,0]=3 831 B9R0.2 CCCOCCCC(=O)C 7a_100000759063_100000210303 [0,0,1,0,0,0|2,0,0]=3 832 B9R0.2 CCCOCCCC(=O)N 34a_100000210258_100102525003 [0,0,1,0,0,0|2,0,0]=3 833 B9R0.2 CCCOCCCC(C)O 34a_100000210258_200000718107 [0,0,1,0,0,0|2,0,1]=4 834 B9R0.2 CCCOCCC[N+](=O)[O-] 34a_200000037920_100000210303 [0,0,1,0,0,0|2,0,1]=4 835 B9R0.2 CCCOCCNC(=O)C 1626a_100161115042_100015343762 [0,0,1,0,0,0|3,0,0]=4 836 B9R0.2 CCCOCCNC(=O)C 240690a_100161115042_100015343762 [0,0,1,0,0,0|3,0,0]=4 837 B9R0.2 CCCOCCNC(=O)C 34a_100000158858_100000210303 [0,0,1,0,0,0|3,0,0]=4 838 B9R0.2 CCCOCCNC(=O)C 527a_100161115042_100103153847 [0,0,1,0,0,0|3,0,0]=4 839 B9R0.2 CCCOCCNC(=O)N 34a_100000181757_100000210303 [0,0,1,0,0,0|3,0,0]=4 840 B9R0.2 CCCOCCOC(=O)C 34a_100000210258_100009814007 [0,0,1,0,0,0|3,0,0]=4 841 B9R0.2 CCCOCCOC(=O)N 34a_100000210258_200011214921 [0,0,1,0,0,0|3,0,0]=4 842 B9R0.2 CCCOCCOC(=O)N 7a_100000766696_100000210303 [0,0,1,0,0,0|3,0,0]=4 843 B9R0.2 CCCSCCCC(=O)C 62a_100000210303_100011215641 [0,0,1,0,0,0|2,0,0]=3 844 B9R0.2 CCCSCCCC(=O)C 62a_100011215641_100000210303 [0,0,1,0,0,0|2,0,0]=3 845 B9R0.2 CCCSCCCC(=O)N 62a_100000210303_100102525003 [0,0,1,0,0,0|2,0,0]=3 846 B9R0.2 CCCSCCCC(=O)N 62a_100102525003_100000210303 [0,0,1,0,0,0|2,0,0]=3 847 B9R0.2 CCCSCCCC(C)O 62a_100000210303_200000718107 [0,0,1,0,0,0|2,0,1]=4 848 B9R0.2 CCCSCCCC(C)O 62a_200000718107_100000210303 [0,0,1,0,0,0|2,0,1]=4 849 B9R0.2 CCCSCCNC(=O)C 11a_100020603323_100015343762 [0,0,1,0,0,0|3,0,0]=4 850 B9R0.2 CCCSCCNC(=O)C 240690a_100020603323_100015343762 [0,0,1,0,0,0|3,0,0]=4 851 B9R0.2 CCCSCCNC(=O)C 527a_100020603323_100103153847 [0,0,1,0,0,0|3,0,0]=4 852 B9R0.2 CCCSCCNC(=O)C 62a_100000189650_100000210303 [0,0,1,0,0,0|3,0,0]=4 853 B9R0.2 CCCSCCNC(=O)C 62a_100000210303_100000189650 [0,0,1,0,0,0|3,0,0]=4 854 B9R0.2 CCCSCCNC(=O)N 62a_100000210303_200000034859 [0,0,1,0,0,0|3,0,0]=4 855 B9R0.2 CCCSCCNC(=O)N 62a_200000034859_100000210303 [0,0,1,0,0,0|3,0,0]=4 856 B9R0.2 CCCSCCOC(=O)C 62a_100000210303_100009814007 [0,0,1,0,0,0|3,0,0]=4 857 B9R0.2 CCCSCCOC(=O)C 62a_100009814007_100000210303 [0,0,1,0,0,0|3,0,0]=4 858 B9R0.2 CCCSCCOC(=O)N 62a_100000210303_200011214921 [0,0,1,0,0,0|3,0,0]=4 859 B9R0.2 CCCSCCOC(=O)N 62a_200011214921_100000210303 [0,0,1,0,0,0|3,0,0]=4 860 B9R0.2 CCNCCCCB(O)O 2230a_100015525214_200009817182 [0,0,1,0,0,0|2,0,1]=4 861 B9R0.2 CCNCCCCC(=O)N 34a_100000696515_100000210202 [0,0,1,0,0,0|2,0,0]=3 862 B9R0.2 CCNCCCNC(=O)C 34a_100000736810_100000210202 [0,0,1,0,0,0|3,0,0]=4 863 B9R0.2 CCNCCCSC(=O)C 2230a_100015525214_100000038929 [0,0,1,0,0,0|3,0,0]=4 864 B9R0.2 CCNCCOCC(=O)N 2230a_100015525214_100000076697 [0,0,1,0,0,0|3,0,0]=4 865 B9R0.2 CCNCCOCC(=O)O 269956a_100000700818_100000210202 [0,0,1,0,0,0|2,0,0]=3 866 B9R0.2 CCOCCCCB(O)O 34a_100121572206_200009817182 [0,0,1,0,0,0|2,0,1]=4 867 B9R0.2 CCOCCCCC(=O)C 34a_100121572206_100009817362 [0,0,1,0,0,0|2,0,0]=3 868 B9R0.2 CCOCCCCC(=O)N 34a_100012022536_100000210202 [0,0,1,0,0,0|2,0,0]=3 869 B9R0.2 CCOCCCCC(=O)N 7a_100012022536_100000210202 [0,0,1,0,0,0|2,0,0]=3 870 B9R0.2 CCOCCCC[N+](=O)[O-] 34a_200015379883_100000210202 [0,0,1,0,0,0|2,0,1]=4 871 B9R0.2 CCOCCCC[N+](=O)[O-] 7a_200015379883_100000210202 [0,0,1,0,0,0|2,0,1]=4 872 B9R0.2 CCOCCCNC(=O)C 11a_100000210961_100015343762 [0,0,1,0,0,0|3,0,0]=4 873 B9R0.2 CCOCCCNC(=O)C 1626a_100000210961_100015343762 [0,0,1,0,0,0|3,0,0]=4 874 B9R0.2 CCOCCCNC(=O)C 240690a_100000210961_100015343762 [0,0,1,0,0,0|3,0,0]=4 875 B9R0.2 CCOCCCNC(=O)C 34a_100000752032_100000210202 [0,0,1,0,0,0|3,0,0]=4 876 B9R0.2 CCOCCCNC(=O)C 527a_100000210961_100103153847 [0,0,1,0,0,0|3,0,0]=4 877 B9R0.2 CCOCCCOC(=O)C 34a_100121572206_100000042594 [0,0,1,0,0,0|3,0,0]=4 878 B9R0.2 CCOCCCSC(=O)C 34a_100121572206_100000038929 [0,0,1,0,0,0|3,0,0]=4 879 B9R0.2 CCOCCNCC(=O)N 2230a_100000711301_100011215890 [0,0,1,0,0,0|3,0,0]=4 880 B9R0.2 CCOCCNCC(=O)N 2230a_102516460346_100000747473 [0,0,1,0,0,0|3,0,0]=4 881 B9R0.2 CCOCCNCC(=O)N 34a_102516460346_100000187820 [0,0,1,0,0,0|3,0,0]=4 882 B9R0.2 CCOCCNCC(=O)O 269956a_100016091260_100000210147 [0,0,1,0,0,0|2,0,0]=3 883 B9R0.2 CCOCCNCC(=O)[O-] 34a_102516460346_100020667443 [0,0,1,0,0,0|2,0,1]=4 884 B9R0.2 CCOCCOCC(=O)C 34a_100000211253_100000210147 [0,0,1,0,0,0|3,0,0]=4 885 B9R0.2 CCOCCOCC(=O)N 34a_100000210136_100000187820 [0,0,1,0,0,0|3,0,0]=4 886 B9R0.2 CCOCCOCC(=O)N 34a_100121572206_100000076697 [0,0,1,0,0,0|3,0,0]=4 887 B9R0.2 CCOCCOCC(=O)N 7a_100000210136_100000187820 [0,0,1,0,0,0|3,0,0]=4 888 B9R0.2 CCOCCOCC(=O)[O-] 34a_100000210136_100020667443 [0,0,1,0,0,0|2,0,1]=4 889 B9R0.2 CCOCCSCC(=O)N 62a_100000210147_100000747473 [0,0,1,0,0,0|3,0,0]=4 890 B9R0.2 CCOCCSCC(=O)N 62a_100000747473_100011215890 [0,0,1,0,0,0|3,0,0]=4 891 B9R0.2 CCOCCSCC(=O)[O-] 62a_100000210147_100020667443 [0,0,1,0,0,0|2,0,1]=4 892 B9R0.2 CCOCCSCC(=O)[O-] 62a_100020667443_100011215890 [0,0,1,0,0,0|2,0,1]=4 893 B9R0.2 CCOCNOCC(=O)O 269956a_100000106656_100000739092 [0,0,1,0,0,0|3,0,0]=4 894 B9R0.2 CCOCSCCC(=O)C 62a_100000053229_100000739092 [0,0,1,0,0,0|3,0,0]=4 895 B9R0.2 CCOCSCCC(=O)C 62a_100000739092_100000053229 [0,0,1,0,0,0|3,0,0]=4 896 B9R0.2 CCOCSCCC(=O)N 62a_100000739092_100000744528 [0,0,1,0,0,0|3,0,0]=4 897 B9R0.2 CCOCSCCC(=O)N 62a_100000744528_100000739092 [0,0,1,0,0,0|3,0,0]=4 898 B9R0.2 CCSCCCCB(O)O 62a_100000210202_200009817182 [0,0,1,0,0,0|2,0,1]=4 899 B9R0.2 CCSCCCCB(O)O 62a_200009817182_100000210202 [0,0,1,0,0,0|2,0,1]=4 900 B9R0.2 CCSCCCCC(=O)C 62a_100000210202_100000735457 [0,0,1,0,0,0|2,0,0]=3 901 B9R0.2 CCSCCCCC(=O)C 62a_100000735457_100000210202 [0,0,1,0,0,0|2,0,0]=3 902 B9R0.2 CCSCCCOC(=O)C 62a_100000042594_100000210202 [0,0,1,0,0,0|3,0,0]=4 903 B9R0.2 CCSCCCOC(=O)C 62a_100000210202_100000042594 [0,0,1,0,0,0|3,0,0]=4 904 B9R0.2 CCSCCCSC(=O)C 62a_100000038929_100000210202 [0,0,1,0,0,0|3,0,0]=4 905 B9R0.2 CCSCCCSC(=O)C 62a_100000210202_100000038929 [0,0,1,0,0,0|3,0,0]=4 906 B9R0.2 CCSCCNCC(=O)N 2230a_100000106463_100000747473 [0,0,1,0,0,0|3,0,0]=4 907 B9R0.2 CCSCCNCC(=O)N 2230a_100000711301_100000757381 [0,0,1,0,0,0|3,0,0]=4 908 B9R0.2 CCSCCNCC(=O)O 269956a_100016091260_100000757381 [0,0,1,0,0,0|2,0,0]=3 909 B9R0.2 CCSCCOCC(=O)C 34a_100000211253_100000757381 [0,0,1,0,0,0|3,0,0]=4 910 B9R0.2 CCSCCOCC(=O)N 34a_100000212035_100000187820 [0,0,1,0,0,0|3,0,0]=4 911 B9R0.2 CCSCCOCC(=O)N 62a_100000076697_100000210202 [0,0,1,0,0,0|3,0,0]=4 912 B9R0.2 CCSCCOCC(=O)N 62a_100000210202_100000076697 [0,0,1,0,0,0|3,0,0]=4 913 B9R0.2 CCSCCOCC(=O)N 7a_100000212035_100000187820 [0,0,1,0,0,0|3,0,0]=4 914 B9R0.2 CCSCCOCC(=O)[O-] 34a_100000212035_100020667443 [0,0,1,0,0,0|2,0,1]=4 915 B9R0.2 CCSCCSCC(=O)N 62a_100000747473_100000757381 [0,0,1,0,0,0|3,0,0]=4 916 B9R0.2 CCSCCSCC(=O)N 62a_100000757381_100000747473 [0,0,1,0,0,0|3,0,0]=4 917 B9R0.2 CCSCCSCC(=O)[O-] 62a_100000757381_100020667443 [0,0,1,0,0,0|2,0,1]=4 918 B9R0.2 CCSCCSCC(=O)[O-] 62a_100020667443_100000757381 [0,0,1,0,0,0|2,0,1]=4 919 B9R0.2 CNCCCCCB(O)O 2230a_106832991635_200009817188 [0,0,1,0,0,0|2,0,1]=4 920 B9R0.2 CNCCCCCB(O)O 34a_100102657272_200009817188 [0,0,1,0,0,0|2,0,1]=4 921 B9R0.2 CNCCCCCB(O)O 7a_106832991635_200009817188 [0,0,1,0,0,0|2,0,1]=4 922 B9R0.2 CNCCCCCC(=O)N 2230a_106832991635_100009817443 [0,0,1,0,0,0|2,0,0]=3 923 B9R0.2 CNCCCCCC(=O)N 34a_100102657272_100009817443 [0,0,1,0,0,0|2,0,0]=3 924 B9R0.2 CNCCCCCC(=O)N 7a_106832991635_100009817443 [0,0,1,0,0,0|2,0,0]=3 925 B9R0.2 CNCCCCNC(=O)C 2230a_200011368371_200000210301 [0,0,1,0,0,0|3,0,0]=4 926 B9R0.2 CNCCCCNC(=O)C 34a_200011368371_200000210301 [0,0,1,0,0,0|3,0,0]=4 927 B9R0.2 CNCCCCOC(=O)C 34a_100102657272_100000033659 [0,0,1,0,0,0|3,0,0]=4 928 B9R0.2 CNCCCCOC(=O)C 7a_106832991635_100000033659 [0,0,1,0,0,0|3,0,0]=4 929 B9R0.2 CNCCCCSC(=O)C 2230a_106832991635_200010402107 [0,0,1,0,0,0|3,0,0]=4 930 B9R0.2 CNCCCCSC(=O)C 34a_100102657272_200010402107 [0,0,1,0,0,0|3,0,0]=4 931 B9R0.2 CNCCCCSC(=O)C 7a_106832991635_200010402107 [0,0,1,0,0,0|3,0,0]=4 932 B9R0.2 CNCCCOCC(=O)N 34a_100000213112_100000187820 [0,0,1,0,0,0|3,0,0]=4 933 B9R0.2 CNCCCOCC(=O)[O-] 34a_100000213112_100020667443 [0,0,1,0,0,0|2,0,1]=4 934 B9R0.2 COCCCCCB(O)O 34a_100138415774_200009817188 [0,0,1,0,0,0|2,0,1]=4 935 B9R0.2 COCCCCCC(=O)C 1458a_100011935119_200000210301 [0,0,1,0,0,0|2,0,0]=3 936 B9R0.2 COCCCCCC(=O)N 34a_100000123541_200000210301 [0,0,1,0,0,0|2,0,0]=3 937 B9R0.2 COCCCCCC(=O)N 34a_100138415774_100009817443 [0,0,1,0,0,0|2,0,0]=3 938 B9R0.2 COCCCCCC(=O)N 7a_100000123541_200000210301 [0,0,1,0,0,0|2,0,0]=3 939 B9R0.2 COCCCCCC(=O)[13CH3] 1458a_100011935119_200025704644 [0,0,1,0,0,0|2,0,0]=3 940 B9R0.2 COCCCCCC(=O)[O-] 7a_100102619762_200000210301 [0,0,1,0,0,0|1,0,1]=3 941 B9R0.2 COCCCCOC(=O)C 34a_100000073216_200000210301 [0,0,1,0,0,0|3,0,0]=4 942 B9R0.2 COCCCCOC(=O)C 34a_100138415774_100000033659 [0,0,1,0,0,0|3,0,0]=4 943 B9R0.2 COCCCCOC(=O)C 7a_100000073216_200000210301 [0,0,1,0,0,0|3,0,0]=4 944 B9R0.2 COCCCCSC(=O)C 34a_100138415774_200010402107 [0,0,1,0,0,0|3,0,0]=4 945 B9R0.2 COCCCNCC(=O)N 2230a_100000711301_100000740836 [0,0,1,0,0,0|3,0,0]=4 946 B9R0.2 COCCCNCC(=O)N 34a_100150723488_100000187820 [0,0,1,0,0,0|3,0,0]=4 947 B9R0.2 COCCCNCC(=O)O 269956a_100016091260_100000740836 [0,0,1,0,0,0|2,0,0]=3 948 B9R0.2 COCCCNCC(=O)[O-] 34a_100150723488_100020667443 [0,0,1,0,0,0|2,0,1]=4 949 B9R0.2 COCCCOCC(=O)C 34a_100000211253_100000740836 [0,0,1,0,0,0|3,0,0]=4 950 B9R0.2 COCCCOCC(=O)N 34a_100000740835_100000187820 [0,0,1,0,0,0|3,0,0]=4 951 B9R0.2 COCCCOCC(=O)[O-] 34a_100000740835_100020667443 [0,0,1,0,0,0|2,0,1]=4 952 B9R0.2 COCCCSCC(=O)N 62a_100000709357_100000747473 [0,0,1,0,0,0|3,0,0]=4 953 B9R0.2 COCCCSCC(=O)N 62a_100000747473_100000709357 [0,0,1,0,0,0|3,0,0]=4 954 B9R0.2 COCCCSCC(=O)[O-] 62a_100000709357_100020667443 [0,0,1,0,0,0|2,0,1]=4 955 B9R0.2 COCCCSCC(=O)[O-] 62a_100020667443_100000709357 [0,0,1,0,0,0|2,0,1]=4 956 B9R0.2 COCCNCCC(=O)N 2230a_100000209980_100000744528 [0,0,1,0,0,0|3,0,0]=4 957 B9R0.2 COCCNOCC(=O)O 269956a_100000106656_100000233755 [0,0,1,0,0,0|3,0,0]=4 958 B9R0.2 COCCOCCC(=O)C 1458a_100000070787_100000695917 [0,0,1,0,0,0|3,0,0]=4 959 B9R0.2 COCCOCCC(=O)C 1458a_100000745395_200000210301 [0,0,1,0,0,0|3,0,0]=4 960 B9R0.2 COCCOCCC(=O)C 34a_100000759926_100011201679 [0,0,1,0,0,0|3,0,0]=4 961 B9R0.2 COCCOCCC(=O)C 7a_100000759926_100000233755 [0,0,1,0,0,0|3,0,0]=4 962 B9R0.2 COCCOCCC(=O)N 34a_100000210237_100000731001 [0,0,1,0,0,0|3,0,0]=4 963 B9R0.2 COCCOCCC(=O)N 34a_100000757172_100011201679 [0,0,1,0,0,0|3,0,0]=4 964 B9R0.2 COCCOCCC(=O)N 7a_100000757172_100000233755 [0,0,1,0,0,0|3,0,0]=4 965 B9R0.2 COCCOCCC(=O)[13CH3] 1458a_100000745395_200025704644 [0,0,1,0,0,0|3,0,0]=4 966 B9R0.2 COCCSCCC(=O)C 62a_100000053229_100000233755 [0,0,1,0,0,0|3,0,0]=4 967 B9R0.2 COCCSCCC(=O)C 62a_100000233755_100000053229 [0,0,1,0,0,0|3,0,0]=4 968 B9R0.2 COCCSCCC(=O)N 62a_100000233755_100000744528 [0,0,1,0,0,0|3,0,0]=4 969 B9R0.2 COCCSCCC(=O)N 62a_100000744528_100000233755 [0,0,1,0,0,0|3,0,0]=4 970 B9R0.2 COCSCCCC(=O)C 62a_100000766300_100011215641 [0,0,1,0,0,0|3,0,0]=4 971 B9R0.2 COCSCCCC(=O)C 62a_100011215641_100000766300 [0,0,1,0,0,0|3,0,0]=4 972 B9R0.2 COCSCCCC(=O)N 62a_100000766300_100102525003 [0,0,1,0,0,0|3,0,0]=4 973 B9R0.2 COCSCCCC(=O)N 62a_100102525003_100000766300 [0,0,1,0,0,0|3,0,0]=4 974 B9R0.2 CSCCCCCB(O)O 62a_200000210301_200009817188 [0,0,1,0,0,0|2,0,1]=4 975 B9R0.2 CSCCCCCB(O)O 62a_200009817188_200000210301 [0,0,1,0,0,0|2,0,1]=4 976 B9R0.2 CSCCCCCC(=O)N 62a_100009817443_200000210301 [0,0,1,0,0,0|2,0,0]=3 977 B9R0.2 CSCCCCCC(=O)N 62a_200000210301_100009817443 [0,0,1,0,0,0|2,0,0]=3 978 B9R0.2 CSCCCCOC(=O)C 62a_100000033659_200000210301 [0,0,1,0,0,0|3,0,0]=4 979 B9R0.2 CSCCCCOC(=O)C 62a_200000210301_100000033659 [0,0,1,0,0,0|3,0,0]=4 980 B9R0.2 CSCCCCSC(=O)C 62a_200000210301_200010402107 [0,0,1,0,0,0|3,0,0]=4 981 B9R0.2 CSCCCCSC(=O)C 62a_200010402107_200000210301 [0,0,1,0,0,0|3,0,0]=4 982 B9R0.2 CSCCCNCC(=O)N 2230a_100000749238_100000747473 [0,0,1,0,0,0|3,0,0]=4 983 B9R0.2 CSCCCOCC(=O)N 34a_100000690336_100000187820 [0,0,1,0,0,0|3,0,0]=4 984 B9R0.2 CSCCCOCC(=O)N 7a_100000690336_100000187820 [0,0,1,0,0,0|3,0,0]=4 985 B9R0.2 CSCCCOCC(=O)[O-] 34a_100000690336_100020667443 [0,0,1,0,0,0|2,0,1]=4 986 B9R0.2 CSCCNCCC(=O)N 2230a_100020590264_100000744528 [0,0,1,0,0,0|3,0,0]=4 987 B9R0.2 CSCCNOCC(=O)O 269956a_100000106656_100000212216 [0,0,1,0,0,0|3,0,0]=4 988 B9R0.2 CSCCOCCC(=O)C 34a_100000759926_100000212216 [0,0,1,0,0,0|3,0,0]=4 989 B9R0.2 CSCCOCCC(=O)C 7a_100000230434_100000053229 [0,0,1,0,0,0|3,0,0]=4 990 B9R0.2 CSCCOCCC(=O)C 7a_100000759926_100000212216 [0,0,1,0,0,0|3,0,0]=4 991 B9R0.2 CSCCOCCC(=O)N 34a_100000230434_100000731001 [0,0,1,0,0,0|3,0,0]=4 992 B9R0.2 CSCCOCCC(=O)N 34a_100000757172_100000212216 [0,0,1,0,0,0|3,0,0]=4 993 B9R0.2 CSCCOCCC(=O)N 7a_100000230434_100000744528 [0,0,1,0,0,0|3,0,0]=4 994 B9R0.2 CSCCOCCC(=O)N 7a_100000757172_100000212216 [0,0,1,0,0,0|3,0,0]=4 995 B9R0.2 CSCCSCCC(=O)C 62a_100000053229_100000751147 [0,0,1,0,0,0|3,0,0]=4 996 B9R0.2 CSCCSCCC(=O)C 62a_100000212216_100000053229 [0,0,1,0,0,0|3,0,0]=4 997 B9R0.2 CSCCSCCC(=O)N 62a_100000212216_100000744528 [0,0,1,0,0,0|3,0,0]=4 998 B9R0.2 CSCCSCCC(=O)N 62a_100000744528_100000751147 [0,0,1,0,0,0|3,0,0]=4 999 B9R0.2 CSCNCCCC(=O)N 34a_100000739312_100011218213 [0,0,1,0,0,0|3,0,0]=4 1000 B9R0.2 CSCOCCCC(=O)C 34a_100000759063_100011218213 [0,0,1,0,0,0|3,0,0]=4 1001 B9R0.2 CSCSCCCC(=O)C 62a_100011215641_100011218213 [0,0,1,0,0,0|3,0,0]=4 1002 B9R0.2 CSCSCCCC(=O)C 62a_100011218213_100011215641 [0,0,1,0,0,0|3,0,0]=4 1003 B9R0.2 CSCSCCCC(=O)N 62a_100011218213_100102525003 [0,0,1,0,0,0|3,0,0]=4 1004 B9R0.2 CSCSCCCC(=O)N 62a_100102525003_100011218213 [0,0,1,0,0,0|3,0,0]=4 1005 B9R0.2 N#CCCCNCC(=O)O 269956a_100016091260_100000687738 [0,0,1,0,0,0|2,0,1]=4 1006 B9R0.2 NC(=O)CCCCNCF 34a_100000696515_100015361967 [0,0,1,0,0,0|3,0,0]=4 1007 B9R0.2 NC(=O)CCCCOCF 34a_100012022536_100015361967 [0,0,1,0,0,0|3,0,0]=4 1008 B9R0.2 NC(=O)CCCCOCF 7a_100012022536_100015361967 [0,0,1,0,0,0|3,0,0]=4 1009 B9R0.2 NC(=O)CCCNCCF 34a_100000724931_100102525003 [0,0,1,0,0,0|3,0,0]=4 1010 B9R0.2 NC(=O)CCCNCCF 34a_100000739312_100011217306 [0,0,1,0,0,0|3,0,0]=4 1011 B9R0.2 NC(=O)CCCNCCO 34a_100000739312_100000211926 [0,0,1,0,0,0|3,0,0]=4 1012 B9R0.2 NC(=O)CCCNCCO 34a_100016990907_100102525003 [0,0,1,0,0,0|3,0,0]=4 1013 B9R0.2 NC(=O)CCCOCCBr 34a_100000211926_100102525003 [0,0,1,0,0,0|3,0,0]=4 1014 B9R0.2 NC(=O)CCCSCCF 62a_100011217306_100102525003 [0,0,1,0,0,0|3,0,0]=4 1015 B9R0.2 NC(=O)CCCSCCF 62a_100102525003_100011217306 [0,0,1,0,0,0|3,0,0]=4 1016 B9R0.2 NC(=O)CCCSCCO 62a_100000211926_100102525003 [0,0,1,0,0,0|3,0,0]=4 1017 B9R0.2 NC(=O)CCCSCCO 62a_100102525003_100000211926 [0,0,1,0,0,0|3,0,0]=4 1018 B9R0.2 NC(=O)CCNCCCF 2230a_100015189416_100000744528 [0,0,1,0,0,0|3,0,0]=4 1019 B9R0.2 NC(=O)CCNCCCF 34a_100015189416_100000731001 [0,0,1,0,0,0|3,0,0]=4 1020 B9R0.2 NC(=O)CCOCCCBr 34a_100011217188_100000731001 [0,0,1,0,0,0|3,0,0]=4 1021 B9R0.2 NC(=O)CCOCCCCl 34a_100000230001_100000731001 [0,0,1,0,0,0|3,0,0]=4 1022 B9R0.2 NC(=O)CCOCCCF 34a_100000757172_100011934791 [0,0,1,0,0,0|3,0,0]=4 1023 B9R0.2 NC(=O)CCOCCCF 34a_100000759539_100000731001 [0,0,1,0,0,0|3,0,0]=4 1024 B9R0.2 NC(=O)CCOCCCF 7a_100000757172_100011934791 [0,0,1,0,0,0|3,0,0]=4 1025 B9R0.2 NC(=O)CCOCCCO 34a_100000757172_100000230001 [0,0,1,0,0,0|3,0,0]=4 1026 B9R0.2 NC(=O)CCOCCCO 7a_100000757172_100011215043 [0,0,1,0,0,0|3,0,0]=4 1027 B9R0.2 NC(=O)CCSCCCF 62a_100000744528_100011934791 [0,0,1,0,0,0|3,0,0]=4 1028 B9R0.2 NC(=O)CCSCCCF 62a_100011934791_100000744528 [0,0,1,0,0,0|3,0,0]=4 1029 B9R0.2 NC(=O)CCSCCCO 62a_100000744528_100011215043 [0,0,1,0,0,0|3,0,0]=4 1030 B9R0.2 NC(=O)CCSCCCO 62a_100011215043_100000744528 [0,0,1,0,0,0|3,0,0]=4 1031 B9R0.2 NC(=O)CNCCCCF 2230a_100000711301_100000729493 [0,0,1,0,0,0|3,0,0]=4 1032 B9R0.2 NC(=O)CNCCCCO 2230a_100000711301_100000210776 [0,0,1,0,0,0|3,0,0]=4 1033 B9R0.2 NC(=O)CNCCCCO 2230a_100000750430_100000747473 [0,0,1,0,0,0|3,0,0]=4 1034 B9R0.2 NC(=O)CNCCCCO 34a_100000750430_100000187820 [0,0,1,0,0,0|3,0,0]=4 1035 B9R0.2 NC(=O)COCCCCBr 34a_100011216708_100000187820 [0,0,1,0,0,0|3,0,0]=4 1036 B9R0.2 NC(=O)COCCCCCl 34a_100000210776_100000187820 [0,0,1,0,0,0|3,0,0]=4 1037 B9R0.2 NC(=O)COCCCCCl 7a_100000210776_100000187820 [0,0,1,0,0,0|3,0,0]=4 1038 B9R0.2 NC(=O)COCCCCF 34a_100011995726_100000187820 [0,0,1,0,0,0|3,0,0]=4 1039 B9R0.2 NC(=O)COCCCCF 7a_100011995726_100000187820 [0,0,1,0,0,0|3,0,0]=4 1040 B9R0.2 NC(=O)COCCCCI 34a_200012148704_100000187820 [0,0,1,0,0,0|3,0,0]=4 1041 B9R0.2 NC(=O)CSCCCCF 62a_100000729493_100000747473 [0,0,1,0,0,0|3,0,0]=4 1042 B9R0.2 NC(=O)CSCCCCF 62a_100000747473_100000729493 [0,0,1,0,0,0|3,0,0]=4 1043 B9R0.2 NC(=O)CSCCCCO 62a_100000210776_100000747473 [0,0,1,0,0,0|3,0,0]=4 1044 B9R0.2 NC(=O)CSCCCCO 62a_100000747473_100000210776 [0,0,1,0,0,0|3,0,0]=4 1045 B9R0.2 NCCCCOCC(=O)N 34a_100000750430_100000187820 [0,0,1,0,0,0|3,0,0]=4 1046 B9R0.2 NCCCCOCC(=O)[O-] 34a_100000750430_100020667443 [0,0,1,0,0,0|2,0,1]=4 1047 B9R0.2 NCCCOCCC(=O)N 34a_100000182051_100000731001 [0,0,1,0,0,0|3,0,0]=4 1048 B9R0.2 NCCOCCCC(=O)N 34a_100000210304_100102525003 [0,0,1,0,0,0|3,0,0]=4 1049 B9R0.2 O=C(O)CNCCCCF 269956a_100016091260_100000729493 [0,0,1,0,0,0|2,0,0]=3 1050 B9R0.2 O=C(O)CNCCCCO 269956a_100016091260_100000210776 [0,0,1,0,0,0|2,0,0]=3 1051 B9R0.2 O=C(O)COCCNCF 269956a_100000700818_100015361967 [0,0,1,0,0,0|3,0,0]=4 1052 B9R0.2 O=C(O)CONCCCF 269956a_100000106656_100011934791 [0,0,1,0,0,0|3,0,0]=4 1053 B9R0.2 O=C(O)CONCCCO 269956a_100000106656_100011215043 [0,0,1,0,0,0|3,0,0]=4 1054 B9R0.2 O=C([O-])CNCCCCO 34a_100000750430_100020667443 [0,0,1,0,0,0|2,0,1]=4 1055 B9R0.2 O=C([O-])COCCCCBr 34a_100011216708_100020667443 [0,0,1,0,0,0|2,0,1]=4 1056 B9R0.2 O=C([O-])COCCCCCl 34a_100000210776_100020667443 [0,0,1,0,0,0|2,0,1]=4 1057 B9R0.2 O=C([O-])COCCCCF 34a_100011995726_100020667443 [0,0,1,0,0,0|2,0,1]=4 1058 B9R0.2 O=C([O-])COCCCCI 34a_200012148704_100020667443 [0,0,1,0,0,0|2,0,1]=4 1059 B9R0.2 O=C([O-])CSCCCCF 62a_100000729493_100020667443 [0,0,1,0,0,0|2,0,1]=4 1060 B9R0.2 O=C([O-])CSCCCCF 62a_100020667443_100000729493 [0,0,1,0,0,0|2,0,1]=4 1061 B9R0.2 O=C([O-])CSCCCCO 62a_100000210776_100020667443 [0,0,1,0,0,0|2,0,1]=4 1062 B9R0.2 O=C([O-])CSCCCCO 62a_100020667443_100000210776 [0,0,1,0,0,0|2,0,1]=4 1063 B9R0.2 O=CCCCNCC(=O)O 269956a_100016091260_200011292268 [0,0,1,0,0,0|2,0,1]=4 1064 B9R0.2 [13CH3]C(=O)CCCCCCO 1458a_100011996774_200025704644 [0,0,1,0,0,0|2,0,0]=3 1065 B9R0.2 [13CH3]OCCCCCC(=O)N 34a_100000123541_200025704644 [0,0,1,0,0,0|2,0,0]=3 1066 B9R0.2 [13CH3]OCCCCCC(=O)N 7a_100000123541_200025704644 [0,0,1,0,0,0|2,0,0]=3 1067 B9R0.2 [13CH3]OCCCCCC(=O)[O-] 7a_100102619762_200025704644 [0,0,1,0,0,0|1,0,1]=3 1068 B9R0.2 [13CH3]SCCCCCB(O)O 62a_200009817188_200025704644 [0,0,1,0,0,0|2,0,1]=4 1069 B9R0.2 [13CH3]SCCCCCB(O)O 62a_200025704644_200009817188 [0,0,1,0,0,0|2,0,1]=4 1070 B9R0.2 [13CH3]SCCCCCC(=O)N 62a_100009817443_200025704644 [0,0,1,0,0,0|2,0,0]=3 1071 B9R0.2 [13CH3]SCCCCCC(=O)N 62a_200025704644_100009817443 [0,0,1,0,0,0|2,0,0]=3 1072 B9R0.4 C#CCCN(C)CC(=O)O 269956a_100000746989_100000688953 [0,0,1,0,0,0|1,0,2]=4 1073 B9R0.4 C/C=C/CN(C)CC(=O)O 269956a_100000746989_100102629194 [0,0,1,0,0,0|1,0,2]=4 1074 B9R0.4 C=C(C)CN(C)CCCC 2230a_100000207549_100000748629 [0,0,1,0,0,0|3,0,0]=4 1075 B9R0.4 C=C(C)CN(C)CCCC 2230a_100000225649_100000210211 [0,0,1,0,0,0|3,0,0]=4 1076 B9R0.4 C=C(C)CN(C)CCCC 269982a_100000207549_100000748629 [0,0,1,0,0,0|3,0,0]=4 1077 B9R0.4 C=C(C)CN(C)CCCC 269982a_100000225649_100000210211 [0,0,1,0,0,0|3,0,0]=4 1078 B9R0.4 C=C(F)CN(C)CCCC 2230a_100000207549_100009893438 [0,0,1,0,0,0|3,0,0]=4 1079 B9R0.4 C=C(F)CN(C)CCCC 269982a_100000207549_100009893438 [0,0,1,0,0,0|3,0,0]=4 1080 B9R0.4 C=CCCN(C)CC(=O)O 269956a_100000746989_100000754431 [0,0,1,0,0,0|1,0,2]=4 1081 B9R0.4 CC#CCN(C)CC(=O)O 269956a_100000746989_100000748600 [0,0,1,0,0,0|1,0,2]=4 1082 B9R0.4 CCCCC(=O)CC(=O)N 1458a_100000210183_100000187820 [0,0,1,0,0,0|2,0,1]=4 1083 B9R0.4 CCCCC(=O)CC(=O)N 1458a_100134613110_100000210211 [0,0,1,0,0,0|2,0,1]=4 1084 B9R0.4 CCCCC(=O)CC(=O)[O-] 1458a_100000210183_100020667443 [0,0,1,0,0,0|1,0,2]=4 1085 B9R0.4 CCCCC(C)NC(=O)C 11a_100000126638_100015343762 [0,0,1,0,0,0|2,0,0]=3 1086 B9R0.4 CCCCC(C)NC(=O)C 1626a_100000126638_100015343762 [0,0,1,0,0,0|2,0,0]=3 1087 B9R0.4 CCCCC(C)NC(=O)C 240690a_100000126638_100015343762 [0,0,1,0,0,0|2,0,0]=3 1088 B9R0.4 CCCCC(C)NC(=O)C 527a_100000126638_100103153847 [0,0,1,0,0,0|2,0,0]=3 1089 B9R0.4 CCCCN(C)CC(=O)N 2230a_100000207549_100000747473 [0,0,1,0,0,0|2,0,0]=3 1090 B9R0.4 CCCCN(C)CC(=O)N 2230a_100000739694_100000210211 [0,0,1,0,0,0|2,0,0]=3 1091 B9R0.4 CCCCN(C)CC(=O)N 269982a_100000207549_100000187820 [0,0,1,0,0,0|2,0,0]=3 1092 B9R0.4 CCCCN(C)CC(=O)O 269956a_100000746989_100000210211 [0,0,1,0,0,0|1,0,0]=2 1093 B9R0.4 CCCCN(C)CC(=O)[O-] 269982a_100000207549_100020667443 [0,0,1,0,0,0|1,0,1]=3 1094 B9R0.4 CCCCN(C)CC(C)O 2230a_100000207549_100011218427 [0,0,1,0,0,0|2,0,1]=4 1095 B9R0.4 CCCCN(C)CC(C)O 2230a_100000227577_100000210211 [0,0,1,0,0,0|2,0,1]=4 1096 B9R0.4 CCCCN(C)CC(C)O 269982a_100000207549_100011218427 [0,0,1,0,0,0|2,0,1]=4 1097 B9R0.4 CCCCN(C)CC(C)O 269982a_100000227577_100000210211 [0,0,1,0,0,0|2,0,1]=4 1098 B9R0.4 CCCCN(C)C[C@@H](C)O 2230a_100000207549_100009817552 [0,0,1,0,0,0|2,0,1]=4 1099 B9R0.4 CCCCN(C)C[C@@H](C)O 269982a_100000207549_100009817552 [0,0,1,0,0,0|2,0,1]=4 1100 B9R0.4 CCCCN(C)C[N+](=O)[O-] 269982a_100000207549_100000761209 [0,0,1,0,0,0|2,0,1]=4 1101 B9R0.4 CCCSC(C)OC(=O)C 62a_100000210303_100009818208 [0,0,1,0,0,0|3,0,0]=4 1102 B9R0.4 CCCSC(C)OC(=O)C 62a_100009818208_100000210303 [0,0,1,0,0,0|3,0,0]=4 1103 B9R0.4 CCNCC(O)CC(=O)O 269956a_100011218706_100000210202 [0,0,1,0,0,0|2,0,0]=3 1104 B9R0.4 CCOCN(C)CC(=O)O 269956a_100000746989_100000739092 [0,0,1,0,0,0|2,0,0]=3 1105 B9R0.4 CN(CCC#N)CC(=O)O 269956a_100000746989_100011215226 [0,0,1,0,0,0|2,0,1]=4 1106 B9R0.4 CN(CCC#N)CC(=O)O 269956a_100011218032_200000210301 [0,0,1,0,0,0|2,0,1]=4 1107 B9R0.4 CN(CCCF)CC(=O)N 2230a_100000739694_100011934791 [0,0,1,0,0,0|3,0,0]=4 1108 B9R0.4 CN(CCCF)CC(=O)O 269956a_100000746989_100011934791 [0,0,1,0,0,0|2,0,0]=3 1109 B9R0.4 CN(CCCO)CC(=O)N 2230a_100000213112_100000747473 [0,0,1,0,0,0|3,0,0]=4 1110 B9R0.4 CN(CCCO)CC(=O)N 2230a_100000739694_100000230001 [0,0,1,0,0,0|3,0,0]=4 1111 B9R0.4 CN(CCCO)CC(=O)N 269982a_100000213112_100000187820 [0,0,1,0,0,0|3,0,0]=4 1112 B9R0.4 CN(CCCO)CC(=O)O 269956a_100000746989_100011215043 [0,0,1,0,0,0|2,0,0]=3 1113 B9R0.4 CN(CCCO)CC(=O)[O-] 269982a_100000213112_100020667443 [0,0,1,0,0,0|2,0,1]=4 1114 B9R0.4 COCCN(C)CC(=O)N 2230a_100000739694_100011201679 [0,0,1,0,0,0|3,0,0]=4 1115 B9R0.4 COCCN(C)CC(=O)N 2230a_100000743101_100000747473 [0,0,1,0,0,0|3,0,0]=4 1116 B9R0.4 COCCN(C)CC(=O)N 269982a_100000743101_100000187820 [0,0,1,0,0,0|3,0,0]=4 1117 B9R0.4 COCCN(C)CC(=O)O 269956a_100000746989_100000233755 [0,0,1,0,0,0|2,0,0]=3 1118 B9R0.4 COCCN(C)CC(=O)[O-] 269982a_100000743101_100020667443 [0,0,1,0,0,0|2,0,1]=4 1119 B9R0.4 CSCCN(C)CC(=O)N 2230a_100000686725_100000747473 [0,0,1,0,0,0|3,0,0]=4 1120 B9R0.4 CSCCN(C)CC(=O)N 2230a_100000739694_100000751147 [0,0,1,0,0,0|3,0,0]=4 1121 B9R0.4 CSCCN(C)CC(=O)N 269982a_100000686725_100000187820 [0,0,1,0,0,0|3,0,0]=4 1122 B9R0.4 CSCCN(C)CC(=O)O 269956a_100000746989_100000212216 [0,0,1,0,0,0|2,0,0]=3 1123 B9R0.4 CSCCN(C)CC(=O)[O-] 269982a_100000686725_100020667443 [0,0,1,0,0,0|2,0,1]=4 1124 B9R0.4 O=C(O)CC(O)CNCF 269956a_100011218706_100015361967 [0,0,1,0,0,0|3,0,0]=4 1125 B9R0.4 [13CH3]N(CCC#N)CC(=O)O 269956a_100011218032_200025704644 [0,0,1,0,0,0|2,0,1]=4 1126 B9R0.14 C#CCN(CC)CC(=O)O 269956a_100000746405_100000184674 [0,0,1,0,0,0|1,0,2]=4 1127 B9R0.14 C#CCN(CC)CC(=O)O 269956a_100011236498_100000210202 [0,0,1,0,0,0|1,0,2]=4 1128 B9R0.14 C=C(C)CN(CC)CCC 2230a_100000211296_100000210303 [0,0,1,0,0,0|3,0,0]=4 1129 B9R0.14 C=C(C)CN(CC)CCC 2230a_100000226822_100000748629 [0,0,1,0,0,0|3,0,0]=4 1130 B9R0.14 C=C(C)CN(CC)CCC 269982a_100000211296_100000210303 [0,0,1,0,0,0|3,0,0]=4 1131 B9R0.14 C=C(C)CN(CC)CCC 269982a_100000226822_100000748629 [0,0,1,0,0,0|3,0,0]=4 1132 B9R0.14 C=C(F)CN(CC)CCC 2230a_100000226822_100009893438 [0,0,1,0,0,0|3,0,0]=4 1133 B9R0.14 C=C(F)CN(CC)CCC 269982a_100000226822_100009893438 [0,0,1,0,0,0|3,0,0]=4 1134 B9R0.14 C=CCN(CC)CC(=O)O 269956a_100000744315_100000210202 [0,0,1,0,0,0|1,0,2]=4 1135 B9R0.14 C=CCN(CC)CC(=O)O 269956a_100000746405_100000210623 [0,0,1,0,0,0|1,0,2]=4 1136 B9R0.14 CCC(COC)NC(=O)C 11a_100000757820_100015343762 [0,0,1,0,0,0|3,0,0]=4 1137 B9R0.14 CCC(COC)NC(=O)C 1626a_100000757820_100015343762 [0,0,1,0,0,0|3,0,0]=4 1138 B9R0.14 CCC(COC)NC(=O)C 240690a_100000757820_100015343762 [0,0,1,0,0,0|3,0,0]=4 1139 B9R0.14 CCC(COC)NC(=O)C 527a_100000757820_100103153847 [0,0,1,0,0,0|3,0,0]=4 1140 B9R0.14 CCCC(CC)NC(=O)C 11a_100000747048_100015343762 [0,0,1,0,0,0|2,0,0]=3 1141 B9R0.14 CCCC(CC)NC(=O)C 1626a_100000747048_100015343762 [0,0,1,0,0,0|2,0,0]=3 1142 B9R0.14 CCCC(CC)NC(=O)C 240690a_100000747048_100015343762 [0,0,1,0,0,0|2,0,0]=3 1143 B9R0.14 CCCC(CC)NC(=O)C 527a_100000747048_100103153847 [0,0,1,0,0,0|2,0,0]=3 1144 B9R0.14 CCCN(CC)CC(=O)N 2230a_100000226822_100000747473 [0,0,1,0,0,0|2,0,0]=3 1145 B9R0.14 CCCN(CC)CC(=O)N 269982a_100000226822_100000187820 [0,0,1,0,0,0|2,0,0]=3 1146 B9R0.14 CCCN(CC)CC(=O)O 269956a_100000746405_100000210207 [0,0,1,0,0,0|1,0,0]=2 1147 B9R0.14 CCCN(CC)CC(=O)[O-] 269982a_100000226822_100020667443 [0,0,1,0,0,0|1,0,1]=3 1148 B9R0.14 CCCN(CC)CC(C)O 2230a_100000226822_100011218427 [0,0,1,0,0,0|2,0,1]=4 1149 B9R0.14 CCCN(CC)CC(C)O 269982a_100000226822_100011218427 [0,0,1,0,0,0|2,0,1]=4 1150 B9R0.14 CCCN(CC)C[C@@H](C)O 2230a_100000226822_100009817552 [0,0,1,0,0,0|2,0,1]=4 1151 B9R0.14 CCCN(CC)C[C@@H](C)O 269982a_100000226822_100009817552 [0,0,1,0,0,0|2,0,1]=4 1152 B9R0.14 CCCN(CC)C[C@H](C)O 2230a_100000729506_100000210303 [0,0,1,0,0,0|2,0,1]=4 1153 B9R0.14 CCCN(CC)C[C@H](C)O 269982a_100000729506_100000210303 [0,0,1,0,0,0|2,0,1]=4 1154 B9R0.14 CCCN(CC)C[N+](=O)[O-] 269982a_100000226822_100000761209 [0,0,1,0,0,0|2,0,1]=4 1155 B9R0.14 CCCN(CO)CC(=O)[O-] 269956a_100016989150_100000210207 [0,0,1,0,0,0|2,0,1]=4 1156 B9R0.14 CCC[C@@H](CO)NC(=O)C 240690a_100000732646_100015343762 [0,0,1,0,0,0|3,0,0]=4 1157 B9R0.14 CCC[C@@H](CO)NC(=O)C 527a_100000732646_100103153847 [0,0,1,0,0,0|3,0,0]=4 1158 B9R0.14 CCN(CC#N)CC(=O)O 269956a_100000746405_100011215382 [0,0,1,0,0,0|2,0,1]=4 1159 B9R0.14 CCN(CC=O)CC(=O)O 269956a_100000746405_200015260668 [0,0,1,0,0,0|2,0,1]=4 1160 B9R0.14 CCN(CCF)CC(=O)O 269956a_100000746405_100011217306 [0,0,1,0,0,0|2,0,0]=3 1161 B9R0.14 CCN(CCO)CC(=O)N 2230a_100000210973_100000747473 [0,0,1,0,0,0|3,0,0]=4 1162 B9R0.14 CCN(CCO)CC(=O)N 269982a_100000210973_100000187820 [0,0,1,0,0,0|3,0,0]=4 1163 B9R0.14 CCN(CCO)CC(=O)O 269956a_100000746405_100000211926 [0,0,1,0,0,0|2,0,0]=3 1164 B9R0.14 CCN(CCO)CC(=O)O 269956a_100000747938_100000210202 [0,0,1,0,0,0|2,0,0]=3 1165 B9R0.14 CCN(CCO)CC(=O)[O-] 269982a_100000210973_100020667443 [0,0,1,0,0,0|2,0,1]=4 1166 B9R0.14 CCN(COC)CC(=O)O 269956a_100000746405_100000766300 [0,0,1,0,0,0|2,0,0]=3 1167 B9R0.14 CCN(CSC)CC(=O)O 269956a_100000746405_100011218213 [0,0,1,0,0,0|2,0,0]=3 1168 B9R0.14 CCN[C@H](CC)CC(=O)O 269956a_100016995926_100000210202 [0,0,1,0,0,0|1,0,0]=2 1169 B9R0.14 CCN[C@H](CO)CC(=O)O 269956a_100009816507_100000210202 [0,0,1,0,0,0|2,0,0]=3 1170 B9R0.14 CC[C@H](CC(=O)O)NCF 269956a_100016995926_100015361967 [0,0,1,0,0,0|2,0,0]=3 1171 B9R0.14 O=C(O)CN(CF)CCO 269956a_100000747938_100015361967 [0,0,1,0,0,0|3,0,0]=4 1172 B9R0.14 O=C(O)C[C@@H](CO)NCF 269956a_100009816507_100015361967 [0,0,1,0,0,0|3,0,0]=4 1173 B11R2.10 CN1C[C@H]2CCCC[C@H]2C1 2230a_100015204113_200000210301 [0,0,0,1,0,0|3,0,0]=4 1174 B11R2.10 CN1C[C@H]2CCCC[C@H]2C1 269982a_100015204113_200000210301 [0,0,0,1,0,0|3,0,0]=4 1175 B11R2.10 CN1C[C@H]2CCCC[C@H]2C1 34a_100015204113_200000210301 [0,0,0,1,0,0|3,0,0]=4 1176 B11R2.10 [13CH3]N1C[C@H]2CCCC[C@H]2C1 2230a_100015204113_200025704644 [0,0,0,1,0,0|3,0,0]=4 1177 B11R2.10 [13CH3]N1C[C@H]2CCCC[C@H]2C1 269982a_100015204113_200025704644 [0,0,0,1,0,0|3,0,0]=4 1178 B11R2.10 [13CH3]N1C[C@H]2CCCC[C@H]2C1 34a_100015204113_200025704644 [0,0,0,1,0,0|3,0,0]=4 1179 B11R2.824 CC(=O)N1C2CCC1CC2 11a_100000735658_100015343762 [0,0,0,1,0,0|2,0,0]=3 1180 B11R2.824 CC(=O)N1C2CCC1CC2 1626a_100000735658_100015343762 [0,0,0,1,0,0|2,0,0]=3 1181 B11R2.824 CC(=O)N1C2CCC1CC2 240690a_100000735658_100015343762 [0,0,0,1,0,0|2,0,0]=3 1182 B11R2.824 CC(=O)N1C2CCC1CC2 527a_100000735658_100103153847 [0,0,0,1,0,0|2,0,0]=3 1183 B11R2.824 CN(C)C1C2CCC1CC2 269982a_100102631434_100009813300 [0,0,0,1,0,0|3,0,0]=4 1184 B11R2.860 CC(=O)NC1C2C1COC2 11a_100000702821_100015343762 [0,0,0,1,0,0|3,0,0]=4 1185 B11R2.860 CC(=O)NC1C2C1COC2 240690a_100000702821_100015343762 [0,0,0,1,0,0|3,0,0]=4 1186 B11R2.860 CC(=O)NC1C2C1COC2 527a_100000702821_100103153847 [0,0,0,1,0,0|3,0,0]=4 1187 B11R2.934 C=C(C)CN1CC2CC2C1 2230a_100000741873_100000748629 [0,0,0,1,0,0|3,0,0]=4 1188 B11R2.934 C=C(C)CN1CC2CC2C1 269982a_100000741873_100000748629 [0,0,0,1,0,0|3,0,0]=4 1189 B11R2.934 C=C(C)CN1CC2CC2C1 34a_100000741873_100000748629 [0,0,0,1,0,0|3,0,0]=4 1190 B11R2.934 C=C(F)CN1CC2CC2C1 2230a_100000741873_100009893438 [0,0,0,1,0,0|3,0,0]=4 1191 B11R2.934 C=C(F)CN1CC2CC2C1 269982a_100000741873_100009893438 [0,0,0,1,0,0|3,0,0]=4 1192 B11R2.934 C=C(F)CN1CC2CC2C1 34a_100000741873_100009893438 [0,0,0,1,0,0|3,0,0]=4 1193 B11R2.934 CC(O)CN1CC2CC2C1 2230a_100000741873_100011218427 [0,0,0,1,0,0|2,0,1]=4 1194 B11R2.934 CC(O)CN1CC2CC2C1 269982a_100000741873_100011218427 [0,0,0,1,0,0|2,0,1]=4 1195 B11R2.934 CC(O)CN1CC2CC2C1 34a_100000741873_100011218427 [0,0,0,1,0,0|2,0,1]=4 1196 B11R2.934 C[C@@H](O)CN1CC2CC2C1 2230a_100000741873_100009817552 [0,0,0,1,0,0|2,0,1]=4 1197 B11R2.934 C[C@@H](O)CN1CC2CC2C1 269982a_100000741873_100009817552 [0,0,0,1,0,0|2,0,1]=4 1198 B11R2.934 C[C@@H](O)CN1CC2CC2C1 34a_100000741873_100009817552 [0,0,0,1,0,0|2,0,1]=4 1199 B11R2.934 NC(=O)CN1CC2CC2C1 2230a_100000741873_100000747473 [0,0,0,1,0,0|2,0,0]=3 1200 B11R2.934 NC(=O)CN1CC2CC2C1 269982a_100000741873_100000187820 [0,0,0,1,0,0|2,0,0]=3 1201 B11R2.934 NC(=O)CN1CC2CC2C1 34a_100000741873_100000187820 [0,0,0,1,0,0|2,0,0]=3 1202 B11R2.934 O=C([O-])CN1CC2CC2C1 269982a_100000741873_100020667443 [0,0,0,1,0,0|1,0,1]=3 1203 B11R2.934 O=C([O-])CN1CC2CC2C1 34a_100000741873_100020667443 [0,0,0,1,0,0|1,0,1]=3 1204 B11R2.934 O=[N+]([O-])CN1CC2CC2C1 269982a_100000741873_100000761209 [0,0,0,1,0,0|2,0,1]=4 1205 B11R2.934 O=[N+]([O-])CN1CC2CC2C1 34a_100000741873_100000761209 [0,0,0,1,0,0|2,0,1]=4 1206 B11R2.1852 CC(=O)[C@H]1[C@H]2[C@@H]1CCCC2 1458a_100153394716_200000210301 [0,0,0,1,0,0|1,0,0]=2 1207 B11R2.1852 [13CH3]C(=O)[C@H]1[C@H]2[C@@H]1CCCC2 1458a_100153394716_200025704644 [0,0,0,1,0,0|1,0,0]=2 1208 B9R1.6 CC(=O)C1=CCCCC1 1458a_100000765259_200000210301 [0,0,0,0,1,0|1,0,2]=4 1209 B9R1.6 CC(=O)C1C=CCCC1 1458a_100000070787_100000751183 [0,0,0,0,1,0|1,0,2]=4 1210 B9R1.6 CC(=O)C1CCCCC1 1458a_100000070787_100000210327 [0,0,0,0,1,0|1,0,0]=2 1211 B9R1.6 CC(=O)C1CCCCC1 1458a_100000210647_200000210301 [0,0,0,0,1,0|1,0,0]=2 1212 B9R1.6 CC(=O)C1CCCCO1 1458a_100000748299_200000210301 [0,0,0,0,1,0|2,0,0]=3 1213 B9R1.6 CC(=O)C1CCCOC1 1458a_100000070787_100000693364 [0,0,0,0,1,0|2,0,0]=3 1214 B9R1.6 CC(=O)C1CCCOC1 1458a_100000741522_200000210301 [0,0,0,0,1,0|2,0,0]=3 1215 B9R1.6 CC(=O)C1CCOCC1 1458a_100000070787_100011324220 [0,0,0,0,1,0|2,0,0]=3 1216 B9R1.6 CC(=O)C1CCOCC1 1458a_100000195482_200000210301 [0,0,0,0,1,0|2,0,0]=3 1217 B9R1.6 CC(=O)C1CCSCC1 1458a_100000755232_200000210301 [0,0,0,0,1,0|2,0,0]=3 1218 B9R1.6 CC(=O)C1COCCO1 1458a_100000045528_200000210301 [0,0,0,0,1,0|3,0,0]=4 1219 B9R1.6 CC(=O)C1SCCCS1 1458a_100000028545_200000210301 [0,0,0,0,1,0|3,0,0]=4 1220 B9R1.6 CC(=O)N1CCCOC1 11a_100000131196_100015343762 [0,0,0,0,1,0|3,0,0]=4 1221 B9R1.6 CC(=O)N1CCCOC1 240690a_100000131196_100015343762 [0,0,0,0,1,0|3,0,0]=4 1222 B9R1.6 CC(=O)N1CCOCC1 11a_100015191051_100015343762 [0,0,0,0,1,0|3,0,0]=4 1223 B9R1.6 CC(=O)N1CCOCC1 1626a_100015191051_100015343762 [0,0,0,0,1,0|3,0,0]=4 1224 B9R1.6 CC(=O)N1CCOCC1 240690a_100015191051_100015343762 [0,0,0,0,1,0|3,0,0]=4 1225 B9R1.6 CC(=O)N1CCOCC1 527a_100015191051_100103153847 [0,0,0,0,1,0|3,0,0]=4 1226 B9R1.6 CC(=O)N1CCSCC1 11a_100000737611_100015343762 [0,0,0,0,1,0|3,0,0]=4 1227 B9R1.6 CC(=O)N1CCSCC1 240690a_100000737611_100015343762 [0,0,0,0,1,0|3,0,0]=4 1228 B9R1.6 CC(=O)N1CCSCC1 527a_100000737611_100103153847 [0,0,0,0,1,0|3,0,0]=4 1229 B9R1.6 CC(=O)[C@H]1CC=CCC1 1458a_100009820709_200000210301 [0,0,0,0,1,0|1,0,2]=4 1230 B9R1.6 CN(C)C1CCCCC1 2230a_100000207522_200000210301 [0,0,0,0,1,0|3,0,0]=4 1231 B9R1.6 CN(C)C1CCCCC1 269982a_100000207522_200000210301 [0,0,0,0,1,0|3,0,0]=4 1232 B9R1.6 CN(C)C1CCCCC1 269982a_100102631434_100000210327 [0,0,0,0,1,0|3,0,0]=4 1233 B9R1.6 CN(C)C1CCCCC1 270004a_100102631434_100000210434 [0,0,0,0,1,0|3,0,0]=4 1234 B9R1.6 CN(C)C1CCCCC1 34a_100000207522_200000210301 [0,0,0,0,1,0|3,0,0]=4 1235 B9R1.6 CN([13CH3])C1CCCCC1 2230a_100000207522_200025704644 [0,0,0,0,1,0|3,0,0]=4 1236 B9R1.6 CN([13CH3])C1CCCCC1 269982a_100000207522_200025704644 [0,0,0,0,1,0|3,0,0]=4 1237 B9R1.6 CN([13CH3])C1CCCCC1 34a_100000207522_200025704644 [0,0,0,0,1,0|3,0,0]=4 1238 B9R1.6 [13CH3]C(=O)C1=CCCCC1 1458a_100000765259_200025704644 [0,0,0,0,1,0|1,0,2]=4 1239 B9R1.6 [13CH3]C(=O)C1CCCCC1 1458a_100000210647_200025704644 [0,0,0,0,1,0|1,0,0]=2 1240 B9R1.6 [13CH3]C(=O)C1CCCCO1 1458a_100000748299_200025704644 [0,0,0,0,1,0|2,0,0]=3 1241 B9R1.6 [13CH3]C(=O)C1CCCOC1 1458a_100000741522_200025704644 [0,0,0,0,1,0|2,0,0]=3 1242 B9R1.6 [13CH3]C(=O)C1CCOCC1 1458a_100000195482_200025704644 [0,0,0,0,1,0|2,0,0]=3 1243 B9R1.6 [13CH3]C(=O)C1CCSCC1 1458a_100000755232_200025704644 [0,0,0,0,1,0|2,0,0]=3 1244 B9R1.6 [13CH3]C(=O)C1COCCO1 1458a_100000045528_200025704644 [0,0,0,0,1,0|3,0,0]=4 1245 B9R1.6 [13CH3]C(=O)C1SCCCS1 1458a_100000028545_200025704644 [0,0,0,0,1,0|3,0,0]=4 1246 B9R1.6 [13CH3]C(=O)[C@H]1CC=CCC1 1458a_100009820709_200025704644 [0,0,0,0,1,0|1,0,2]=4 1247 B9R1.13 C=C(C)CN1CCCC1 2230a_100000188435_100000748629 [0,0,0,0,1,0|3,0,0]=4 1248 B9R1.13 C=C(C)CN1CCCC1 269982a_100000188435_100000748629 [0,0,0,0,1,0|3,0,0]=4 1249 B9R1.13 C=C(F)CN1CCCC1 2230a_100000188435_100009893438 [0,0,0,0,1,0|3,0,0]=4 1250 B9R1.13 C=C(F)CN1CCCC1 269982a_100000188435_100009893438 [0,0,0,0,1,0|3,0,0]=4 1251 B9R1.13 CC(=O)C=C1CCCC1 1458a_100000743260_200000210301 [0,0,0,0,1,0|1,0,2]=4 1252 B9R1.13 CC(=O)CC1=CCCC1 1458a_100000050221_200000210301 [0,0,0,0,1,0|1,0,2]=4 1253 B9R1.13 CC(=O)CC1C=CCC1 1458a_100000212241_200000210301 [0,0,0,0,1,0|1,0,2]=4 1254 B9R1.13 CC(=O)CC1CC=CC1 1458a_200000137526_200000210301 [0,0,0,0,1,0|1,0,2]=4 1255 B9R1.13 CC(=O)CC1CCCC1 1458a_100000070787_100000740388 [0,0,0,0,1,0|1,0,0]=2 1256 B9R1.13 CC(=O)CC1CCCC1 1458a_100000210891_200000210301 [0,0,0,0,1,0|1,0,0]=2 1257 B9R1.13 CC(=O)CC1CCCO1 1458a_100000070787_100000203698 [0,0,0,0,1,0|2,0,0]=3 1258 B9R1.13 CC(=O)CC1CCOC1 1458a_100000070787_100000702531 [0,0,0,0,1,0|2,0,0]=3 1259 B9R1.13 CC(=O)CC1CCOC1 1458a_100011218419_200000210301 [0,0,0,0,1,0|2,0,0]=3 1260 B9R1.13 CC(=O)CC1OCCO1 1458a_100000070787_100000755774 [0,0,0,0,1,0|3,0,0]=4 1261 B9R1.13 CC(=O)CN1CCCC1 1458a_100000740243_200000210301 [0,0,0,0,1,0|2,0,0]=3 1262 B9R1.13 CC(=O)NC1CCCC1 11a_100000211070_100015343762 [0,0,0,0,1,0|2,0,0]=3 1263 B9R1.13 CC(=O)NC1CCCC1 1626a_100000211070_100015343762 [0,0,0,0,1,0|2,0,0]=3 1264 B9R1.13 CC(=O)NC1CCCC1 240690a_100000211070_100015343762 [0,0,0,0,1,0|2,0,0]=3 1265 B9R1.13 CC(=O)NC1CCCC1 527a_100000211070_100103153847 [0,0,0,0,1,0|2,0,0]=3 1266 B9R1.13 CC(=O)N[C@@H]1CCOC1 240690a_200015188469_100015343762 [0,0,0,0,1,0|3,0,0]=4 1267 B9R1.13 CC(=O)N[C@@H]1CCOC1 527a_200015188469_100103153847 [0,0,0,0,1,0|3,0,0]=4 1268 B9R1.13 CC(=O)N[C@H]1CCOC1 11a_100015188467_100015343762 [0,0,0,0,1,0|3,0,0]=4 1269 B9R1.13 CC(=O)N[C@H]1CCOC1 1626a_100015188467_100015343762 [0,0,0,0,1,0|3,0,0]=4 1270 B9R1.13 CC(=O)N[C@H]1CCOC1 240690a_100015188467_100015343762 [0,0,0,0,1,0|3,0,0]=4 1271 B9R1.13 CC(=O)N[C@H]1CCOC1 527a_100015188467_100103153847 [0,0,0,0,1,0|3,0,0]=4 1272 B9R1.13 CC(O)CN1CCCC1 2230a_100000188435_100011218427 [0,0,0,0,1,0|2,0,1]=4 1273 B9R1.13 CC(O)CN1CCCC1 269982a_100000188435_100011218427 [0,0,0,0,1,0|2,0,1]=4 1274 B9R1.13 CN(C)CC1CCCC1 2230a_100102631434_100000740388 [0,0,0,0,1,0|3,0,0]=4 1275 B9R1.13 CN(C)CC1CCCC1 269982a_100102631434_100000740388 [0,0,0,0,1,0|3,0,0]=4 1276 B9R1.13 C[C@@H](O)CN1CCCC1 2230a_100000188435_100009817552 [0,0,0,0,1,0|2,0,1]=4 1277 B9R1.13 C[C@@H](O)CN1CCCC1 269982a_100000188435_100009817552 [0,0,0,0,1,0|2,0,1]=4 1278 B9R1.13 NC(=O)CN1CCCC1 2230a_100000188435_100000747473 [0,0,0,0,1,0|2,0,0]=3 1279 B9R1.13 NC(=O)CN1CCCC1 269982a_100000188435_100000187820 [0,0,0,0,1,0|2,0,0]=3 1280 B9R1.13 NC(=O)CN1CCSC1 2230a_100011215254_100000747473 [0,0,0,0,1,0|3,0,0]=4 1281 B9R1.13 NC(=O)CN1CCSC1 269982a_100011215254_100000187820 [0,0,0,0,1,0|3,0,0]=4 1282 B9R1.13 O=C([O-])CN1CCCC1 269982a_100000188435_100020667443 [0,0,0,0,1,0|1,0,1]=3 1283 B9R1.13 O=C([O-])CN1CCSC1 269982a_100011215254_100020667443 [0,0,0,0,1,0|2,0,1]=4 1284 B9R1.13 O=[N+]([O-])CN1CCCC1 269982a_100000188435_100000761209 [0,0,0,0,1,0|2,0,1]=4 1285 B9R1.13 [13CH3]C(=O)C=C1CCCC1 1458a_100000743260_200025704644 [0,0,0,0,1,0|1,0,2]=4 1286 B9R1.13 [13CH3]C(=O)CC1=CCCC1 1458a_100000050221_200025704644 [0,0,0,0,1,0|1,0,2]=4 1287 B9R1.13 [13CH3]C(=O)CC1C=CCC1 1458a_100000212241_200025704644 [0,0,0,0,1,0|1,0,2]=4 1288 B9R1.13 [13CH3]C(=O)CC1CC=CC1 1458a_200000137526_200025704644 [0,0,0,0,1,0|1,0,2]=4 1289 B9R1.13 [13CH3]C(=O)CC1CCCC1 1458a_100000210891_200025704644 [0,0,0,0,1,0|1,0,0]=2 1290 B9R1.13 [13CH3]C(=O)CC1CCOC1 1458a_100011218419_200025704644 [0,0,0,0,1,0|2,0,0]=3 1291 B9R1.13 [13CH3]C(=O)CN1CCCC1 1458a_100000740243_200025704644 [0,0,0,0,1,0|2,0,0]=3 1292 B11R1.91 C=C(C)CNC1CCCCC1 2230a_100000182618_100000748629 [0,0,0,0,0,1|2,0,0]=3 1293 B11R1.91 C=C(C)CNC1CCCCC1 34a_100000182618_100000748629 [0,0,0,0,0,1|2,0,0]=3 1294 B11R1.91 C=C(C)CNC1CCCOC1 2230a_100000719290_100000748629 [0,0,0,0,0,1|3,0,0]=4 1295 B11R1.91 C=C(C)CNC1CCCOC1 34a_100000719290_100000748629 [0,0,0,0,0,1|3,0,0]=4 1296 B11R1.91 C=C(C)CNC1CCOCC1 2230a_100000741149_100000748629 [0,0,0,0,0,1|3,0,0]=4 1297 B11R1.91 C=C(C)CNC1CCOCC1 34a_100000741149_100000748629 [0,0,0,0,0,1|3,0,0]=4 1298 B11R1.91 C=C(C)CNC1CCSCC1 2230a_100000748639_100000748629 [0,0,0,0,0,1|3,0,0]=4 1299 B11R1.91 C=C(C)CNC1CCSCC1 34a_100000748639_100000748629 [0,0,0,0,0,1|3,0,0]=4 1300 B11R1.91 C=C(C)COC1CCCCC1 34a_100000210231_100000748629 [0,0,0,0,0,1|2,0,0]=3 1301 B11R1.91 C=C(C)COC1CCCCC1 34a_100000210245_100000210327 [0,0,0,0,0,1|2,0,0]=3 1302 B11R1.91 C=C(C)COC1CCCCC1 7a_100000210231_100000748629 [0,0,0,0,0,1|2,0,0]=3 1303 B11R1.91 C=C(C)COC1CCCCO1 34a_100000033831_100000748629 [0,0,0,0,0,1|3,0,0]=4 1304 B11R1.91 C=C(C)COC1CCCOC1 34a_100000210245_100000693364 [0,0,0,0,0,1|3,0,0]=4 1305 B11R1.91 C=C(C)COC1CCCOC1 34a_100000754041_100000748629 [0,0,0,0,0,1|3,0,0]=4 1306 B11R1.91 C=C(C)COC1CCCSC1 7a_100015962668_100000748629 [0,0,0,0,0,1|3,0,0]=4 1307 B11R1.91 C=C(C)COC1CCOCC1 34a_100000744328_100000748629 [0,0,0,0,0,1|3,0,0]=4 1308 B11R1.91 C=C(C)COC1CCSCC1 34a_100000210245_100000069128 [0,0,0,0,0,1|3,0,0]=4 1309 B11R1.91 C=C(C)COC1CCSCC1 34a_100000731022_100000748629 [0,0,0,0,0,1|3,0,0]=4 1310 B11R1.91 C=C(C)COC1CCSCC1 7a_100000731022_100000748629 [0,0,0,0,0,1|3,0,0]=4 1311 B11R1.91 C=C(C)CSC1CCCCC1 62a_100000210327_100000211660 [0,0,0,0,0,1|2,0,0]=3 1312 B11R1.91 C=C(C)CSC1CCCCC1 62a_100000748629_100000210327 [0,0,0,0,0,1|2,0,0]=3 1313 B11R1.91 C=C(C)CSC1CCCOC1 62a_100000748629_100000693364 [0,0,0,0,0,1|3,0,0]=4 1314 B11R1.91 C=C(C)CSC1CCOCC1 62a_100000748629_100011324220 [0,0,0,0,0,1|3,0,0]=4 1315 B11R1.91 C=C(C)CSC1CCSCC1 62a_100000748629_100000069128 [0,0,0,0,0,1|3,0,0]=4 1316 B11R1.91 C=C(F)CNC1CCCCC1 2230a_100000182618_100009893438 [0,0,0,0,0,1|2,0,0]=3 1317 B11R1.91 C=C(F)CNC1CCCCC1 34a_100000182618_100009893438 [0,0,0,0,0,1|2,0,0]=3 1318 B11R1.91 C=C(F)CNC1CCCOC1 2230a_100000719290_100009893438 [0,0,0,0,0,1|3,0,0]=4 1319 B11R1.91 C=C(F)CNC1CCCOC1 34a_100000719290_100009893438 [0,0,0,0,0,1|3,0,0]=4 1320 B11R1.91 C=C(F)CNC1CCOCC1 2230a_100000741149_100009893438 [0,0,0,0,0,1|3,0,0]=4 1321 B11R1.91 C=C(F)CNC1CCOCC1 34a_100000741149_100009893438 [0,0,0,0,0,1|3,0,0]=4 1322 B11R1.91 C=C(F)CNC1CCSCC1 2230a_100000748639_100009893438 [0,0,0,0,0,1|3,0,0]=4 1323 B11R1.91 C=C(F)CNC1CCSCC1 34a_100000748639_100009893438 [0,0,0,0,0,1|3,0,0]=4 1324 B11R1.91 C=C(F)COC1CCCCC1 34a_100000210231_100009893438 [0,0,0,0,0,1|2,0,0]=3 1325 B11R1.91 C=C(F)COC1CCCCC1 34a_200010262243_100000210327 [0,0,0,0,0,1|2,0,0]=3 1326 B11R1.91 C=C(F)COC1CCCCC1 7a_100000210231_100000042424 [0,0,0,0,0,1|2,0,0]=3 1327 B11R1.91 C=C(F)COC1CCCCO1 34a_100000033831_100009893438 [0,0,0,0,0,1|3,0,0]=4 1328 B11R1.91 C=C(F)COC1CCCOC1 34a_100000754041_100009893438 [0,0,0,0,0,1|3,0,0]=4 1329 B11R1.91 C=C(F)COC1CCCOC1 34a_200010262243_100000693364 [0,0,0,0,0,1|3,0,0]=4 1330 B11R1.91 C=C(F)COC1CCCSC1 7a_100015962668_100000042424 [0,0,0,0,0,1|3,0,0]=4 1331 B11R1.91 C=C(F)COC1CCOCC1 34a_100000744328_100009893438 [0,0,0,0,0,1|3,0,0]=4 1332 B11R1.91 C=C(F)COC1CCSCC1 34a_100000731022_100009893438 [0,0,0,0,0,1|3,0,0]=4 1333 B11R1.91 C=C(F)COC1CCSCC1 34a_200010262243_100000069128 [0,0,0,0,0,1|3,0,0]=4 1334 B11R1.91 C=C(F)COC1CCSCC1 7a_100000731022_100000042424 [0,0,0,0,0,1|3,0,0]=4 1335 B11R1.91 C=C(F)CSC1CCCCC1 62a_100000042424_100000210327 [0,0,0,0,0,1|2,0,0]=3 1336 B11R1.91 C=C(F)CSC1CCCCC1 62a_100000210327_100000042424 [0,0,0,0,0,1|2,0,0]=3 1337 B11R1.91 C=C(F)CSC1CCCOC1 62a_100000042424_100000693364 [0,0,0,0,0,1|3,0,0]=4 1338 B11R1.91 C=C(F)CSC1CCOCC1 62a_100000042424_100011324220 [0,0,0,0,0,1|3,0,0]=4 1339 B11R1.91 C=C(F)CSC1CCSCC1 62a_100000042424_100000069128 [0,0,0,0,0,1|3,0,0]=4 1340 B11R1.91 CC(=O)C=CC1CCCCC1 1458a_100102566626_200000210301 [0,0,0,0,0,1|1,0,1]=3 1341 B11R1.91 CC(=O)CCC1CCCCC1 1458a_100000070787_100011273959 [0,0,0,0,0,1|1,0,0]=2 1342 B11R1.91 CC(=O)CCC1CCCCC1 1458a_100000211375_200000210301 [0,0,0,0,0,1|1,0,0]=2 1343 B11R1.91 CC(=O)CCC1CCOCC1 1458a_100000070787_100011934994 [0,0,0,0,0,1|2,0,0]=3 1344 B11R1.91 CC(=O)CCC1OCCCO1 1458a_100000070787_100000764188 [0,0,0,0,0,1|3,0,0]=4 1345 B11R1.91 CC(=O)CCN1CCCCC1 1458a_100000070787_100000739454 [0,0,0,0,0,1|2,0,0]=3 1346 B11R1.91 CC(=O)CCN1CCCCC1 1458a_100000743487_200000210301 [0,0,0,0,0,1|2,0,0]=3 1347 B11R1.91 CC(=O)CCN1CCCCO1 1458a_200015184090_200000210301 [0,0,0,0,0,1|3,0,0]=4 1348 B11R1.91 CC(=O)CCN1CCCOC1 269982a_100000131196_100000053229 [0,0,0,0,0,1|3,0,0]=4 1349 B11R1.91 CC(=O)CCN1CCOCC1 1458a_100000070787_100000753993 [0,0,0,0,0,1|3,0,0]=4 1350 B11R1.91 CC(=O)CCN1CCOCC1 1458a_100000749337_200000210301 [0,0,0,0,0,1|3,0,0]=4 1351 B11R1.91 CC(=O)CCN1CCOCC1 269982a_100015191051_100000053229 [0,0,0,0,0,1|3,0,0]=4 1352 B11R1.91 CC(=O)CCN1CCSCC1 269982a_100000737611_100000053229 [0,0,0,0,0,1|3,0,0]=4 1353 B11R1.91 CC(=O)CNC1=NCCCC1 1458a_100000118790_200000210301 [0,0,0,0,0,1|2,0,1]=4 1354 B11R1.91 CC(=O)COC1CCCCC1 1458a_100000070787_100011935260 [0,0,0,0,0,1|1,0,0]=2 1355 B11R1.91 CC(=O)COC1CCCCC1 1458a_100011223303_200000210301 [0,0,0,0,0,1|1,0,0]=2 1356 B11R1.91 CC(=O)COC1CCCCC1 34a_100000211253_100000210327 [0,0,0,0,0,1|1,0,0]=2 1357 B11R1.91 CC(=O)COC1CCCOC1 34a_100000211253_100000693364 [0,0,0,0,0,1|2,0,0]=3 1358 B11R1.91 CC(=O)COC1CCSCC1 34a_100000211253_100000069128 [0,0,0,0,0,1|2,0,0]=3 1359 B11R1.91 CC(=O)NCC1CCCCC1 11a_100000210473_100015343762 [0,0,0,0,0,1|1,0,0]=2 1360 B11R1.91 CC(=O)NCC1CCCCC1 1626a_100000210473_100015343762 [0,0,0,0,0,1|1,0,0]=2 1361 B11R1.91 CC(=O)NCC1CCCCC1 240690a_100000210473_100015343762 [0,0,0,0,0,1|1,0,0]=2 1362 B11R1.91 CC(=O)NCC1CCCCC1 527a_100000210473_100103153847 [0,0,0,0,0,1|1,0,0]=2 1363 B11R1.91 CC(=O)NCC1CCCCO1 11a_100000174945_100015343762 [0,0,0,0,0,1|2,0,0]=3 1364 B11R1.91 CC(=O)NCC1CCCCO1 1626a_100000174945_100015343762 [0,0,0,0,0,1|2,0,0]=3 1365 B11R1.91 CC(=O)NCC1CCCCO1 240690a_100000174945_100015343762 [0,0,0,0,0,1|2,0,0]=3 1366 B11R1.91 CC(=O)NCC1CCCCO1 527a_100000174945_100103153847 [0,0,0,0,0,1|2,0,0]=3 1367 B11R1.91 CC(=O)NCC1CCCOC1 11a_100000720124_100015343762 [0,0,0,0,0,1|2,0,0]=3 1368 B11R1.91 CC(=O)NCC1CCCOC1 1626a_100000720124_100015343762 [0,0,0,0,0,1|2,0,0]=3 1369 B11R1.91 CC(=O)NCC1CCCOC1 240690a_100000720124_100015343762 [0,0,0,0,0,1|2,0,0]=3 1370 B11R1.91 CC(=O)NCC1CCCOC1 527a_100000720124_100103153847 [0,0,0,0,0,1|2,0,0]=3 1371 B11R1.91 CC(=O)NCC1CCOCC1 11a_100000746373_100015343762 [0,0,0,0,0,1|2,0,0]=3 1372 B11R1.91 CC(=O)NCC1CCOCC1 1626a_100000746373_100015343762 [0,0,0,0,0,1|2,0,0]=3 1373 B11R1.91 CC(=O)NCC1CCOCC1 240690a_100000746373_100015343762 [0,0,0,0,0,1|2,0,0]=3 1374 B11R1.91 CC(=O)NCC1CCOCC1 527a_100000746373_100103153847 [0,0,0,0,0,1|2,0,0]=3 1375 B11R1.91 CC(=O)NCC1CCSCC1 11a_100015188806_100015343762 [0,0,0,0,0,1|2,0,0]=3 1376 B11R1.91 CC(=O)NCC1CCSCC1 240690a_100015188806_100015343762 [0,0,0,0,0,1|2,0,0]=3 1377 B11R1.91 CC(=O)NCC1CCSCC1 527a_100015188806_100103153847 [0,0,0,0,0,1|2,0,0]=3 1378 B11R1.91 CC(=O)NC[C@H]1COCCO1 11a_100010981119_100015343762 [0,0,0,0,0,1|3,0,0]=4 1379 B11R1.91 CC(=O)NC[C@H]1COCCO1 1626a_100010981119_100015343762 [0,0,0,0,0,1|3,0,0]=4 1380 B11R1.91 CC(=O)NC[C@H]1COCCO1 240690a_100010981119_100015343762 [0,0,0,0,0,1|3,0,0]=4 1381 B11R1.91 CC(=O)NC[C@H]1COCCO1 527a_100010981119_100103153847 [0,0,0,0,0,1|3,0,0]=4 1382 B11R1.91 CC(=O)NN=C1CCCCC1 4a_100000189765_100000210434 [0,0,0,0,0,1|2,0,1]=4 1383 B11R1.91 CC(=O)NNC1CCCCC1 22a_100000709804_100000070787 [0,0,0,0,0,1|2,0,0]=3 1384 B11R1.91 CC(=O)NNC1CCOCC1 22a_100000687383_100000070787 [0,0,0,0,0,1|3,0,0]=4 1385 B11R1.91 CC(=O)OCN1CCCOC1 269982a_100000131196_100000076356 [0,0,0,0,0,1|3,0,0]=4 1386 B11R1.91 CC(=O)OCN1CCCOC1 34a_100000131196_100009813279 [0,0,0,0,0,1|3,0,0]=4 1387 B11R1.91 CC(=O)OCN1CCOCC1 269982a_100015191051_100000076356 [0,0,0,0,0,1|3,0,0]=4 1388 B11R1.91 CC(=O)OCN1CCOCC1 34a_100015191051_100009813279 [0,0,0,0,0,1|3,0,0]=4 1389 B11R1.91 CC(=O)OCN1CCSCC1 269982a_100000737611_100000076356 [0,0,0,0,0,1|3,0,0]=4 1390 B11R1.91 CC(Br)COC1CCCCC1 34a_100012180447_100000210327 [0,0,0,0,0,1|2,0,1]=4 1391 B11R1.91 CC(C)CNC1CCCCC1 2230a_100000182618_100000210760 [0,0,0,0,0,1|2,0,1]=4 1392 B11R1.91 CC(C)CNC1CCCCC1 270004a_100000182618_100000210432 [0,0,0,0,0,1|2,0,1]=4 1393 B11R1.91 CC(C)CNC1CCCCC1 270004a_100000210953_100000210434 [0,0,0,0,0,1|2,0,1]=4 1394 B11R1.91 CC(C)CNC1CCCCC1 34a_100000182618_100000210624 [0,0,0,0,0,1|2,0,1]=4 1395 B11R1.91 CC(C)CNC1CCCCC1 34a_100000210953_100000210327 [0,0,0,0,0,1|2,0,1]=4 1396 B11R1.91 CC(C)COC1CCCCC1 34a_100000210231_100000210624 [0,0,0,0,0,1|2,0,1]=4 1397 B11R1.91 CC(C)COC1CCCCC1 34a_100000210257_100000210327 [0,0,0,0,0,1|2,0,1]=4 1398 B11R1.91 CC(C)COC1CCCCC1 7a_100000210231_100000210760 [0,0,0,0,0,1|2,0,1]=4 1399 B11R1.91 CC(C)CSC1CCCCC1 62a_100000210327_100000210760 [0,0,0,0,0,1|2,0,1]=4 1400 B11R1.91 CC(C)CSC1CCCCC1 62a_100000210624_100000210327 [0,0,0,0,0,1|2,0,1]=4 1401 B11R1.91 CC(C)NCC1CCCCC1 2230a_100000210473_100000210206 [0,0,0,0,0,1|2,0,1]=4 1402 B11R1.91 CC(C)NCC1CCCCC1 2230a_100138425928_100000211423 [0,0,0,0,0,1|2,0,1]=4 1403 B11R1.91 CC(C)NCC1CCCCC1 34a_100000210473_100000210206 [0,0,0,0,0,1|2,0,1]=4 1404 B11R1.91 CC(C)NCC1CCCCC1 34a_100138425928_100000211423 [0,0,0,0,0,1|2,0,1]=4 1405 B11R1.91 CC(C)OCC1CCCCC1 34a_100000212181_100000210206 [0,0,0,0,0,1|2,0,1]=4 1406 B11R1.91 CC(C)OCC1CCCCC1 34a_100000212225_100000211423 [0,0,0,0,0,1|2,0,1]=4 1407 B11R1.91 CC(C)OCC1CCCCC1 7a_100000212181_100000210206 [0,0,0,0,0,1|2,0,1]=4 1408 B11R1.91 CC(C)SCC1CCCCC1 62a_100000210206_100000211423 [0,0,0,0,0,1|2,0,1]=4 1409 B11R1.91 CC(C)SCC1CCCCC1 62a_100000211423_100000210206 [0,0,0,0,0,1|2,0,1]=4 1410 B11R1.91 CC(F)COC1CCCCC1 34a_100015925927_100000210327 [0,0,0,0,0,1|2,0,1]=4 1411 B11R1.91 CC(O)CNC1CCCCC1 2230a_100000182618_100011218427 [0,0,0,0,0,1|1,0,1]=3 1412 B11R1.91 CC(O)CNC1CCCCC1 270004a_100000210904_100000210434 [0,0,0,0,0,1|1,0,1]=3 1413 B11R1.91 CC(O)CNC1CCCCC1 34a_100000182618_100011218427 [0,0,0,0,0,1|1,0,1]=3 1414 B11R1.91 CC(O)CNC1CCCCC1 34a_100000210904_100000210327 [0,0,0,0,0,1|1,0,1]=3 1415 B11R1.91 CC(O)CNC1CCCOC1 2230a_100000719290_100011218427 [0,0,0,0,0,1|2,0,1]=4 1416 B11R1.91 CC(O)CNC1CCCOC1 270004a_100000210904_100000753404 [0,0,0,0,0,1|2,0,1]=4 1417 B11R1.91 CC(O)CNC1CCCOC1 34a_100000210904_100000693364 [0,0,0,0,0,1|2,0,1]=4 1418 B11R1.91 CC(O)CNC1CCCOC1 34a_100000719290_100011218427 [0,0,0,0,0,1|2,0,1]=4 1419 B11R1.91 CC(O)CNC1CCCSC1 270004a_100000210904_100000057913 [0,0,0,0,0,1|2,0,1]=4 1420 B11R1.91 CC(O)CNC1CCNCC1 270004a_100000210904_100015192401 [0,0,0,0,0,1|2,0,1]=4 1421 B11R1.91 CC(O)CNC1CCOCC1 2230a_100000741149_100011218427 [0,0,0,0,0,1|2,0,1]=4 1422 B11R1.91 CC(O)CNC1CCOCC1 270004a_100000210904_100011217826 [0,0,0,0,0,1|2,0,1]=4 1423 B11R1.91 CC(O)CNC1CCOCC1 34a_100000741149_100011218427 [0,0,0,0,0,1|2,0,1]=4 1424 B11R1.91 CC(O)CNC1CCSCC1 2230a_100000748639_100011218427 [0,0,0,0,0,1|2,0,1]=4 1425 B11R1.91 CC(O)CNC1CCSCC1 270004a_100000210904_100000203788 [0,0,0,0,0,1|2,0,1]=4 1426 B11R1.91 CC(O)CNC1CCSCC1 34a_100000210904_100000069128 [0,0,0,0,0,1|2,0,1]=4 1427 B11R1.91 CC(O)CNC1CCSCC1 34a_100000748639_100011218427 [0,0,0,0,0,1|2,0,1]=4 1428 B11R1.91 CC(O)COC1CCCCC1 34a_100000210231_100011218427 [0,0,0,0,0,1|1,0,1]=3 1429 B11R1.91 CC(O)COC1CCCCC1 7a_100000210231_100011218427 [0,0,0,0,0,1|1,0,1]=3 1430 B11R1.91 CC(O)COC1CCCCO1 34a_100000033831_100011218427 [0,0,0,0,0,1|2,0,1]=4 1431 B11R1.91 CC(O)COC1CCCOC1 34a_100000754041_100011218427 [0,0,0,0,0,1|2,0,1]=4 1432 B11R1.91 CC(O)COC1CCCSC1 7a_100015962668_100011218427 [0,0,0,0,0,1|2,0,1]=4 1433 B11R1.91 CC(O)COC1CCOCC1 34a_100000744328_100011218427 [0,0,0,0,0,1|2,0,1]=4 1434 B11R1.91 CC(O)COC1CCSCC1 34a_100000731022_100011218427 [0,0,0,0,0,1|2,0,1]=4 1435 B11R1.91 CC(O)COC1CCSCC1 7a_100000731022_100011218427 [0,0,0,0,0,1|2,0,1]=4 1436 B11R1.91 CC(O)CSC1CCCCC1 62a_100000210327_100011218427 [0,0,0,0,0,1|1,0,1]=3 1437 B11R1.91 CC(O)CSC1CCCCC1 62a_100011218427_100000210327 [0,0,0,0,0,1|1,0,1]=3 1438 B11R1.91 CC(O)CSC1CCCOC1 62a_100011218427_100000693364 [0,0,0,0,0,1|2,0,1]=4 1439 B11R1.91 CC(O)CSC1CCOCC1 62a_100011218427_100011324220 [0,0,0,0,0,1|2,0,1]=4 1440 B11R1.91 CC(O)CSC1CCSCC1 62a_100011218427_100000069128 [0,0,0,0,0,1|2,0,1]=4 1441 B11R1.91 CN(C)CCC1CCCCC1 2230a_100102631434_100012355289 [0,0,0,0,0,1|3,0,0]=4 1442 B11R1.91 CN(C)CCC1CCCCC1 269982a_100102631434_100011273959 [0,0,0,0,0,1|3,0,0]=4 1443 B11R1.91 CN(C)CCC1CCCCC1 270004a_100102631434_100011713444 [0,0,0,0,0,1|3,0,0]=4 1444 B11R1.91 CN(C)COC1CCCCC1 2230a_100102631434_100011935260 [0,0,0,0,0,1|3,0,0]=4 1445 B11R1.91 CN(C)COC1CCCCC1 269982a_100102631434_100011935260 [0,0,0,0,0,1|3,0,0]=4 1446 B11R1.91 C[C@@H](Cl)COC1CCCCC1 34a_100016084084_100000210327 [0,0,0,0,0,1|2,0,1]=4 1447 B11R1.91 C[C@@H](N)COC1CCCCC1 34a_100000737577_100000210327 [0,0,0,0,0,1|2,0,1]=4 1448 B11R1.91 C[C@@H](O)CNC1CCCCC1 2230a_100000182618_100009817552 [0,0,0,0,0,1|1,0,1]=3 1449 B11R1.91 C[C@@H](O)CNC1CCCCC1 34a_100000182618_100009817552 [0,0,0,0,0,1|1,0,1]=3 1450 B11R1.91 C[C@@H](O)CNC1CCCOC1 2230a_100000719290_100009817552 [0,0,0,0,0,1|2,0,1]=4 1451 B11R1.91 C[C@@H](O)CNC1CCCOC1 34a_100000719290_100009817552 [0,0,0,0,0,1|2,0,1]=4 1452 B11R1.91 C[C@@H](O)CNC1CCOCC1 2230a_100000741149_100009817552 [0,0,0,0,0,1|2,0,1]=4 1453 B11R1.91 C[C@@H](O)CNC1CCOCC1 34a_100000741149_100009817552 [0,0,0,0,0,1|2,0,1]=4 1454 B11R1.91 C[C@@H](O)CNC1CCSCC1 2230a_100000748639_100009817552 [0,0,0,0,0,1|2,0,1]=4 1455 B11R1.91 C[C@@H](O)CNC1CCSCC1 34a_100000748639_100009817552 [0,0,0,0,0,1|2,0,1]=4 1456 B11R1.91 C[C@@H](O)COC1CCCCC1 34a_100000210231_100009817552 [0,0,0,0,0,1|1,0,1]=3 1457 B11R1.91 C[C@@H](O)COC1CCCCC1 7a_100000210231_100009817552 [0,0,0,0,0,1|1,0,1]=3 1458 B11R1.91 C[C@@H](O)COC1CCCCO1 34a_100000033831_100009817552 [0,0,0,0,0,1|2,0,1]=4 1459 B11R1.91 C[C@@H](O)COC1CCCOC1 34a_100000754041_100009817552 [0,0,0,0,0,1|2,0,1]=4 1460 B11R1.91 C[C@@H](O)COC1CCCSC1 7a_100015962668_100009817552 [0,0,0,0,0,1|2,0,1]=4 1461 B11R1.91 C[C@@H](O)COC1CCOCC1 34a_100000744328_100009817552 [0,0,0,0,0,1|2,0,1]=4 1462 B11R1.91 C[C@@H](O)COC1CCSCC1 34a_100000731022_100009817552 [0,0,0,0,0,1|2,0,1]=4 1463 B11R1.91 C[C@@H](O)COC1CCSCC1 7a_100000731022_100009817552 [0,0,0,0,0,1|2,0,1]=4 1464 B11R1.91 C[C@@H](O)CSC1CCCCC1 62a_100000210327_100009817552 [0,0,0,0,0,1|1,0,1]=3 1465 B11R1.91 C[C@@H](O)CSC1CCCCC1 62a_100009817552_100000210327 [0,0,0,0,0,1|1,0,1]=3 1466 B11R1.91 C[C@@H](O)CSC1CCCOC1 62a_100009817552_100000693364 [0,0,0,0,0,1|2,0,1]=4 1467 B11R1.91 C[C@@H](O)CSC1CCOCC1 62a_100009817552_100011324220 [0,0,0,0,0,1|2,0,1]=4 1468 B11R1.91 C[C@@H](O)CSC1CCSCC1 62a_100009817552_100000069128 [0,0,0,0,0,1|2,0,1]=4 1469 B11R1.91 FC(F)CNC1CCCCC1 2230a_100000182618_100011934356 [0,0,0,0,0,1|2,0,1]=4 1470 B11R1.91 FC(F)CNC1CCCCC1 270004a_100000765723_100000210434 [0,0,0,0,0,1|2,0,1]=4 1471 B11R1.91 FC(F)CNC1CCCCC1 34a_100000182618_100011934356 [0,0,0,0,0,1|2,0,1]=4 1472 B11R1.91 FC(F)CNC1CCCCC1 34a_100000765723_100000210327 [0,0,0,0,0,1|2,0,1]=4 1473 B11R1.91 FC(F)COC1CCCCC1 34a_100000210231_100011934356 [0,0,0,0,0,1|2,0,1]=4 1474 B11R1.91 FC(F)COC1CCCCC1 34a_100000743014_100000210327 [0,0,0,0,0,1|2,0,1]=4 1475 B11R1.91 FC(F)COC1CCCCC1 7a_100000210231_100011934356 [0,0,0,0,0,1|2,0,1]=4 1476 B11R1.91 FC(F)CSC1CCCCC1 62a_100000210327_100011934356 [0,0,0,0,0,1|2,0,1]=4 1477 B11R1.91 FC(F)CSC1CCCCC1 62a_100011934356_100000210327 [0,0,0,0,0,1|2,0,1]=4 1478 B11R1.91 NC(=O)CCN1CCCOC1 2230a_100000131196_100000744528 [0,0,0,0,0,1|3,0,0]=4 1479 B11R1.91 NC(=O)CCN1CCCOC1 269982a_100000131196_100000744528 [0,0,0,0,0,1|3,0,0]=4 1480 B11R1.91 NC(=O)CCN1CCCOC1 34a_100000131196_100000731001 [0,0,0,0,0,1|3,0,0]=4 1481 B11R1.91 NC(=O)CCN1CCOCC1 2230a_100015191051_100000744528 [0,0,0,0,0,1|3,0,0]=4 1482 B11R1.91 NC(=O)CCN1CCOCC1 269982a_100015191051_100000744528 [0,0,0,0,0,1|3,0,0]=4 1483 B11R1.91 NC(=O)CCN1CCOCC1 34a_100015191051_100000731001 [0,0,0,0,0,1|3,0,0]=4 1484 B11R1.91 NC(=O)CCN1CCSCC1 2230a_100000737611_100000744528 [0,0,0,0,0,1|3,0,0]=4 1485 B11R1.91 NC(=O)CCN1CCSCC1 269982a_100000737611_100000744528 [0,0,0,0,0,1|3,0,0]=4 1486 B11R1.91 NC(=O)CNC1C=CCCC1 2230a_100000711301_100000751183 [0,0,0,0,0,1|1,0,2]=4 1487 B11R1.91 NC(=O)CNC1CCCCC1 2230a_100000182618_100000747473 [0,0,0,0,0,1|1,0,0]=2 1488 B11R1.91 NC(=O)CNC1CCCCC1 34a_100000182618_100000187820 [0,0,0,0,0,1|1,0,0]=2 1489 B11R1.91 NC(=O)CNC1CCCOC1 2230a_100000719290_100000747473 [0,0,0,0,0,1|2,0,0]=3 1490 B11R1.91 NC(=O)CNC1CCCOC1 34a_100000719290_100000187820 [0,0,0,0,0,1|2,0,0]=3 1491 B11R1.91 NC(=O)CNC1CCOCC1 2230a_100000741149_100000747473 [0,0,0,0,0,1|2,0,0]=3 1492 B11R1.91 NC(=O)CNC1CCOCC1 34a_100000741149_100000187820 [0,0,0,0,0,1|2,0,0]=3 1493 B11R1.91 NC(=O)CNC1CCSCC1 2230a_100000748639_100000747473 [0,0,0,0,0,1|2,0,0]=3 1494 B11R1.91 NC(=O)CNC1CCSCC1 34a_100000748639_100000187820 [0,0,0,0,0,1|2,0,0]=3 1495 B11R1.91 NC(=O)COC1C=CCCC1 34a_100011215024_100000187820 [0,0,0,0,0,1|1,0,2]=4 1496 B11R1.91 NC(=O)COC1CC=CCC1 34a_100000073881_100000187820 [0,0,0,0,0,1|1,0,2]=4 1497 B11R1.91 NC(=O)COC1CCCCC1 34a_100000210231_100000187820 [0,0,0,0,0,1|1,0,0]=2 1498 B11R1.91 NC(=O)COC1CCCCC1 7a_100000210231_100000187820 [0,0,0,0,0,1|1,0,0]=2 1499 B11R1.91 NC(=O)COC1CCCCO1 34a_100000033831_100000187820 [0,0,0,0,0,1|2,0,0]=3 1500 B11R1.91 NC(=O)COC1CCCOC1 34a_100000754041_100000187820 [0,0,0,0,0,1|2,0,0]=3 1501 B11R1.91 NC(=O)COC1CCCSC1 7a_100015962668_100000187820 [0,0,0,0,0,1|2,0,0]=3 1502 B11R1.91 NC(=O)COC1CCOCC1 34a_100000744328_100000187820 [0,0,0,0,0,1|2,0,0]=3 1503 B11R1.91 NC(=O)COC1CCSCC1 34a_100000731022_100000187820 [0,0,0,0,0,1|2,0,0]=3 1504 B11R1.91 NC(=O)COC1CCSCC1 7a_100000731022_100000187820 [0,0,0,0,0,1|2,0,0]=3 1505 B11R1.91 NC(=O)CSC1C=CCCC1 62a_100000747473_100000751183 [0,0,0,0,0,1|1,0,2]=4 1506 B11R1.91 NC(=O)CSC1C=CCCC1 62a_100000751183_100000747473 [0,0,0,0,0,1|1,0,2]=4 1507 B11R1.91 NC(=O)CSC1CCCCC1 62a_100000210327_100000747473 [0,0,0,0,0,1|1,0,0]=2 1508 B11R1.91 NC(=O)CSC1CCCCC1 62a_100000747473_100000210327 [0,0,0,0,0,1|1,0,0]=2 1509 B11R1.91 NC(=O)CSC1CCCOC1 62a_100000747473_100000693364 [0,0,0,0,0,1|2,0,0]=3 1510 B11R1.91 NC(=O)CSC1CCOCC1 62a_100000747473_100011324220 [0,0,0,0,0,1|2,0,0]=3 1511 B11R1.91 NC(=O)CSC1CCSCC1 62a_100000747473_100000069128 [0,0,0,0,0,1|2,0,0]=3 1512 B11R1.91 O=C(O)CNC1C=CCCC1 269956a_100016091260_100000751183 [0,0,0,0,0,1|0,0,2]=3 1513 B11R1.91 O=C(O)CNC1CCCCC1 269956a_100016091260_100000210327 [0,0,0,0,0,1|0,0,0]=1 1514 B11R1.91 O=C(O)CNC1CCCOC1 269956a_100016091260_100000693364 [0,0,0,0,0,1|1,0,0]=2 1515 B11R1.91 O=C(O)CNC1CCOCC1 269956a_100016091260_100011324220 [0,0,0,0,0,1|1,0,0]=2 1516 B11R1.91 O=C(O)CNC1CCSCC1 269956a_100016091260_100000069128 [0,0,0,0,0,1|1,0,0]=2 1517 B11R1.91 O=C([O-])CNC1CCCCC1 34a_100000182618_100020667443 [0,0,0,0,0,1|0,0,1]=2 1518 B11R1.91 O=C([O-])CNC1CCCOC1 34a_100000719290_100020667443 [0,0,0,0,0,1|1,0,1]=3 1519 B11R1.91 O=C([O-])CNC1CCOCC1 34a_100000741149_100020667443 [0,0,0,0,0,1|1,0,1]=3 1520 B11R1.91 O=C([O-])CNC1CCSCC1 34a_100000748639_100020667443 [0,0,0,0,0,1|1,0,1]=3 1521 B11R1.91 O=C([O-])COC1C=CCCC1 34a_100011215024_100020667443 [0,0,0,0,0,1|0,0,3]=4 1522 B11R1.91 O=C([O-])COC1CC=CCC1 34a_100000073881_100020667443 [0,0,0,0,0,1|0,0,3]=4 1523 B11R1.91 O=C([O-])COC1CCCCC1 34a_100000210231_100020667443 [0,0,0,0,0,1|0,0,1]=2 1524 B11R1.91 O=C([O-])COC1CCCCO1 34a_100000033831_100020667443 [0,0,0,0,0,1|1,0,1]=3 1525 B11R1.91 O=C([O-])COC1CCCOC1 34a_100000754041_100020667443 [0,0,0,0,0,1|1,0,1]=3 1526 B11R1.91 O=C([O-])COC1CCOCC1 34a_100000744328_100020667443 [0,0,0,0,0,1|1,0,1]=3 1527 B11R1.91 O=C([O-])COC1CCSCC1 34a_100000731022_100020667443 [0,0,0,0,0,1|1,0,1]=3 1528 B11R1.91 O=C([O-])CSC1C=CCCC1 62a_100000751183_100020667443 [0,0,0,0,0,1|0,0,3]=4 1529 B11R1.91 O=C([O-])CSC1C=CCCC1 62a_100020667443_100000751183 [0,0,0,0,0,1|0,0,3]=4 1530 B11R1.91 O=C([O-])CSC1CCCCC1 62a_100000210327_100020667443 [0,0,0,0,0,1|0,0,1]=2 1531 B11R1.91 O=C([O-])CSC1CCCCC1 62a_100020667443_100000210327 [0,0,0,0,0,1|0,0,1]=2 1532 B11R1.91 O=C([O-])CSC1CCCOC1 62a_100020667443_100000693364 [0,0,0,0,0,1|1,0,1]=3 1533 B11R1.91 O=C([O-])CSC1CCOCC1 62a_100020667443_100011324220 [0,0,0,0,0,1|1,0,1]=3 1534 B11R1.91 O=C([O-])CSC1CCSCC1 62a_100020667443_100000069128 [0,0,0,0,0,1|1,0,1]=3 1535 B11R1.91 O=[N+]([O-])CNC1CCCCC1 34a_100000182618_100000761209 [0,0,0,0,0,1|1,0,1]=3 1536 B11R1.91 O=[N+]([O-])CNC1CCCOC1 34a_100000719290_100000761209 [0,0,0,0,0,1|2,0,1]=4 1537 B11R1.91 O=[N+]([O-])CNC1CCOCC1 34a_100000741149_100000761209 [0,0,0,0,0,1|2,0,1]=4 1538 B11R1.91 O=[N+]([O-])CNC1CCSCC1 34a_100000748639_100000761209 [0,0,0,0,0,1|2,0,1]=4 1539 B11R1.91 O=[N+]([O-])COC1CCCCC1 34a_100000210231_100000761209 [0,0,0,0,0,1|1,0,1]=3 1540 B11R1.91 O=[N+]([O-])COC1CCCCO1 34a_100000033831_100000761209 [0,0,0,0,0,1|2,0,1]=4 1541 B11R1.91 O=[N+]([O-])COC1CCCOC1 34a_100000754041_100000761209 [0,0,0,0,0,1|2,0,1]=4 1542 B11R1.91 O=[N+]([O-])COC1CCOCC1 34a_100000744328_100000761209 [0,0,0,0,0,1|2,0,1]=4 1543 B11R1.91 O=[N+]([O-])COC1CCSCC1 34a_100000731022_100000761209 [0,0,0,0,0,1|2,0,1]=4 1544 B11R1.91 O=[N+]([O-])CSC1CCCCC1 62a_100000210327_100000761209 [0,0,0,0,0,1|1,0,1]=3 1545 B11R1.91 [13CH3]C(=O)C=CC1CCCCC1 1458a_100102566626_200025704644 [0,0,0,0,0,1|1,0,1]=3 1546 B11R1.91 [13CH3]C(=O)CCC1CCCCC1 1458a_100000211375_200025704644 [0,0,0,0,0,1|1,0,0]=2 1547 B11R1.91 [13CH3]C(=O)CCN1CCCCC1 1458a_100000743487_200025704644 [0,0,0,0,0,1|2,0,0]=3 1548 B11R1.91 [13CH3]C(=O)CCN1CCCCO1 1458a_200015184090_200025704644 [0,0,0,0,0,1|3,0,0]=4 1549 B11R1.91 [13CH3]C(=O)CCN1CCOCC1 1458a_100000749337_200025704644 [0,0,0,0,0,1|3,0,0]=4 1550 B11R1.91 [13CH3]C(=O)CNC1=NCCCC1 1458a_100000118790_200025704644 [0,0,0,0,0,1|2,0,1]=4 1551 B11R1.91 [13CH3]C(=O)COC1CCCCC1 1458a_100011223303_200025704644 [0,0,0,0,0,1|1,0,0]=2 1552 B11R1.742 C=C(C)CN1CCCCCC1 2230a_100000185865_100000748629 [0,0,0,0,0,1|3,0,0]=4 1553 B11R1.742 C=C(C)CN1CCCCCC1 269982a_100000185865_100000748629 [0,0,0,0,0,1|3,0,0]=4 1554 B11R1.742 C=C(C)CN1CCCCCC1 34a_100000185865_100000748629 [0,0,0,0,0,1|3,0,0]=4 1555 B11R1.742 C=C(C)CN1CCCOCC1 2230a_100000685342_100000748629 [0,0,0,0,0,1|3,0,0]=4 1556 B11R1.742 C=C(C)CN1CCCOCC1 269982a_100000685342_100000748629 [0,0,0,0,0,1|3,0,0]=4 1557 B11R1.742 C=C(C)CN1CCCOCC1 34a_100000685342_100000748629 [0,0,0,0,0,1|3,0,0]=4 1558 B11R1.742 C=C(F)CN1CCCCCC1 2230a_100000185865_100009893438 [0,0,0,0,0,1|3,0,0]=4 1559 B11R1.742 C=C(F)CN1CCCCCC1 269982a_100000185865_100009893438 [0,0,0,0,0,1|3,0,0]=4 1560 B11R1.742 C=C(F)CN1CCCCCC1 34a_100000185865_100009893438 [0,0,0,0,0,1|3,0,0]=4 1561 B11R1.742 C=C(F)CN1CCCOCC1 2230a_100000685342_100009893438 [0,0,0,0,0,1|3,0,0]=4 1562 B11R1.742 C=C(F)CN1CCCOCC1 269982a_100000685342_100009893438 [0,0,0,0,0,1|3,0,0]=4 1563 B11R1.742 C=C(F)CN1CCCOCC1 34a_100000685342_100009893438 [0,0,0,0,0,1|3,0,0]=4 1564 B11R1.742 CC(=O)C=C1CCCCCC1 1458a_100011240665_200000210301 [0,0,0,0,0,1|1,0,2]=4 1565 B11R1.742 CC(=O)CC1CCCCCC1 1458a_100000070787_200000696569 [0,0,0,0,0,1|1,0,0]=2 1566 B11R1.742 CC(=O)CC1CCCCCC1 1458a_100000685095_200000210301 [0,0,0,0,0,1|1,0,0]=2 1567 B11R1.742 CC(=O)CN1CCCCCC1 1458a_100000740298_200000210301 [0,0,0,0,0,1|2,0,0]=3 1568 B11R1.742 CC(=O)NC1CCCCCC1 11a_100000210984_100015343762 [0,0,0,0,0,1|2,0,0]=3 1569 B11R1.742 CC(=O)NC1CCCCCC1 1626a_100000210984_100015343762 [0,0,0,0,0,1|2,0,0]=3 1570 B11R1.742 CC(=O)NC1CCCCCC1 240690a_100000210984_100015343762 [0,0,0,0,0,1|2,0,0]=3 1571 B11R1.742 CC(=O)NC1CCCCCC1 527a_100000210984_100103153847 [0,0,0,0,0,1|2,0,0]=3 1572 B11R1.742 CC(O)CN1CCCCCC1 2230a_100000185865_100011218427 [0,0,0,0,0,1|2,0,1]=4 1573 B11R1.742 CC(O)CN1CCCCCC1 269982a_100000185865_100011218427 [0,0,0,0,0,1|2,0,1]=4 1574 B11R1.742 CC(O)CN1CCCCCC1 34a_100000185865_100011218427 [0,0,0,0,0,1|2,0,1]=4 1575 B11R1.742 CC(O)CN1CCCOCC1 2230a_100000685342_100011218427 [0,0,0,0,0,1|2,0,1]=4 1576 B11R1.742 CC(O)CN1CCCOCC1 269982a_100000685342_100011218427 [0,0,0,0,0,1|2,0,1]=4 1577 B11R1.742 CC(O)CN1CCCOCC1 34a_100000685342_100011218427 [0,0,0,0,0,1|2,0,1]=4 1578 B11R1.742 CN(C)CC1CCCCCC1 2230a_100102631434_200000696569 [0,0,0,0,0,1|3,0,0]=4 1579 B11R1.742 CN(C)CC1CCCCCC1 269982a_100102631434_200000696569 [0,0,0,0,0,1|3,0,0]=4 1580 B11R1.742 C[C@@H](O)CN1CCCCCC1 2230a_100000185865_100009817552 [0,0,0,0,0,1|2,0,1]=4 1581 B11R1.742 C[C@@H](O)CN1CCCCCC1 269982a_100000185865_100009817552 [0,0,0,0,0,1|2,0,1]=4 1582 B11R1.742 C[C@@H](O)CN1CCCCCC1 34a_100000185865_100009817552 [0,0,0,0,0,1|2,0,1]=4 1583 B11R1.742 C[C@@H](O)CN1CCCOCC1 2230a_100000685342_100009817552 [0,0,0,0,0,1|2,0,1]=4 1584 B11R1.742 C[C@@H](O)CN1CCCOCC1 269982a_100000685342_100009817552 [0,0,0,0,0,1|2,0,1]=4 1585 B11R1.742 C[C@@H](O)CN1CCCOCC1 34a_100000685342_100009817552 [0,0,0,0,0,1|2,0,1]=4 1586 B11R1.742 NC(=O)CN1CCCCCC1 2230a_100000185865_100000747473 [0,0,0,0,0,1|2,0,0]=3 1587 B11R1.742 NC(=O)CN1CCCCCC1 269982a_100000185865_100000187820 [0,0,0,0,0,1|2,0,0]=3 1588 B11R1.742 NC(=O)CN1CCCCCC1 34a_100000185865_100000187820 [0,0,0,0,0,1|2,0,0]=3 1589 B11R1.742 NC(=O)CN1CCCOCC1 2230a_100000685342_100000747473 [0,0,0,0,0,1|2,0,0]=3 1590 B11R1.742 NC(=O)CN1CCCOCC1 269982a_100000685342_100000187820 [0,0,0,0,0,1|2,0,0]=3 1591 B11R1.742 NC(=O)CN1CCCOCC1 34a_100000685342_100000187820 [0,0,0,0,0,1|2,0,0]=3 1592 B11R1.742 O=C([O-])CN1CCCCCC1 269982a_100000185865_100020667443 [0,0,0,0,0,1|1,0,1]=3 1593 B11R1.742 O=C([O-])CN1CCCCCC1 34a_100000185865_100020667443 [0,0,0,0,0,1|1,0,1]=3 1594 B11R1.742 O=C([O-])CN1CCCOCC1 269982a_100000685342_100020667443 [0,0,0,0,0,1|1,0,1]=3 1595 B11R1.742 O=C([O-])CN1CCCOCC1 34a_100000685342_100020667443 [0,0,0,0,0,1|1,0,1]=3 1596 B11R1.742 O=[N+]([O-])CN1CCCCCC1 269982a_100000185865_100000761209 [0,0,0,0,0,1|2,0,1]=4 1597 B11R1.742 O=[N+]([O-])CN1CCCCCC1 34a_100000185865_100000761209 [0,0,0,0,0,1|2,0,1]=4 1598 B11R1.742 O=[N+]([O-])CN1CCCOCC1 269982a_100000685342_100000761209 [0,0,0,0,0,1|2,0,1]=4 1599 B11R1.742 O=[N+]([O-])CN1CCCOCC1 34a_100000685342_100000761209 [0,0,0,0,0,1|2,0,1]=4 1600 B11R1.742 [13CH3]C(=O)C=C1CCCCCC1 1458a_100011240665_200025704644 [0,0,0,0,0,1|1,0,2]=4 1601 B11R1.742 [13CH3]C(=O)CC1CCCCCC1 1458a_100000685095_200025704644 [0,0,0,0,0,1|1,0,0]=2 1602 B11R1.742 [13CH3]C(=O)CN1CCCCCC1 1458a_100000740298_200025704644 [0,0,0,0,0,1|2,0,0]=3 1603 B8R0.4 C=CCCCCCNC 2230a_106832991635_100000700193 [1,0,1,0,0,0|2,0,0]=4 1604 B8R0.4 C=CCCCCCNC 34a_100102657272_100000700193 [1,0,1,0,0,0|2,0,0]=4 1605 B8R0.4 C=CCCCCCNC 7a_106832991635_100000700193 [1,0,1,0,0,0|2,0,0]=4 1606 B8R0.4 C=CCCCCCOC 34a_100011216702_200000210301 [1,0,1,0,0,0|2,0,0]=4 1607 B8R0.4 C=CCCCCCOC 34a_100138415774_100000700193 [1,0,1,0,0,0|2,0,0]=4 1608 B8R0.4 C=CCCCCCOC 7a_100011216702_200000210301 [1,0,1,0,0,0|2,0,0]=4 1609 B8R0.4 C=CCCCCCO[13CH3] 34a_100011216702_200025704644 [1,0,1,0,0,0|2,0,0]=4 1610 B8R0.4 C=CCCCCCO[13CH3] 7a_100011216702_200025704644 [1,0,1,0,0,0|2,0,0]=4 1611 B8R0.4 C=CCCCCCSC 62a_100000700193_200000210301 [1,0,1,0,0,0|2,0,0]=4 1612 B8R0.4 C=CCCCCCSC 62a_200000210301_100000700193 [1,0,1,0,0,0|2,0,0]=4 1613 B8R0.4 C=CCCCCCS[13CH3] 62a_100000700193_200025704644 [1,0,1,0,0,0|2,0,0]=4 1614 B8R0.4 C=CCCCCCS[13CH3] 62a_200025704644_100000700193 [1,0,1,0,0,0|2,0,0]=4 1615 B8R0.4 C=CCCCCNCC 2230a_100000703577_100000210202 [1,0,1,0,0,0|2,0,0]=4 1616 B8R0.4 C=CCCCCNCC 2230a_100015525214_100011215482 [1,0,1,0,0,0|2,0,0]=4 1617 B8R0.4 C=CCCCCNCC 34a_100000703577_100000210202 [1,0,1,0,0,0|2,0,0]=4 1618 B8R0.4 C=CCCCCOCC 34a_100000766645_100000210202 [1,0,1,0,0,0|2,0,0]=4 1619 B8R0.4 C=CCCCCOCC 34a_100121572206_100011215482 [1,0,1,0,0,0|2,0,0]=4 1620 B8R0.4 C=CCCCCOCC 7a_100000766645_100000210202 [1,0,1,0,0,0|2,0,0]=4 1621 B8R0.4 C=CCCCCSCC 62a_100000210202_100011215482 [1,0,1,0,0,0|2,0,0]=4 1622 B8R0.4 C=CCCCCSCC 62a_100011215482_100000210202 [1,0,1,0,0,0|2,0,0]=4 1623 B8R0.4 C=CCCCNCCC 2230a_100000700776_100000210303 [1,0,1,0,0,0|2,0,0]=4 1624 B8R0.4 C=CCCCNCCC 34a_100000700776_100000210303 [1,0,1,0,0,0|2,0,0]=4 1625 B8R0.4 C=CCCCOCCC 34a_100000210258_100000757094 [1,0,1,0,0,0|2,0,0]=4 1626 B8R0.4 C=CCCCOCCC 34a_100000758997_100000210303 [1,0,1,0,0,0|2,0,0]=4 1627 B8R0.4 C=CCCCOCCC 7a_100000758997_100000210303 [1,0,1,0,0,0|2,0,0]=4 1628 B8R0.4 C=CCCCSCCC 62a_100000210303_100000757094 [1,0,1,0,0,0|2,0,0]=4 1629 B8R0.4 C=CCCCSCCC 62a_100011713584_100000210303 [1,0,1,0,0,0|2,0,0]=4 1630 B8R0.4 C=CCCNCCCC 2230a_100000102301_100000754431 [1,0,1,0,0,0|2,0,0]=4 1631 B8R0.4 C=CCCNCCCC 2230a_100015191253_100000210211 [1,0,1,0,0,0|2,0,0]=4 1632 B8R0.4 C=CCCNCCCC 7a_106832991798_100000754431 [1,0,1,0,0,0|2,0,0]=4 1633 B8R0.4 C=CCCOCCCC 34a_100000210227_100000754431 [1,0,1,0,0,0|2,0,0]=4 1634 B8R0.4 C=CCCOCCCC 34a_100011205117_100000210210 [1,0,1,0,0,0|2,0,0]=4 1635 B8R0.4 C=CCCOCCCC 7a_100000210227_100000754431 [1,0,1,0,0,0|2,0,0]=4 1636 B8R0.4 C=CCCSCCCC 62a_100000210211_100000754431 [1,0,1,0,0,0|2,0,0]=4 1637 B8R0.4 C=CCCSCCCC 62a_100000754431_100000210210 [1,0,1,0,0,0|2,0,0]=4 1638 B8R0.4 C=CCNCCCCC 2230a_100000209983_100000210623 [1,0,1,0,0,0|2,0,0]=4 1639 B8R0.4 C=CCNCCCCC 2230a_100020586998_100000210326 [1,0,1,0,0,0|2,0,0]=4 1640 B8R0.4 C=CCOCCCCC 34a_100000210253_100015514636 [1,0,1,0,0,0|2,0,0]=4 1641 B8R0.4 C=CCOCCCCC 34a_200000210373_100000718602 [1,0,1,0,0,0|2,0,0]=4 1642 B8R0.4 C=CCOCCCCC 7a_100000210253_100015514636 [1,0,1,0,0,0|2,0,0]=4 1643 B8R0.4 C=CCSCCCCC 62a_100000210326_100000210623 [1,0,1,0,0,0|2,0,0]=4 1644 B8R0.4 C=CCSCCCCC 62a_100000210623_100000210326 [1,0,1,0,0,0|2,0,0]=4 1645 B8R0.4 CCCCCCCNC 2230a_100000229938_200000210301 [1,0,1,0,0,0|2,0,0]=4 1646 B8R0.4 CCCCCCCNC 2230a_106832991635_100000210681 [1,0,1,0,0,0|2,0,0]=4 1647 B8R0.4 CCCCCCCNC 34a_100102657272_100000210614 [1,0,1,0,0,0|2,0,0]=4 1648 B8R0.4 CCCCCCCNC 7a_106832991635_100000210614 [1,0,1,0,0,0|2,0,0]=4 1649 B8R0.4 CCCCCCCN[13CH3] 2230a_100000229938_200025704644 [1,0,1,0,0,0|2,0,0]=4 1650 B8R0.4 CCCCCCCOC 34a_100000210272_200000210301 [1,0,1,0,0,0|2,0,0]=4 1651 B8R0.4 CCCCCCCOC 34a_100138415774_100000210614 [1,0,1,0,0,0|2,0,0]=4 1652 B8R0.4 CCCCCCCOC 7a_100000210272_200000210301 [1,0,1,0,0,0|2,0,0]=4 1653 B8R0.4 CCCCCCCO[13CH3] 34a_100000210272_200025704644 [1,0,1,0,0,0|2,0,0]=4 1654 B8R0.4 CCCCCCCO[13CH3] 7a_100000210272_200025704644 [1,0,1,0,0,0|2,0,0]=4 1655 B8R0.4 CCCCCCCSC 62a_100000210614_200000210301 [1,0,1,0,0,0|2,0,0]=4 1656 B8R0.4 CCCCCCCSC 62a_200000210301_100000210316 [1,0,1,0,0,0|2,0,0]=4 1657 B8R0.4 CCCCCCCS[13CH3] 62a_100000210614_200025704644 [1,0,1,0,0,0|2,0,0]=4 1658 B8R0.4 CCCCCCCS[13CH3] 62a_200025704644_100000210316 [1,0,1,0,0,0|2,0,0]=4 1659 B8R0.4 CCCCCNCC=O 2230a_100000209983_200015260668 [1,0,1,0,0,0|1,0,0]=3 1660 B8R0.4 CCCCCNCCO 2230a_100000209983_100000211926 [1,0,1,0,0,0|1,0,1]=4 1661 B8R0.4 CCCCCNCCO 2230a_100016997473_100000210326 [1,0,1,0,0,0|1,0,1]=4 1662 B8R0.4 CCCCCNCCO 34a_100016990907_100000718602 [1,0,1,0,0,0|1,0,1]=4 1663 B8R0.4 CCCCCOCC=O 34a_100000210253_200009817547 [1,0,1,0,0,0|1,0,0]=3 1664 B8R0.4 CCCCCOCC=O 7a_100000210253_200015260668 [1,0,1,0,0,0|1,0,0]=3 1665 B8R0.4 CCCCCOCCO 34a_100000210253_100000211926 [1,0,1,0,0,0|1,0,1]=4 1666 B8R0.4 CCCCCOCCO 7a_100000210253_100000211926 [1,0,1,0,0,0|1,0,1]=4 1667 B8R0.4 CCCCCSCC=O 62a_100000210326_200015260668 [1,0,1,0,0,0|1,0,0]=3 1668 B8R0.4 CCCCCSCC=O 62a_200015260668_100000210326 [1,0,1,0,0,0|1,0,0]=3 1669 B8R0.4 CCCCCSCCO 62a_100000210326_100000211926 [1,0,1,0,0,0|1,0,1]=4 1670 B8R0.4 CCCCCSCCO 62a_100000211926_100000210326 [1,0,1,0,0,0|1,0,1]=4 1671 B8R0.4 CCCCNCCCO 2230a_100000102301_100000230001 [1,0,1,0,0,0|1,0,1]=4 1672 B8R0.4 CCCCNCCCO 7a_106832991798_100011215043 [1,0,1,0,0,0|1,0,1]=4 1673 B8R0.4 CCCCOCCCO 34a_100000210227_100000230001 [1,0,1,0,0,0|1,0,1]=4 1674 B8R0.4 CCCCOCCCO 7a_100000210227_100011215043 [1,0,1,0,0,0|1,0,1]=4 1675 B8R0.4 CCCCSCCCO 62a_100000210211_100011215043 [1,0,1,0,0,0|1,0,1]=4 1676 B8R0.4 CCCCSCCCO 62a_100011215043_100000210210 [1,0,1,0,0,0|1,0,1]=4 1677 B8R0.4 CCCNCCCCO 2230a_100000750430_100000210303 [1,0,1,0,0,0|1,0,1]=4 1678 B8R0.4 CCCNCCCCO 34a_100000750430_100000210303 [1,0,1,0,0,0|1,0,1]=4 1679 B8R0.4 CCCOCCCCO 34a_100000210258_100011216708 [1,0,1,0,0,0|1,0,1]=4 1680 B8R0.4 CCCSCCCC=O 62a_100000210303_200011292268 [1,0,1,0,0,0|1,0,0]=3 1681 B8R0.4 CCCSCCCC=O 62a_200011292268_100000210303 [1,0,1,0,0,0|1,0,0]=3 1682 B8R0.4 CCCSCCCCO 62a_100000210303_100000210776 [1,0,1,0,0,0|1,0,1]=4 1683 B8R0.4 CCCSCCCCO 62a_100000210776_100000210303 [1,0,1,0,0,0|1,0,1]=4 1684 B8R0.4 CCNCCCCC=O 2230a_100015525214_100000139335 [1,0,1,0,0,0|1,0,0]=3 1685 B8R0.4 CCNCCCCCO 2230a_100000762737_100000210202 [1,0,1,0,0,0|1,0,1]=4 1686 B8R0.4 CCNCCCCCO 2230a_100015525214_100000746330 [1,0,1,0,0,0|1,0,1]=4 1687 B8R0.4 CCNCCCCCO 34a_100000762737_100000210202 [1,0,1,0,0,0|1,0,1]=4 1688 B8R0.4 CCOCCCCCO 34a_100121572206_100000746330 [1,0,1,0,0,0|1,0,1]=4 1689 B8R0.4 CCOCCNCC=O 2230a_102516460346_200015260668 [1,0,1,0,0,0|2,0,0]=4 1690 B8R0.4 CCOCCNCC=O 34a_102516460346_200009817547 [1,0,1,0,0,0|2,0,0]=4 1691 B8R0.4 CCOCCOCC=O 34a_100000210136_200009817547 [1,0,1,0,0,0|2,0,0]=4 1692 B8R0.4 CCOCCOCC=O 7a_100000210136_200015260668 [1,0,1,0,0,0|2,0,0]=4 1693 B8R0.4 CCOCCSCC=O 62a_100000210147_200015260668 [1,0,1,0,0,0|2,0,0]=4 1694 B8R0.4 CCOCCSCC=O 62a_200015260668_100011215890 [1,0,1,0,0,0|2,0,0]=4 1695 B8R0.4 CCSCCCCC=O 62a_100000139335_100000210202 [1,0,1,0,0,0|1,0,0]=3 1696 B8R0.4 CCSCCCCC=O 62a_100000210202_100000139335 [1,0,1,0,0,0|1,0,0]=3 1697 B8R0.4 CCSCCCCCO 62a_100000210202_100000746330 [1,0,1,0,0,0|1,0,1]=4 1698 B8R0.4 CCSCCCCCO 62a_100000746330_100000210202 [1,0,1,0,0,0|1,0,1]=4 1699 B8R0.4 CCSCCNCC=O 2230a_100000106463_200015260668 [1,0,1,0,0,0|2,0,0]=4 1700 B8R0.4 CCSCCOCC=O 34a_100000212035_200009817547 [1,0,1,0,0,0|2,0,0]=4 1701 B8R0.4 CCSCCOCC=O 7a_100000212035_200015260668 [1,0,1,0,0,0|2,0,0]=4 1702 B8R0.4 CCSCCSCC=O 62a_100000757381_200015260668 [1,0,1,0,0,0|2,0,0]=4 1703 B8R0.4 CCSCCSCC=O 62a_200015260668_100000757381 [1,0,1,0,0,0|2,0,0]=4 1704 B8R0.4 CNCCCCCC=O 2230a_106832991635_100000139337 [1,0,1,0,0,0|1,0,0]=3 1705 B8R0.4 CNCCCCCC=O 7a_106832991635_100000139337 [1,0,1,0,0,0|1,0,0]=3 1706 B8R0.4 CNCCCCCCO 2230a_100000686447_200000210301 [1,0,1,0,0,0|1,0,1]=4 1707 B8R0.4 CNCCCCCCO 2230a_106832991635_100000766143 [1,0,1,0,0,0|1,0,1]=4 1708 B8R0.4 CNCCCCCCO 34a_100000686447_200000210301 [1,0,1,0,0,0|1,0,1]=4 1709 B8R0.4 CNCCCCCCO 34a_100102657272_100000766143 [1,0,1,0,0,0|1,0,1]=4 1710 B8R0.4 CNCCCCCCO 7a_106832991635_100000766143 [1,0,1,0,0,0|1,0,1]=4 1711 B8R0.4 CNCCCOCC=O 34a_100000213112_200009817547 [1,0,1,0,0,0|2,0,0]=4 1712 B8R0.4 COCCCCCCO 34a_100138415774_100000766143 [1,0,1,0,0,0|1,0,1]=4 1713 B8R0.4 COCCCNCC=O 34a_100150723488_200009817547 [1,0,1,0,0,0|2,0,0]=4 1714 B8R0.4 COCCCOCC=O 34a_100000740835_200009817547 [1,0,1,0,0,0|2,0,0]=4 1715 B8R0.4 COCCCSCC=O 62a_100000709357_200015260668 [1,0,1,0,0,0|2,0,0]=4 1716 B8R0.4 COCCCSCC=O 62a_200015260668_100000709357 [1,0,1,0,0,0|2,0,0]=4 1717 B8R0.4 COCSCCCC=O 62a_100000766300_200011292268 [1,0,1,0,0,0|2,0,0]=4 1718 B8R0.4 COCSCCCC=O 62a_200011292268_100000766300 [1,0,1,0,0,0|2,0,0]=4 1719 B8R0.4 CSCCCCCC=O 62a_100000139337_200000210301 [1,0,1,0,0,0|1,0,0]=3 1720 B8R0.4 CSCCCCCC=O 62a_200000210301_100000139337 [1,0,1,0,0,0|1,0,0]=3 1721 B8R0.4 CSCCCCCCO 62a_100000766143_200000210301 [1,0,1,0,0,0|1,0,1]=4 1722 B8R0.4 CSCCCCCCO 62a_200000210301_100000766143 [1,0,1,0,0,0|1,0,1]=4 1723 B8R0.4 CSCCCNCC=O 2230a_100000749238_200015260668 [1,0,1,0,0,0|2,0,0]=4 1724 B8R0.4 CSCCCOCC=O 34a_100000690336_200009817547 [1,0,1,0,0,0|2,0,0]=4 1725 B8R0.4 CSCCCOCC=O 7a_100000690336_200015260668 [1,0,1,0,0,0|2,0,0]=4 1726 B8R0.4 CSCSCCCC=O 62a_100011218213_200011292268 [1,0,1,0,0,0|2,0,0]=4 1727 B8R0.4 CSCSCCCC=O 62a_200011292268_100011218213 [1,0,1,0,0,0|2,0,0]=4 1728 B8R0.4 NCCCCOCC=O 34a_100000750430_200009817547 [1,0,1,0,0,0|2,0,0]=4 1729 B8R0.4 O=CCCCCSCF 62a_100000139335_100015361967 [1,0,1,0,0,0|2,0,0]=4 1730 B8R0.4 O=CCCCCSCF 62a_100015361967_100000139335 [1,0,1,0,0,0|2,0,0]=4 1731 B8R0.4 O=CCCCNCCO 2230a_100016997473_200011292268 [1,0,1,0,0,0|2,0,0]=4 1732 B8R0.4 O=CCCCSCCF 62a_100011217306_200011292268 [1,0,1,0,0,0|2,0,0]=4 1733 B8R0.4 O=CCCCSCCF 62a_200011292268_100011217306 [1,0,1,0,0,0|2,0,0]=4 1734 B8R0.4 O=CCCCSCCO 62a_100000211926_200011292268 [1,0,1,0,0,0|2,0,0]=4 1735 B8R0.4 O=CCCCSCCO 62a_200011292268_100000211926 [1,0,1,0,0,0|2,0,0]=4 1736 B8R0.4 O=CCNCCCCO 2230a_100000750430_200015260668 [1,0,1,0,0,0|2,0,0]=4 1737 B8R0.4 O=CCNCCCCO 34a_100000750430_200009817547 [1,0,1,0,0,0|2,0,0]=4 1738 B8R0.4 O=CCOCCCCBr 34a_100011216708_200009817547 [1,0,1,0,0,0|2,0,0]=4 1739 B8R0.4 O=CCOCCCCCl 34a_100000210776_200009817547 [1,0,1,0,0,0|2,0,0]=4 1740 B8R0.4 O=CCOCCCCCl 7a_100000210776_200015260668 [1,0,1,0,0,0|2,0,0]=4 1741 B8R0.4 O=CCOCCCCF 34a_100011995726_200009817547 [1,0,1,0,0,0|2,0,0]=4 1742 B8R0.4 O=CCOCCCCF 7a_100011995726_200015260668 [1,0,1,0,0,0|2,0,0]=4 1743 B8R0.4 O=CCOCCCCI 34a_200012148704_200009817547 [1,0,1,0,0,0|2,0,0]=4 1744 B8R0.4 O=CCSCCCCF 62a_100000729493_200015260668 [1,0,1,0,0,0|2,0,0]=4 1745 B8R0.4 O=CCSCCCCF 62a_200015260668_100000729493 [1,0,1,0,0,0|2,0,0]=4 1746 B8R0.4 O=CCSCCCCO 62a_100000210776_200015260668 [1,0,1,0,0,0|2,0,0]=4 1747 B8R0.4 O=CCSCCCCO 62a_200015260668_100000210776 [1,0,1,0,0,0|2,0,0]=4 1748 B8R0.4 [13CH3]NCCCCCCO 2230a_100000686447_200025704644 [1,0,1,0,0,0|1,0,1]=4 1749 B8R0.4 [13CH3]NCCCCCCO 34a_100000686447_200025704644 [1,0,1,0,0,0|1,0,1]=4 1750 B8R0.4 [13CH3]SCCCCCC=O 62a_100000139337_200025704644 [1,0,1,0,0,0|1,0,0]=3 1751 B8R0.4 [13CH3]SCCCCCC=O 62a_200025704644_100000139337 [1,0,1,0,0,0|1,0,0]=3 1752 B8R0.4 [13CH3]SCCCCCCO 62a_100000766143_200025704644 [1,0,1,0,0,0|1,0,1]=4 1753 B8R0.4 [13CH3]SCCCCCCO 62a_200025704644_100000766143 [1,0,1,0,0,0|1,0,1]=4 1754 B8R0.7 CC(=O)CCCCCF 1458a_100000070787_100000729378 [1,0,1,0,0,0|2,0,0]=4 1755 B8R0.7 CC(=O)CCCCCO 1458a_100000070787_100000746330 [1,0,1,0,0,0|2,0,0]=4 1756 B8R0.7 CC(=O)CCCCCO 1458a_100102619762_200000210301 [1,0,1,0,0,0|2,0,0]=4 1757 B8R0.7 CC(=O)CCCCS[13CH3] 62a_100000735457_200025704644 [1,0,1,0,0,0|2,0,0]=4 1758 B8R0.7 CC(=O)CCCCS[13CH3] 62a_200025704644_100000735457 [1,0,1,0,0,0|2,0,0]=4 1759 B8R0.7 CCCCCCC(=O)C 1458a_100000070787_100000210757 [1,0,1,0,0,0|1,0,0]=3 1760 B8R0.7 CCCCCCC(=O)C 1458a_100102632555_200000210301 [1,0,1,0,0,0|1,0,0]=3 1761 B8R0.7 CCCCCCC(=O)[13CH3] 1458a_100102632555_200025704644 [1,0,1,0,0,0|1,0,0]=3 1762 B8R0.7 CCCCCNC(=O)C 11a_100000209983_100015343762 [1,0,1,0,0,0|2,0,0]=4 1763 B8R0.7 CCCCCNC(=O)C 1626a_100000209983_100015343762 [1,0,1,0,0,0|2,0,0]=4 1764 B8R0.7 CCCCCNC(=O)C 240690a_100000209983_100015343762 [1,0,1,0,0,0|2,0,0]=4 1765 B8R0.7 CCCCCNC(=O)C 527a_100000209983_100103153847 [1,0,1,0,0,0|2,0,0]=4 1766 B8R0.7 CCCCNCC(=O)N 2230a_100000102301_100000747473 [1,0,1,0,0,0|2,0,0]=4 1767 B8R0.7 CCCCNCC(=O)N 2230a_100000711301_100000210211 [1,0,1,0,0,0|2,0,0]=4 1768 B8R0.7 CCCCNCC(=O)N 7a_106832991798_100000187820 [1,0,1,0,0,0|2,0,0]=4 1769 B8R0.7 CCCCNCC(=O)O 269956a_100016091260_100000210211 [1,0,1,0,0,0|1,0,0]=3 1770 B8R0.7 CCCCOCC(=O)C 1458a_100000070787_100011995733 [1,0,1,0,0,0|2,0,0]=4 1771 B8R0.7 CCCCOCC(=O)C 1458a_100000757543_200000210301 [1,0,1,0,0,0|2,0,0]=4 1772 B8R0.7 CCCCOCC(=O)C 34a_100000211253_100000210210 [1,0,1,0,0,0|2,0,0]=4 1773 B8R0.7 CCCCOCC(=O)N 34a_100000210227_100000187820 [1,0,1,0,0,0|2,0,0]=4 1774 B8R0.7 CCCCOCC(=O)N 7a_100000210227_100000187820 [1,0,1,0,0,0|2,0,0]=4 1775 B8R0.7 CCCCOCC(=O)[13CH3] 1458a_100000757543_200025704644 [1,0,1,0,0,0|2,0,0]=4 1776 B8R0.7 CCCCOCC(=O)[O-] 34a_100000210227_100020667443 [1,0,1,0,0,0|1,0,1]=4 1777 B8R0.7 CCCCSCC(=O)C 1458a_100000191162_200000210301 [1,0,1,0,0,0|2,0,0]=4 1778 B8R0.7 CCCCSCC(=O)N 62a_100000210211_100000747473 [1,0,1,0,0,0|2,0,0]=4 1779 B8R0.7 CCCCSCC(=O)N 62a_100000747473_100000210210 [1,0,1,0,0,0|2,0,0]=4 1780 B8R0.7 CCCCSCC(=O)[13CH3] 1458a_100000191162_200025704644 [1,0,1,0,0,0|2,0,0]=4 1781 B8R0.7 CCCCSCC(=O)[O-] 62a_100000210211_100020667443 [1,0,1,0,0,0|1,0,1]=4 1782 B8R0.7 CCCCSCC(=O)[O-] 62a_100020667443_100000210210 [1,0,1,0,0,0|1,0,1]=4 1783 B8R0.7 CCCNOCC(=O)O 269956a_100000106656_100000210207 [1,0,1,0,0,0|2,0,0]=4 1784 B8R0.7 CCCOCCC(=O)C 1458a_100000070787_100011215938 [1,0,1,0,0,0|2,0,0]=4 1785 B8R0.7 CCCOCCC(=O)C 34a_100000759926_100000210303 [1,0,1,0,0,0|2,0,0]=4 1786 B8R0.7 CCCOCCC(=O)C 7a_100000759926_100000210303 [1,0,1,0,0,0|2,0,0]=4 1787 B8R0.7 CCCOCCC(=O)N 34a_100000210258_100000731001 [1,0,1,0,0,0|2,0,0]=4 1788 B8R0.7 CCCOCCC(=O)N 34a_100000757172_100000210303 [1,0,1,0,0,0|2,0,0]=4 1789 B8R0.7 CCCOCCC(=O)N 7a_100000757172_100000210303 [1,0,1,0,0,0|2,0,0]=4 1790 B8R0.7 CCCSCCC(=O)C 62a_100000053229_100000210303 [1,0,1,0,0,0|2,0,0]=4 1791 B8R0.7 CCCSCCC(=O)C 62a_100000210303_100000053229 [1,0,1,0,0,0|2,0,0]=4 1792 B8R0.7 CCCSCCC(=O)N 62a_100000210303_100000744528 [1,0,1,0,0,0|2,0,0]=4 1793 B8R0.7 CCCSCCC(=O)N 62a_100000744528_100000210303 [1,0,1,0,0,0|2,0,0]=4 1794 B8R0.7 CCNCCCC(=O)N 34a_100000739312_100000210202 [1,0,1,0,0,0|2,0,0]=4 1795 B8R0.7 CCOCCCC(=O)C 1458a_100000070787_100012232248 [1,0,1,0,0,0|2,0,0]=4 1796 B8R0.7 CCOCCCC(=O)C 34a_100000759063_100000210202 [1,0,1,0,0,0|2,0,0]=4 1797 B8R0.7 CCOCCCC(=O)C 34a_100121572206_100000685027 [1,0,1,0,0,0|2,0,0]=4 1798 B8R0.7 CCOCCCC(=O)C 7a_100000759063_100000210202 [1,0,1,0,0,0|2,0,0]=4 1799 B8R0.7 CCOCCCC(=O)N 34a_100121572206_100102525003 [1,0,1,0,0,0|2,0,0]=4 1800 B8R0.7 CCOCNCC(=O)O 269956a_100016091260_100000739092 [1,0,1,0,0,0|2,0,0]=4 1801 B8R0.7 CCSCCCC(=O)C 62a_100000210202_100011215641 [1,0,1,0,0,0|2,0,0]=4 1802 B8R0.7 CCSCCCC(=O)C 62a_100011215641_100000210202 [1,0,1,0,0,0|2,0,0]=4 1803 B8R0.7 CCSCCCC(=O)N 62a_100000210202_100102525003 [1,0,1,0,0,0|2,0,0]=4 1804 B8R0.7 CCSCCCC(=O)N 62a_100102525003_100000210202 [1,0,1,0,0,0|2,0,0]=4 1805 B8R0.7 CNCCCCC(=O)C 34a_100102657272_100009817362 [1,0,1,0,0,0|2,0,0]=4 1806 B8R0.7 CNCCCCC(=O)C 7a_106832991635_100000735457 [1,0,1,0,0,0|2,0,0]=4 1807 B8R0.7 CNCCCCC(=O)N 34a_100000696515_200000210301 [1,0,1,0,0,0|2,0,0]=4 1808 B8R0.7 CNCCOCC(=O)O 269956a_100000700818_200000210301 [1,0,1,0,0,0|2,0,0]=4 1809 B8R0.7 COCCCCC(=O)C 1458a_100000070787_100000755781 [1,0,1,0,0,0|2,0,0]=4 1810 B8R0.7 COCCCCC(=O)C 34a_100138415774_100009817362 [1,0,1,0,0,0|2,0,0]=4 1811 B8R0.7 COCCCCC(=O)N 34a_100012022536_200000210301 [1,0,1,0,0,0|2,0,0]=4 1812 B8R0.7 COCCCCC(=O)N 7a_100012022536_200000210301 [1,0,1,0,0,0|2,0,0]=4 1813 B8R0.7 COCCNCC(=O)O 269956a_100016091260_100000233755 [1,0,1,0,0,0|2,0,0]=4 1814 B8R0.7 CSCCCCC(=O)C 62a_100000735457_200000210301 [1,0,1,0,0,0|2,0,0]=4 1815 B8R0.7 CSCCCCC(=O)C 62a_200000210301_100000735457 [1,0,1,0,0,0|2,0,0]=4 1816 B8R0.7 CSCCNCC(=O)O 269956a_100016091260_100000212216 [1,0,1,0,0,0|2,0,0]=4 1817 B8R0.7 O=C(O)CNCCCF 269956a_100016091260_100011934791 [1,0,1,0,0,0|2,0,0]=4 1818 B8R0.7 O=C(O)CNCCCO 269956a_100016091260_100011215043 [1,0,1,0,0,0|2,0,0]=4 1819 B8R0.7 [13CH3]C(=O)CCCCCO 1458a_100102619762_200025704644 [1,0,1,0,0,0|2,0,0]=4 1820 B8R0.7 [13CH3]NCCCCC(=O)N 34a_100000696515_200025704644 [1,0,1,0,0,0|2,0,0]=4 1821 B8R0.7 [13CH3]NCCOCC(=O)O 269956a_100000700818_200025704644 [1,0,1,0,0,0|2,0,0]=4 1822 B8R0.7 [13CH3]OCCCCC(=O)N 34a_100012022536_200025704644 [1,0,1,0,0,0|2,0,0]=4 1823 B8R0.7 [13CH3]OCCCCC(=O)N 7a_100012022536_200025704644 [1,0,1,0,0,0|2,0,0]=4 1824 B8R0.1 C=CCC(C)COCC 34a_100009832082_100000210202 [1,0,1,0,0,0|2,0,0]=4 1825 B8R0.1 C=CCC(C)COCC 7a_100009832082_100000210202 [1,0,1,0,0,0|2,0,0]=4 1826 B8R0.1 C=CCN(C)CCCC 2230a_100000207549_100000210623 [1,0,1,0,0,0|2,0,0]=4 1827 B8R0.1 C=CCN(C)CCCC 2230a_100000225617_100000210211 [1,0,1,0,0,0|2,0,0]=4 1828 B8R0.1 C=CCN(C)CCCC 269982a_100000207549_100000210623 [1,0,1,0,0,0|2,0,0]=4 1829 B8R0.1 C=CCN(C)CCCC 269982a_100000225617_100000210211 [1,0,1,0,0,0|2,0,0]=4 1830 B8R0.1 C=CC[C@@H](C)OCCC 34a_100000731007_100000210303 [1,0,1,0,0,0|2,0,0]=4 1831 B8R0.1 C=CC[C@@H](C)OCCC 7a_100000731007_100000210303 [1,0,1,0,0,0|2,0,0]=4 1832 B8R0.1 CCCCC(C)COC 34a_100011995851_200000210301 [1,0,1,0,0,0|2,0,0]=4 1833 B8R0.1 CCCCC(C)COC 7a_100011995851_200000210301 [1,0,1,0,0,0|2,0,0]=4 1834 B8R0.1 CCCCC(C)CO[13CH3] 34a_100011995851_200025704644 [1,0,1,0,0,0|2,0,0]=4 1835 B8R0.1 CCCCC(C)CO[13CH3] 7a_100011995851_200025704644 [1,0,1,0,0,0|2,0,0]=4 1836 B8R0.1 CCCCN(C)CC=O 2230a_100000207549_200015260668 [1,0,1,0,0,0|1,0,0]=3 1837 B8R0.1 CCCCN(C)CC=O 269982a_100000207549_200015260668 [1,0,1,0,0,0|1,0,0]=3 1838 B8R0.1 CCCCN(C)CCO 2230a_100000198060_200000210301 [1,0,1,0,0,0|1,0,1]=4 1839 B8R0.1 CCCCN(C)CCO 2230a_100000207549_100000211926 [1,0,1,0,0,0|1,0,1]=4 1840 B8R0.1 CCCCN(C)CCO 2230a_100000210263_100000210211 [1,0,1,0,0,0|1,0,1]=4 1841 B8R0.1 CCCCN(C)CCO 269982a_100000198060_200000210301 [1,0,1,0,0,0|1,0,1]=4 1842 B8R0.1 CCCCN(C)CCO 269982a_100000207549_100000211926 [1,0,1,0,0,0|1,0,1]=4 1843 B8R0.1 CCCCN(C)CCO 269982a_100000210263_100000210211 [1,0,1,0,0,0|1,0,1]=4 1844 B8R0.1 CCCCN([13CH3])CCO 2230a_100000198060_200025704644 [1,0,1,0,0,0|1,0,1]=4 1845 B8R0.1 CCCCN([13CH3])CCO 269982a_100000198060_200025704644 [1,0,1,0,0,0|1,0,1]=4 1846 B8R0.1 CCCN[C@H](C)CCO 2230a_100000706166_100000210303 [1,0,1,0,0,0|1,0,1]=4 1847 B8R0.1 CCCN[C@H](C)CCO 34a_100000706166_100000210303 [1,0,1,0,0,0|1,0,1]=4 1848 B8R0.1 CCCOC(C)CCO 34a_100000210258_100009893172 [1,0,1,0,0,0|1,0,1]=4 1849 B8R0.1 CCCSC(C)CCO 62a_100000210303_100009893172 [1,0,1,0,0,0|1,0,1]=4 1850 B8R0.1 CCCSC(C)CCO 62a_100009893172_100000210303 [1,0,1,0,0,0|1,0,1]=4 1851 B8R0.1 CN(CC=O)CCCO 2230a_100000213112_200015260668 [1,0,1,0,0,0|2,0,0]=4 1852 B8R0.1 CN(CC=O)CCCO 269982a_100000213112_200015260668 [1,0,1,0,0,0|2,0,0]=4 1853 B8R0.1 COCCN(C)CC=O 2230a_100000743101_200015260668 [1,0,1,0,0,0|2,0,0]=4 1854 B8R0.1 COCCN(C)CC=O 269982a_100000743101_200015260668 [1,0,1,0,0,0|2,0,0]=4 1855 B8R0.1 CSCCN(C)CC=O 2230a_100000686725_200015260668 [1,0,1,0,0,0|2,0,0]=4 1856 B8R0.1 CSCCN(C)CC=O 269982a_100000686725_200015260668 [1,0,1,0,0,0|2,0,0]=4 1857 B8R0.5 CCCC(C)CC(=O)C 1458a_100000070787_100011216630 [1,0,1,0,0,0|1,0,0]=3 1858 B8R0.5 CCCC(C)CC(=O)C 1458a_100000748435_200000210301 [1,0,1,0,0,0|1,0,0]=3 1859 B8R0.5 CCCC(C)CC(=O)[13CH3] 1458a_100000748435_200025704644 [1,0,1,0,0,0|1,0,0]=3 1860 B8R0.5 CCCC(C)NC(=O)C 11a_100000741246_100015343762 [1,0,1,0,0,0|2,0,0]=4 1861 B8R0.5 CCCC(C)NC(=O)C 1626a_100000741246_100015343762 [1,0,1,0,0,0|2,0,0]=4 1862 B8R0.5 CCCC(C)NC(=O)C 240690a_100000741246_100015343762 [1,0,1,0,0,0|2,0,0]=4 1863 B8R0.5 CCCC(C)NC(=O)C 527a_100000741246_100103153847 [1,0,1,0,0,0|2,0,0]=4 1864 B8R0.5 CCCN(C)CC(=O)N 2230a_100000739694_100000210303 [1,0,1,0,0,0|2,0,0]=4 1865 B8R0.5 CCCN(C)CC(=O)N 2230a_100000747261_100000747473 [1,0,1,0,0,0|2,0,0]=4 1866 B8R0.5 CCCN(C)CC(=O)N 269982a_100000747261_100000187820 [1,0,1,0,0,0|2,0,0]=4 1867 B8R0.5 CCCN(C)CC(=O)O 269956a_100000746989_100000210207 [1,0,1,0,0,0|1,0,0]=3 1868 B8R0.5 CCCN(C)CC(=O)[O-] 269982a_100000747261_100020667443 [1,0,1,0,0,0|1,0,1]=4 1869 B8R0.5 CCSC(C)CC(=O)C 1458a_200011311441_200000210301 [1,0,1,0,0,0|2,0,0]=4 1870 B8R0.5 CCSC(C)CC(=O)[13CH3] 1458a_200011311441_200025704644 [1,0,1,0,0,0|2,0,0]=4 1871 B8R0.5 CN(CCF)CC(=O)O 269956a_100000746989_100011217306 [1,0,1,0,0,0|2,0,0]=4 1872 B8R0.5 CN(CCO)CC(=O)O 269956a_100000746989_100000211926 [1,0,1,0,0,0|2,0,0]=4 1873 B8R0.5 CN(CCO)CC(=O)O 269956a_100000747938_200000210301 [1,0,1,0,0,0|2,0,0]=4 1874 B8R0.5 CNCC(O)CC(=O)O 269956a_100011218706_200000210301 [1,0,1,0,0,0|2,0,0]=4 1875 B8R0.5 COCN(C)CC(=O)O 269956a_100000746989_100000766300 [1,0,1,0,0,0|2,0,0]=4 1876 B8R0.5 CSCN(C)CC(=O)O 269956a_100000746989_100011218213 [1,0,1,0,0,0|2,0,0]=4 1877 B8R0.5 [13CH3]N(CCO)CC(=O)O 269956a_100000747938_200025704644 [1,0,1,0,0,0|2,0,0]=4 1878 B8R0.5 [13CH3]NCC(O)CC(=O)O 269956a_100011218706_200025704644 [1,0,1,0,0,0|2,0,0]=4 1879 B8R0.16 CCC(CC)CC(=O)C 1458a_100000070787_100011215472 [1,0,1,0,0,0|1,0,0]=3 1880 B8R0.16 CCC(CC)NC(=O)C 11a_100000199018_100015343762 [1,0,1,0,0,0|2,0,0]=4 1881 B8R0.16 CCC(CC)NC(=O)C 1626a_100000199018_100015343762 [1,0,1,0,0,0|2,0,0]=4 1882 B8R0.16 CCC(CC)NC(=O)C 240690a_100000199018_100015343762 [1,0,1,0,0,0|2,0,0]=4 1883 B8R0.16 CCC(CC)NC(=O)C 527a_100000199018_100103153847 [1,0,1,0,0,0|2,0,0]=4 1884 B8R0.16 CCN(CC)CC(=O)C 1458a_100000758533_200000210301 [1,0,1,0,0,0|2,0,0]=4 1885 B8R0.16 CCN(CC)CC(=O)N 2230a_100000724800_100000747473 [1,0,1,0,0,0|2,0,0]=4 1886 B8R0.16 CCN(CC)CC(=O)N 269956a_100000042499_100000187820 [1,0,1,0,0,0|2,0,0]=4 1887 B8R0.16 CCN(CC)CC(=O)N 269982a_100000724800_100000187820 [1,0,1,0,0,0|2,0,0]=4 1888 B8R0.16 CCN(CC)CC(=O)O 269956a_100000746405_100000210202 [1,0,1,0,0,0|1,0,0]=3 1889 B8R0.16 CCN(CC)CC(=O)[13CH3] 1458a_100000758533_200025704644 [1,0,1,0,0,0|2,0,0]=4 1890 B8R0.16 CCN(CC)CC(=O)[O-] 269956a_100000042499_100020667443 [1,0,1,0,0,0|1,0,1]=4 1891 B8R0.16 CCN(CC)CC(=O)[O-] 269982a_100000724800_100020667443 [1,0,1,0,0,0|1,0,1]=4 1892 B8R0.16 CCN(CF)CC(=O)O 269956a_100000746405_100015361967 [1,0,1,0,0,0|2,0,0]=4 1893 B8R0.16 CC[C@H](CC(=O)O)NC 269956a_100016995926_200000210301 [1,0,1,0,0,0|1,0,0]=3 1894 B8R0.16 CC[C@H](CC(=O)O)N[13CH3] 269956a_100016995926_200025704644 [1,0,1,0,0,0|1,0,0]=3 1895 B8R0.16 CN[C@H](CO)CC(=O)O 269956a_100009816507_200000210301 [1,0,1,0,0,0|2,0,0]=4 1896 B8R0.16 [13CH3]N[C@H](CO)CC(=O)O 269956a_100009816507_200025704644 [1,0,1,0,0,0|2,0,0]=4 1897 B8R0.22 C=CCC(CCC)OC 34a_100011215139_200000210301 [1,0,1,0,0,0|2,0,0]=4 1898 B8R0.22 C=CCC(CCC)OC 7a_100011215139_200000210301 [1,0,1,0,0,0|2,0,0]=4 1899 B8R0.22 C=CCC(CCC)O[13CH3] 34a_100011215139_200025704644 [1,0,1,0,0,0|2,0,0]=4 1900 B8R0.22 C=CCC(CCC)O[13CH3] 7a_100011215139_200025704644 [1,0,1,0,0,0|2,0,0]=4 1901 B8R0.22 C=CCN(CC)CCC 2230a_100000226822_100000210623 [1,0,1,0,0,0|2,0,0]=4 1902 B8R0.22 C=CCN(CC)CCC 269982a_100000226822_100000210623 [1,0,1,0,0,0|2,0,0]=4 1903 B8R0.22 CCCN(CC)CC=O 2230a_100000226822_200015260668 [1,0,1,0,0,0|1,0,0]=3 1904 B8R0.22 CCCN(CC)CC=O 269982a_100000226822_200015260668 [1,0,1,0,0,0|1,0,0]=3 1905 B8R0.22 CCCN(CC)CCO 2230a_100000210973_100000210303 [1,0,1,0,0,0|1,0,1]=4 1906 B8R0.22 CCCN(CC)CCO 2230a_100000211420_100000210202 [1,0,1,0,0,0|1,0,1]=4 1907 B8R0.22 CCCN(CC)CCO 2230a_100000226822_100000211926 [1,0,1,0,0,0|1,0,1]=4 1908 B8R0.22 CCCN(CC)CCO 269982a_100000210973_100000210303 [1,0,1,0,0,0|1,0,1]=4 1909 B8R0.22 CCCN(CC)CCO 269982a_100000211420_100000204670 [1,0,1,0,0,0|1,0,1]=4 1910 B8R0.22 CCCN(CC)CCO 269982a_100000226822_100000211926 [1,0,1,0,0,0|1,0,1]=4 1911 B8R0.22 CCC[C@@H](CCO)NC 2230a_100015193777_200000210301 [1,0,1,0,0,0|1,0,1]=4 1912 B8R0.22 CCC[C@@H](CCO)NC 34a_100015193777_200000210301 [1,0,1,0,0,0|1,0,1]=4 1913 B8R0.22 CCC[C@@H](CCO)N[13CH3] 2230a_100015193777_200025704644 [1,0,1,0,0,0|1,0,1]=4 1914 B8R0.22 CCC[C@@H](CCO)N[13CH3] 34a_100015193777_200025704644 [1,0,1,0,0,0|1,0,1]=4 1915 B8R0.22 CCN(CC=O)CCO 2230a_100000210973_200015260668 [1,0,1,0,0,0|2,0,0]=4 1916 B8R0.22 CCN(CC=O)CCO 269982a_100000210973_200015260668 [1,0,1,0,0,0|2,0,0]=4 1917 B8R1.2 CNC1CCCCC1 2230a_100000182618_200000210301 [2,0,0,0,0,0|1,0,1]=4 1918 B8R1.2 CNC1CCCCC1 270004a_106832991635_100000210434 [2,0,0,0,0,0|1,0,1]=4 1919 B8R1.2 CNC1CCCCC1 34a_100000182618_200000210301 [2,0,0,0,0,0|1,0,1]=4 1920 B8R1.2 CNC1CCCCC1 34a_100102657272_100000210327 [2,0,0,0,0,0|1,0,1]=4 1921 B8R1.2 CNC1CCCCC1 7a_106832991635_100000210327 [2,0,0,0,0,0|1,0,1]=4 1922 B8R1.2 COC1CCCCC1 34a_100000210231_200000210301 [2,0,0,0,0,0|1,0,1]=4 1923 B8R1.2 COC1CCCCC1 34a_100138415774_100000210327 [2,0,0,0,0,0|1,0,1]=4 1924 B8R1.2 COC1CCCCC1 7a_100000210231_200000210301 [2,0,0,0,0,0|1,0,1]=4 1925 B8R1.2 CSC1CCCCC1 62a_100000210327_200000210301 [2,0,0,0,0,0|1,0,1]=4 1926 B8R1.2 CSC1CCCCC1 62a_200000210301_100000210327 [2,0,0,0,0,0|1,0,1]=4 1927 B8R1.2 [13CH3]NC1CCCCC1 2230a_100000182618_200025704644 [2,0,0,0,0,0|1,0,1]=4 1928 B8R1.2 [13CH3]NC1CCCCC1 34a_100000182618_200025704644 [2,0,0,0,0,0|1,0,1]=4 1929 B8R1.2 [13CH3]OC1CCCCC1 34a_100000210231_200025704644 [2,0,0,0,0,0|1,0,1]=4 1930 B8R1.2 [13CH3]OC1CCCCC1 7a_100000210231_200025704644 [2,0,0,0,0,0|1,0,1]=4 1931 B8R1.2 [13CH3]SC1CCCCC1 62a_100000210327_200025704644 [2,0,0,0,0,0|1,0,1]=4 1932 B8R1.2 [13CH3]SC1CCCCC1 62a_200025704644_100000210327 [2,0,0,0,0,0|1,0,1]=4 1933 B10R0.3 CCCC(=O)CCCC(=O)C 1458a_100000211992_100011215641 [0,1,1,0,0,0|1,0,1]=4 1934 B10R0.3 CCCC(=O)CCCC(=O)N 1458a_100000211992_100102525003 [0,1,1,0,0,0|1,0,1]=4 1935 B10R0.3 CCCC(=O)CNCC(=O)O 269956a_100016091260_100000747444 [0,1,1,0,0,0|1,0,1]=4 1936 B10R0.3 CCCC(C)CNCC(=O)N 2230a_100000711301_100011216630 [0,1,1,0,0,0|2,0,0]=4 1937 B10R0.3 CCCC(C)CNCC(=O)O 269956a_100016091260_100011216630 [0,1,1,0,0,0|1,0,0]=3 1938 B10R0.3 CCCC(C)COCC(=O)C 34a_100000211253_100011216630 [0,1,1,0,0,0|2,0,0]=4 1939 B10R0.3 CCCC(C)COCC(=O)N 34a_100000688023_100000187820 [0,1,1,0,0,0|2,0,0]=4 1940 B10R0.3 CCCC(C)COCC(=O)N 7a_100000688023_100000187820 [0,1,1,0,0,0|2,0,0]=4 1941 B10R0.3 CCCC(C)COCC(=O)[O-] 34a_100000688023_100020667443 [0,1,1,0,0,0|1,0,1]=4 1942 B10R0.3 CCCC(C)CSCC(=O)N 62a_100000747473_100011216630 [0,1,1,0,0,0|2,0,0]=4 1943 B10R0.3 CCCC(C)CSCC(=O)N 62a_100011216630_100000747473 [0,1,1,0,0,0|2,0,0]=4 1944 B10R0.3 CCCC(C)CSCC(=O)[O-] 62a_100011216630_100020667443 [0,1,1,0,0,0|1,0,1]=4 1945 B10R0.3 CCCC(C)CSCC(=O)[O-] 62a_100020667443_100011216630 [0,1,1,0,0,0|1,0,1]=4 1946 B10R0.3 CCCC(C)NCCC(=O)N 2230a_100000741246_100000744528 [0,1,1,0,0,0|2,0,0]=4 1947 B10R0.3 CCCC(C)NOCC(=O)O 269956a_100000106656_100000766640 [0,1,1,0,0,0|2,0,0]=4 1948 B10R0.3 CCCC(C)OCCC(=O)C 34a_100000759926_100000766640 [0,1,1,0,0,0|2,0,0]=4 1949 B10R0.3 CCCC(C)OCCC(=O)C 7a_100000759926_100000766640 [0,1,1,0,0,0|2,0,0]=4 1950 B10R0.3 CCCC(C)OCCC(=O)C 7a_100000764384_100000053229 [0,1,1,0,0,0|2,0,0]=4 1951 B10R0.3 CCCC(C)OCCC(=O)N 34a_100000757172_100000766640 [0,1,1,0,0,0|2,0,0]=4 1952 B10R0.3 CCCC(C)OCCC(=O)N 34a_100000764384_100000731001 [0,1,1,0,0,0|2,0,0]=4 1953 B10R0.3 CCCC(C)OCCC(=O)N 7a_100000757172_100000766640 [0,1,1,0,0,0|2,0,0]=4 1954 B10R0.3 CCCC(C)OCCC(=O)N 7a_100000764384_100000744528 [0,1,1,0,0,0|2,0,0]=4 1955 B10R0.3 CCCC(C)SCCC(=O)C 62a_100000053229_100000766640 [0,1,1,0,0,0|2,0,0]=4 1956 B10R0.3 CCCC(C)SCCC(=O)C 62a_100000766640_100000053229 [0,1,1,0,0,0|2,0,0]=4 1957 B10R0.3 CCCC(C)SCCC(=O)N 62a_100000744528_100000766640 [0,1,1,0,0,0|2,0,0]=4 1958 B10R0.3 CCCC(C)SCCC(=O)N 62a_100000766640_100000744528 [0,1,1,0,0,0|2,0,0]=4 1959 B10R0.3 CCCN(C)CCCC(=O)C 269982a_100000747261_100011215641 [0,1,1,0,0,0|2,0,0]=4 1960 B10R0.3 CCCN(C)CCCC(=O)N 269982a_100000747261_100102525003 [0,1,1,0,0,0|2,0,0]=4 1961 B10R0.3 CCCN(C)CCCC(=O)O 269956a_100000719178_100000210207 [0,1,1,0,0,0|1,0,0]=3 1962 B10R0.3 CCC[C@H](N)COCC(=O)N 34a_100000732646_100000187820 [0,1,1,0,0,0|2,0,0]=4 1963 B10R0.3 CCC[C@H](N)COCC(=O)[O-] 34a_100000732646_100020667443 [0,1,1,0,0,0|1,0,1]=4 1964 B10R0.3 CCOC(C)CCCC(=O)[O-] 7a_100000761597_100000210202 [0,1,1,0,0,0|1,0,1]=4 1965 B10R0.3 CN(CCF)CCCC(=O)O 269956a_100000719178_100011217306 [0,1,1,0,0,0|2,0,0]=4 1966 B10R0.3 CN(CCO)CCCC(=O)O 269956a_100000719178_100000211926 [0,1,1,0,0,0|2,0,0]=4 1967 B10R0.3 COCC(O)CNCC(=O)O 269956a_100016091260_100011215053 [0,1,1,0,0,0|2,0,0]=4 1968 B10R0.3 COCN(C)CCCC(=O)O 269956a_100000719178_100000766300 [0,1,1,0,0,0|2,0,0]=4 1969 B10R0.3 CSCN(C)CCCC(=O)O 269956a_100000719178_100011218213 [0,1,1,0,0,0|2,0,0]=4 1970 B10R0.4 C#CCCCCCCC(=O)C 1458a_100000034748_200000210301 [0,1,1,0,0,0|1,0,1]=4 1971 B10R0.4 C#CCCCCCCC(=O)C 1458a_100000070787_100012276617 [0,1,1,0,0,0|1,0,1]=4 1972 B10R0.4 C#CCCCCCCC(=O)[13CH3] 1458a_100000034748_200025704644 [0,1,1,0,0,0|1,0,1]=4 1973 B10R0.4 C#CCCCCNCC(=O)O 269956a_100016091260_100010269958 [0,1,1,0,0,0|0,0,2]=4 1974 B10R0.4 C=C(Br)CCOCCCCC 34a_100009813270_100000718602 [0,1,1,0,0,0|2,0,0]=4 1975 B10R0.4 C=C(C)CCNCCCCC 2230a_100000209983_100000730704 [0,1,1,0,0,0|2,0,0]=4 1976 B10R0.4 C=C(C)CCOCCCCC 34a_100000210253_100000730704 [0,1,1,0,0,0|2,0,0]=4 1977 B10R0.4 C=C(C)CCOCCCCC 34a_100000764851_100000718602 [0,1,1,0,0,0|2,0,0]=4 1978 B10R0.4 C=C(C)CCOCCCCC 7a_100000210253_100000730704 [0,1,1,0,0,0|2,0,0]=4 1979 B10R0.4 C=C(C)CCSCCCCC 62a_100000210326_100000730704 [0,1,1,0,0,0|2,0,0]=4 1980 B10R0.4 C=C(C)CCSCCCCC 62a_100000730704_100000210326 [0,1,1,0,0,0|2,0,0]=4 1981 B10R0.4 C=C(C)CNCCCCCC 2230a_100000210581_100000748629 [0,1,1,0,0,0|2,0,0]=4 1982 B10R0.4 C=C(C)COCCCCCC 34a_100000210245_100000210314 [0,1,1,0,0,0|2,0,0]=4 1983 B10R0.4 C=C(C)COCCCCCC 34a_100000210259_100000748629 [0,1,1,0,0,0|2,0,0]=4 1984 B10R0.4 C=C(C)COCCCCCC 7a_100000210259_100000748629 [0,1,1,0,0,0|2,0,0]=4 1985 B10R0.4 C=C(C)CSCCCCCC 62a_100000210314_100000211660 [0,1,1,0,0,0|2,0,0]=4 1986 B10R0.4 C=C(C)CSCCCCCC 62a_100000748629_100000210757 [0,1,1,0,0,0|2,0,0]=4 1987 B10R0.4 C=C(F)CNCCCCCC 2230a_100000210581_100009893438 [0,1,1,0,0,0|2,0,0]=4 1988 B10R0.4 C=C(F)COCCCCCC 34a_100000210259_100009893438 [0,1,1,0,0,0|2,0,0]=4 1989 B10R0.4 C=C(F)COCCCCCC 34a_200010262243_100000210314 [0,1,1,0,0,0|2,0,0]=4 1990 B10R0.4 C=C(F)COCCCCCC 7a_100000210259_100000042424 [0,1,1,0,0,0|2,0,0]=4 1991 B10R0.4 C=C(F)CSCCCCCC 62a_100000042424_100000210757 [0,1,1,0,0,0|2,0,0]=4 1992 B10R0.4 C=C(F)CSCCCCCC 62a_100000210314_100000042424 [0,1,1,0,0,0|2,0,0]=4 1993 B10R0.4 C=CCCCCCCC(=O)C 1458a_100000070787_100011215473 [0,1,1,0,0,0|1,0,1]=4 1994 B10R0.4 C=CCCCCCCC(=O)C 1458a_100011809334_200000210301 [0,1,1,0,0,0|1,0,1]=4 1995 B10R0.4 C=CCCCCCCC(=O)[13CH3] 1458a_100011809334_200025704644 [0,1,1,0,0,0|1,0,1]=4 1996 B10R0.4 C=CCCCCNCC(=O)O 269956a_100016091260_100011215482 [0,1,1,0,0,0|0,0,2]=4 1997 B10R0.4 CC(=O)CCCCCCC#N 1458a_100000070787_100009813337 [0,1,1,0,0,0|1,0,1]=4 1998 B10R0.4 CC(=O)CCCCCCCO 1458a_100000070787_100000760002 [0,1,1,0,0,0|1,0,0]=3 1999 B10R0.4 CC(=O)CCCCCCCO 1458a_100011219782_200000210301 [0,1,1,0,0,0|1,0,0]=3 2000 B10R0.4 CC(=O)CCCCNCCF 34a_100000724931_100009817362 [0,1,1,0,0,0|2,0,0]=4 2001 B10R0.4 CC(=O)CCCCNCCO 34a_100016990907_100009817362 [0,1,1,0,0,0|2,0,0]=4 2002 B10R0.4 CC(=O)CCCCOCCBr 34a_100000211926_100009817362 [0,1,1,0,0,0|2,0,0]=4 2003 B10R0.4 CC(=O)CCCCOCCN 34a_100000210304_100009817362 [0,1,1,0,0,0|2,0,0]=4 2004 B10R0.4 CC(=O)CCCCSCCF 62a_100000735457_100011217306 [0,1,1,0,0,0|2,0,0]=4 2005 B10R0.4 CC(=O)CCCCSCCF 62a_100011217306_100000735457 [0,1,1,0,0,0|2,0,0]=4 2006 B10R0.4 CC(=O)CCCCSCCO 62a_100000211926_100000735457 [0,1,1,0,0,0|2,0,0]=4 2007 B10R0.4 CC(=O)CCCCSCCO 62a_100000735457_100000211926 [0,1,1,0,0,0|2,0,0]=4 2008 B10R0.4 CC(=O)CCCNCCCF 34a_100015189416_100000685027 [0,1,1,0,0,0|2,0,0]=4 2009 B10R0.4 CC(=O)CCCOCCCBr 34a_100011217188_100000685027 [0,1,1,0,0,0|2,0,0]=4 2010 B10R0.4 CC(=O)CCCOCCCCl 34a_100000230001_100000685027 [0,1,1,0,0,0|2,0,0]=4 2011 B10R0.4 CC(=O)CCCOCCCF 34a_100000759063_100011934791 [0,1,1,0,0,0|2,0,0]=4 2012 B10R0.4 CC(=O)CCCOCCCF 34a_100000759539_100000685027 [0,1,1,0,0,0|2,0,0]=4 2013 B10R0.4 CC(=O)CCCOCCCF 7a_100000759063_100011934791 [0,1,1,0,0,0|2,0,0]=4 2014 B10R0.4 CC(=O)CCCOCCCN 34a_100000182051_100000685027 [0,1,1,0,0,0|2,0,0]=4 2015 B10R0.4 CC(=O)CCCOCCCO 34a_100000759063_100000230001 [0,1,1,0,0,0|2,0,0]=4 2016 B10R0.4 CC(=O)CCCOCCCO 7a_100000759063_100011215043 [0,1,1,0,0,0|2,0,0]=4 2017 B10R0.4 CC(=O)CCCSCCCF 62a_100011215641_100011934791 [0,1,1,0,0,0|2,0,0]=4 2018 B10R0.4 CC(=O)CCCSCCCF 62a_100011934791_100011215641 [0,1,1,0,0,0|2,0,0]=4 2019 B10R0.4 CC(=O)CCCSCCCO 62a_100011215043_100011215641 [0,1,1,0,0,0|2,0,0]=4 2020 B10R0.4 CC(=O)CCCSCCCO 62a_100011215641_100011215043 [0,1,1,0,0,0|2,0,0]=4 2021 B10R0.4 CC(=O)CCOCCCCCl 7a_100000210776_100000053229 [0,1,1,0,0,0|2,0,0]=4 2022 B10R0.4 CC(=O)CCOCCCCF 34a_100000759926_100000729493 [0,1,1,0,0,0|2,0,0]=4 2023 B10R0.4 CC(=O)CCOCCCCF 7a_100000759926_100000729493 [0,1,1,0,0,0|2,0,0]=4 2024 B10R0.4 CC(=O)CCOCCCCF 7a_100011995726_100000053229 [0,1,1,0,0,0|2,0,0]=4 2025 B10R0.4 CC(=O)CCOCCCCO 34a_100000759926_100011216708 [0,1,1,0,0,0|2,0,0]=4 2026 B10R0.4 CC(=O)CCOCCCCO 7a_100000759926_100000210776 [0,1,1,0,0,0|2,0,0]=4 2027 B10R0.4 CC(=O)CCSCCCCF 62a_100000053229_100000729493 [0,1,1,0,0,0|2,0,0]=4 2028 B10R0.4 CC(=O)CCSCCCCF 62a_100000729493_100000053229 [0,1,1,0,0,0|2,0,0]=4 2029 B10R0.4 CC(=O)CCSCCCCO 62a_100000053229_100000210776 [0,1,1,0,0,0|2,0,0]=4 2030 B10R0.4 CC(=O)CCSCCCCO 62a_100000210776_100000053229 [0,1,1,0,0,0|2,0,0]=4 2031 B10R0.4 CC(=O)COCCCCCF 34a_100000211253_100000729378 [0,1,1,0,0,0|2,0,0]=4 2032 B10R0.4 CC(=O)COCCCCCO 34a_100000211253_100000746330 [0,1,1,0,0,0|2,0,0]=4 2033 B10R0.4 CC(=O)NCCCCCCO 240690a_100000686447_100015343762 [0,1,1,0,0,0|2,0,0]=4 2034 B10R0.4 CC(=O)NCCCCCCO 527a_100000686447_100103153847 [0,1,1,0,0,0|2,0,0]=4 2035 B10R0.4 CC(=O)NCCCCCN[13CH3] 2230a_200012022750_200025704644 [0,1,1,0,0,0|2,0,0]=4 2036 B10R0.4 CC(=O)NCCCCCN[13CH3] 34a_200012022750_200025704644 [0,1,1,0,0,0|2,0,0]=4 2037 B10R0.4 CC(=O)OCCCCCS[13CH3] 62a_100000033007_200025704644 [0,1,1,0,0,0|2,0,0]=4 2038 B10R0.4 CC(=O)OCCCCCS[13CH3] 62a_200025704644_100000033007 [0,1,1,0,0,0|2,0,0]=4 2039 B10R0.4 CC/C=C\CCNCC(=O)O 269956a_100016091260_100015370543 [0,1,1,0,0,0|0,0,2]=4 2040 B10R0.4 CCCCC/C=C/CC(=O)C 1458a_100020675968_200000210301 [0,1,1,0,0,0|1,0,1]=4 2041 B10R0.4 CCCCC/C=C/CC(=O)[13CH3] 1458a_100020675968_200025704644 [0,1,1,0,0,0|1,0,1]=4 2042 B10R0.4 CCCCCC#CCC(=O)C 1458a_100000070787_100009816472 [0,1,1,0,0,0|1,0,1]=4 2043 B10R0.4 CCCCCCC=CC(=O)C 1458a_200015324643_200000210301 [0,1,1,0,0,0|1,0,1]=4 2044 B10R0.4 CCCCCCC=CC(=O)[13CH3] 1458a_200015324643_200025704644 [0,1,1,0,0,0|1,0,1]=4 2045 B10R0.4 CCCCCCCCC(=O)C 1458a_100000070787_100000210759 [0,1,1,0,0,0|1,0,0]=3 2046 B10R0.4 CCCCCCCCC(=O)C 1458a_100000210188_200000210301 [0,1,1,0,0,0|1,0,0]=3 2047 B10R0.4 CCCCCCCCC(=O)[13CH3] 1458a_100000210188_200025704644 [0,1,1,0,0,0|1,0,0]=3 2048 B10R0.4 CCCCCCCNC(=O)C 11a_100000229938_100015343762 [0,1,1,0,0,0|1,0,0]=3 2049 B10R0.4 CCCCCCCNC(=O)C 1626a_100000229938_100015343762 [0,1,1,0,0,0|1,0,0]=3 2050 B10R0.4 CCCCCCCNC(=O)C 240690a_100000229938_100015343762 [0,1,1,0,0,0|1,0,0]=3 2051 B10R0.4 CCCCCCCNC(=O)C 527a_100000229938_100103153847 [0,1,1,0,0,0|1,0,0]=3 2052 B10R0.4 CCCCCCNCC(=O)N 2230a_100000210581_100000747473 [0,1,1,0,0,0|1,0,0]=3 2053 B10R0.4 CCCCCCNCC(=O)N 2230a_100000711301_100000210314 [0,1,1,0,0,0|1,0,0]=3 2054 B10R0.4 CCCCCCNCC(=O)O 269956a_100016091260_100000210757 [0,1,1,0,0,0|0,0,0]=2 2055 B10R0.4 CCCCCCNCC(C)O 2230a_100000210581_100011218427 [0,1,1,0,0,0|1,0,1]=4 2056 B10R0.4 CCCCCCNCC(C)O 2230a_100000210904_100000210314 [0,1,1,0,0,0|1,0,1]=4 2057 B10R0.4 CCCCCCNCC(C)O 34a_100000210904_100000210314 [0,1,1,0,0,0|1,0,1]=4 2058 B10R0.4 CCCCCCNC[C@@H](C)O 2230a_100000210581_100009817552 [0,1,1,0,0,0|1,0,1]=4 2059 B10R0.4 CCCCCCOCC(=O)C 34a_100000211253_100000210314 [0,1,1,0,0,0|1,0,0]=3 2060 B10R0.4 CCCCCCOCC(=O)N 34a_100000210259_100000187820 [0,1,1,0,0,0|1,0,0]=3 2061 B10R0.4 CCCCCCOCC(=O)N 7a_100000210259_100000187820 [0,1,1,0,0,0|1,0,0]=3 2062 B10R0.4 CCCCCCOCC(=O)[O-] 34a_100000210259_100020667443 [0,1,1,0,0,0|0,0,1]=3 2063 B10R0.4 CCCCCCOCC(C)O 34a_100000210259_100011218427 [0,1,1,0,0,0|1,0,1]=4 2064 B10R0.4 CCCCCCOCC(C)O 7a_100000210259_100011218427 [0,1,1,0,0,0|1,0,1]=4 2065 B10R0.4 CCCCCCOC[C@@H](C)O 34a_100000210259_100009817552 [0,1,1,0,0,0|1,0,1]=4 2066 B10R0.4 CCCCCCOC[C@@H](C)O 7a_100000210259_100009817552 [0,1,1,0,0,0|1,0,1]=4 2067 B10R0.4 CCCCCCOC[N+](=O)[O-] 34a_100000210259_100000761209 [0,1,1,0,0,0|1,0,1]=4 2068 B10R0.4 CCCCCCSCC(=O)N 62a_100000210314_100000747473 [0,1,1,0,0,0|1,0,0]=3 2069 B10R0.4 CCCCCCSCC(=O)N 62a_100000747473_100000210757 [0,1,1,0,0,0|1,0,0]=3 2070 B10R0.4 CCCCCCSCC(=O)[O-] 62a_100000210314_100020667443 [0,1,1,0,0,0|0,0,1]=3 2071 B10R0.4 CCCCCCSCC(=O)[O-] 62a_100020667443_100000210757 [0,1,1,0,0,0|0,0,1]=3 2072 B10R0.4 CCCCCCSCC(C)O 62a_100000210314_100011218427 [0,1,1,0,0,0|1,0,1]=4 2073 B10R0.4 CCCCCCSCC(C)O 62a_100011218427_100000210757 [0,1,1,0,0,0|1,0,1]=4 2074 B10R0.4 CCCCCCSC[C@@H](C)O 62a_100000210314_100009817552 [0,1,1,0,0,0|1,0,1]=4 2075 B10R0.4 CCCCCCSC[C@@H](C)O 62a_100009817552_100000210757 [0,1,1,0,0,0|1,0,1]=4 2076 B10R0.4 CCCCCCSC[N+](=O)[O-] 62a_100000210314_100000761209 [0,1,1,0,0,0|1,0,1]=4 2077 B10R0.4 CCCCCNCCC(=O)N 2230a_100000209983_100000744528 [0,1,1,0,0,0|1,0,0]=3 2078 B10R0.4 CCCCCNCCC(C)O 2230a_100000209983_100012276601 [0,1,1,0,0,0|1,0,1]=4 2079 B10R0.4 CCCCCNCCC(C)O 2230a_200000755665_100000210326 [0,1,1,0,0,0|1,0,1]=4 2080 B10R0.4 CCCCCNOCC(=O)O 269956a_100000106656_100000210326 [0,1,1,0,0,0|1,0,0]=3 2081 B10R0.4 CCCCCOCCC(=O)C 34a_100000759926_100000718602 [0,1,1,0,0,0|1,0,0]=3 2082 B10R0.4 CCCCCOCCC(=O)C 7a_100000210253_100000053229 [0,1,1,0,0,0|1,0,0]=3 2083 B10R0.4 CCCCCOCCC(=O)C 7a_100000759926_100000210326 [0,1,1,0,0,0|1,0,0]=3 2084 B10R0.4 CCCCCOCCC(=O)N 34a_100000210253_100000731001 [0,1,1,0,0,0|1,0,0]=3 2085 B10R0.4 CCCCCOCCC(=O)N 34a_100000757172_100000718602 [0,1,1,0,0,0|1,0,0]=3 2086 B10R0.4 CCCCCOCCC(=O)N 7a_100000210253_100000744528 [0,1,1,0,0,0|1,0,0]=3 2087 B10R0.4 CCCCCOCCC(=O)N 7a_100000757172_100000210326 [0,1,1,0,0,0|1,0,0]=3 2088 B10R0.4 CCCCCOCCC(C)O 34a_100000210253_100012276601 [0,1,1,0,0,0|1,0,1]=4 2089 B10R0.4 CCCCCOCCC(C)O 7a_100000210253_100012276601 [0,1,1,0,0,0|1,0,1]=4 2090 B10R0.4 CCCCCOCOC(=O)C 34a_100000210253_100009813279 [0,1,1,0,0,0|2,0,0]=4 2091 B10R0.4 CCCCCSCCC(=O)C 62a_100000053229_100000210326 [0,1,1,0,0,0|1,0,0]=3 2092 B10R0.4 CCCCCSCCC(=O)C 62a_100000210326_100000053229 [0,1,1,0,0,0|1,0,0]=3 2093 B10R0.4 CCCCCSCCC(=O)N 62a_100000210326_100000744528 [0,1,1,0,0,0|1,0,0]=3 2094 B10R0.4 CCCCCSCCC(=O)N 62a_100000744528_100000210326 [0,1,1,0,0,0|1,0,0]=3 2095 B10R0.4 CCCCCSCCC(C)O 62a_100000210326_100012276601 [0,1,1,0,0,0|1,0,1]=4 2096 B10R0.4 CCCCCSCCC(C)O 62a_100012276601_100000210326 [0,1,1,0,0,0|1,0,1]=4 2097 B10R0.4 CCCCCSCOC(=O)C 62a_100000076356_100000210326 [0,1,1,0,0,0|2,0,0]=4 2098 B10R0.4 CCCCCSCOC(=O)C 62a_100000210326_100000076356 [0,1,1,0,0,0|2,0,0]=4 2099 B10R0.4 CCCCNCCCC(=O)C 7a_106832991798_100011215641 [0,1,1,0,0,0|1,0,0]=3 2100 B10R0.4 CCCCNCCCC(=O)N 34a_100000739312_100000210210 [0,1,1,0,0,0|1,0,0]=3 2101 B10R0.4 CCCCNCCCC(=O)N 7a_106832991798_100102525003 [0,1,1,0,0,0|1,0,0]=3 2102 B10R0.4 CCCCNCCCC(C)O 2230a_100000102301_200000718107 [0,1,1,0,0,0|1,0,1]=4 2103 B10R0.4 CCCCNCCCC(C)O 7a_106832991798_200000718107 [0,1,1,0,0,0|1,0,1]=4 2104 B10R0.4 CCCCNCCCS(=O)C 2230a_200000753449_100000210211 [0,1,1,0,0,0|2,0,0]=4 2105 B10R0.4 CCCCNCCNC(=O)C 2230a_100000102301_100000189650 [0,1,1,0,0,0|2,0,0]=4 2106 B10R0.4 CCCCNCCNC(=O)C 2230a_100000209853_100000210211 [0,1,1,0,0,0|2,0,0]=4 2107 B10R0.4 CCCCNCCNC(=O)C 7a_106832991798_100000189650 [0,1,1,0,0,0|2,0,0]=4 2108 B10R0.4 CCCCNCCNC(=O)N 2230a_100000102301_200000034859 [0,1,1,0,0,0|2,0,0]=4 2109 B10R0.4 CCCCNCCNC(=O)N 34a_100020590234_100000210210 [0,1,1,0,0,0|2,0,0]=4 2110 B10R0.4 CCCCNCCNC(=O)N 7a_106832991798_200000034859 [0,1,1,0,0,0|2,0,0]=4 2111 B10R0.4 CCCCNCCOC(=O)C 7a_106832991798_100009814007 [0,1,1,0,0,0|2,0,0]=4 2112 B10R0.4 CCCCNCCOC(=O)N 7a_106832991798_200011214921 [0,1,1,0,0,0|2,0,0]=4 2113 B10R0.4 CCCCOCCCC(=O)C 34a_100000210227_100000685027 [0,1,1,0,0,0|1,0,0]=3 2114 B10R0.4 CCCCOCCCC(=O)C 34a_100000759063_100000210210 [0,1,1,0,0,0|1,0,0]=3 2115 B10R0.4 CCCCOCCCC(=O)C 7a_100000210227_100011215641 [0,1,1,0,0,0|1,0,0]=3 2116 B10R0.4 CCCCOCCCC(=O)C 7a_100000759063_100000210211 [0,1,1,0,0,0|1,0,0]=3 2117 B10R0.4 CCCCOCCCC(=O)N 34a_100000210227_100102525003 [0,1,1,0,0,0|1,0,0]=3 2118 B10R0.4 CCCCOCCCC(=O)N 7a_100000210227_100102525003 [0,1,1,0,0,0|1,0,0]=3 2119 B10R0.4 CCCCOCCCC(C)O 34a_100000210227_200000718107 [0,1,1,0,0,0|1,0,1]=4 2120 B10R0.4 CCCCOCCCC(C)O 7a_100000210227_200000718107 [0,1,1,0,0,0|1,0,1]=4 2121 B10R0.4 CCCCOCCC[N+](=O)[O-] 34a_200000037920_100000210210 [0,1,1,0,0,0|1,0,1]=4 2122 B10R0.4 CCCCOCCNC(=O)C 34a_100000158858_100000210210 [0,1,1,0,0,0|2,0,0]=4 2123 B10R0.4 CCCCOCCNC(=O)C 7a_100000210227_100000189650 [0,1,1,0,0,0|2,0,0]=4 2124 B10R0.4 CCCCOCCNC(=O)N 34a_100000181757_100000210210 [0,1,1,0,0,0|2,0,0]=4 2125 B10R0.4 CCCCOCCNC(=O)N 7a_100000210227_200000034859 [0,1,1,0,0,0|2,0,0]=4 2126 B10R0.4 CCCCOCCOC(=O)C 34a_100000210227_100009814007 [0,1,1,0,0,0|2,0,0]=4 2127 B10R0.4 CCCCOCCOC(=O)C 7a_100000210227_100009814007 [0,1,1,0,0,0|2,0,0]=4 2128 B10R0.4 CCCCOCCOC(=O)N 34a_100000210227_200011214921 [0,1,1,0,0,0|2,0,0]=4 2129 B10R0.4 CCCCOCCOC(=O)N 7a_100000210227_200011214921 [0,1,1,0,0,0|2,0,0]=4 2130 B10R0.4 CCCCOCCOC(=O)N 7a_100000766696_100000210211 [0,1,1,0,0,0|2,0,0]=4 2131 B10R0.4 CCCCOCNCC(=O)N 2230a_100000711301_100011995733 [0,1,1,0,0,0|2,0,0]=4 2132 B10R0.4 CCCCOCNCC(=O)O 269956a_100016091260_100011995733 [0,1,1,0,0,0|1,0,0]=3 2133 B10R0.4 CCCCOCOCC(=O)C 34a_100000211253_100011995733 [0,1,1,0,0,0|2,0,0]=4 2134 B10R0.4 CCCCOCSCC(=O)N 62a_100000747473_100011995733 [0,1,1,0,0,0|2,0,0]=4 2135 B10R0.4 CCCCOCSCC(=O)N 62a_100011995733_100000747473 [0,1,1,0,0,0|2,0,0]=4 2136 B10R0.4 CCCCOCSCC(=O)[O-] 62a_100011995733_100020667443 [0,1,1,0,0,0|1,0,1]=4 2137 B10R0.4 CCCCOCSCC(=O)[O-] 62a_100020667443_100011995733 [0,1,1,0,0,0|1,0,1]=4 2138 B10R0.4 CCCCSCCCC(=O)C 62a_100000210211_100011215641 [0,1,1,0,0,0|1,0,0]=3 2139 B10R0.4 CCCCSCCCC(=O)C 62a_100011215641_100000210210 [0,1,1,0,0,0|1,0,0]=3 2140 B10R0.4 CCCCSCCCC(=O)N 62a_100000210211_100102525003 [0,1,1,0,0,0|1,0,0]=3 2141 B10R0.4 CCCCSCCCC(=O)N 62a_100102525003_100000210210 [0,1,1,0,0,0|1,0,0]=3 2142 B10R0.4 CCCCSCCCC(C)O 62a_100000210211_200000718107 [0,1,1,0,0,0|1,0,1]=4 2143 B10R0.4 CCCCSCCCC(C)O 62a_200000718107_100000210210 [0,1,1,0,0,0|1,0,1]=4 2144 B10R0.4 CCCCSCCNC(=O)C 11a_100025743550_100015343762 [0,1,1,0,0,0|2,0,0]=4 2145 B10R0.4 CCCCSCCNC(=O)C 1626a_100025743550_100015343762 [0,1,1,0,0,0|2,0,0]=4 2146 B10R0.4 CCCCSCCNC(=O)C 240690a_100025743550_100015343762 [0,1,1,0,0,0|2,0,0]=4 2147 B10R0.4 CCCCSCCNC(=O)C 527a_100025743550_100103153847 [0,1,1,0,0,0|2,0,0]=4 2148 B10R0.4 CCCCSCCNC(=O)C 62a_100000189650_100000210210 [0,1,1,0,0,0|2,0,0]=4 2149 B10R0.4 CCCCSCCNC(=O)C 62a_100000210211_100000189650 [0,1,1,0,0,0|2,0,0]=4 2150 B10R0.4 CCCCSCCNC(=O)N 62a_100000210211_200000034859 [0,1,1,0,0,0|2,0,0]=4 2151 B10R0.4 CCCCSCCNC(=O)N 62a_200000034859_100000210210 [0,1,1,0,0,0|2,0,0]=4 2152 B10R0.4 CCCCSCCOC(=O)C 62a_100000210211_100009814007 [0,1,1,0,0,0|2,0,0]=4 2153 B10R0.4 CCCCSCCOC(=O)C 62a_100009814007_100000210210 [0,1,1,0,0,0|2,0,0]=4 2154 B10R0.4 CCCCSCCOC(=O)N 62a_100000210211_200011214921 [0,1,1,0,0,0|2,0,0]=4 2155 B10R0.4 CCCCSCCOC(=O)N 62a_200011214921_100000210210 [0,1,1,0,0,0|2,0,0]=4 2156 B10R0.4 CCCNCCCCC(=O)N 34a_100000696515_100000210303 [0,1,1,0,0,0|1,0,0]=3 2157 B10R0.4 CCCNCCCNC(=O)C 34a_100000736810_100000210303 [0,1,1,0,0,0|2,0,0]=4 2158 B10R0.4 CCCNCCOCC(=O)O 269956a_100000700818_100000210207 [0,1,1,0,0,0|1,0,0]=3 2159 B10R0.4 CCCOCCCCB(O)O 34a_100000210258_200009817182 [0,1,1,0,0,0|1,0,1]=4 2160 B10R0.4 CCCOCCCCC(=O)C 34a_100000210258_100009817362 [0,1,1,0,0,0|1,0,0]=3 2161 B10R0.4 CCCOCCCCC(=O)N 34a_100012022536_100000210303 [0,1,1,0,0,0|1,0,0]=3 2162 B10R0.4 CCCOCCCCC(=O)N 7a_100012022536_100000210303 [0,1,1,0,0,0|1,0,0]=3 2163 B10R0.4 CCCOCCCC[N+](=O)[O-] 34a_200015379883_100000210303 [0,1,1,0,0,0|1,0,1]=4 2164 B10R0.4 CCCOCCCC[N+](=O)[O-] 7a_200015379883_100000210303 [0,1,1,0,0,0|1,0,1]=4 2165 B10R0.4 CCCOCCCNC(=O)C 1626a_100011217757_100015343762 [0,1,1,0,0,0|2,0,0]=4 2166 B10R0.4 CCCOCCCNC(=O)C 240690a_100011217757_100015343762 [0,1,1,0,0,0|2,0,0]=4 2167 B10R0.4 CCCOCCCNC(=O)C 34a_100000752032_100000210303 [0,1,1,0,0,0|2,0,0]=4 2168 B10R0.4 CCCOCCCNC(=O)C 527a_100011217757_100103153847 [0,1,1,0,0,0|2,0,0]=4 2169 B10R0.4 CCCOCCCOC(=O)C 34a_100000210258_100000042594 [0,1,1,0,0,0|2,0,0]=4 2170 B10R0.4 CCCOCCCSC(=O)C 34a_100000210258_100000038929 [0,1,1,0,0,0|2,0,0]=4 2171 B10R0.4 CCCOCCNCC(=O)N 2230a_100000711301_100011215938 [0,1,1,0,0,0|2,0,0]=4 2172 B10R0.4 CCCOCCNCC(=O)N 2230a_100161115042_100000747473 [0,1,1,0,0,0|2,0,0]=4 2173 B10R0.4 CCCOCCNCC(=O)N 34a_100161115042_100000187820 [0,1,1,0,0,0|2,0,0]=4 2174 B10R0.4 CCCOCCNCC(=O)O 269956a_100016091260_100011215938 [0,1,1,0,0,0|1,0,0]=3 2175 B10R0.4 CCCOCCNCC(=O)[O-] 34a_100161115042_100020667443 [0,1,1,0,0,0|1,0,1]=4 2176 B10R0.4 CCCOCCOCC(=O)C 34a_100000211253_100011215938 [0,1,1,0,0,0|2,0,0]=4 2177 B10R0.4 CCCOCCOCC(=O)N 34a_100000210258_100000076697 [0,1,1,0,0,0|2,0,0]=4 2178 B10R0.4 CCCOCCOCC(=O)N 34a_100000752267_100000187820 [0,1,1,0,0,0|2,0,0]=4 2179 B10R0.4 CCCOCCOCC(=O)N 7a_100000752267_100000187820 [0,1,1,0,0,0|2,0,0]=4 2180 B10R0.4 CCCOCCOCC(=O)[O-] 34a_100000752267_100020667443 [0,1,1,0,0,0|1,0,1]=4 2181 B10R0.4 CCCOCCSCC(=O)N 62a_100000747473_100011215938 [0,1,1,0,0,0|2,0,0]=4 2182 B10R0.4 CCCOCCSCC(=O)N 62a_100011215938_100000747473 [0,1,1,0,0,0|2,0,0]=4 2183 B10R0.4 CCCOCCSCC(=O)[O-] 62a_100011215938_100020667443 [0,1,1,0,0,0|1,0,1]=4 2184 B10R0.4 CCCOCCSCC(=O)[O-] 62a_100020667443_100011215938 [0,1,1,0,0,0|1,0,1]=4 2185 B10R0.4 CCCSCCCCB(O)O 62a_100000210303_200009817182 [0,1,1,0,0,0|1,0,1]=4 2186 B10R0.4 CCCSCCCCB(O)O 62a_200009817182_100000210303 [0,1,1,0,0,0|1,0,1]=4 2187 B10R0.4 CCCSCCCCC(=O)C 62a_100000210303_100000735457 [0,1,1,0,0,0|1,0,0]=3 2188 B10R0.4 CCCSCCCCC(=O)C 62a_100000735457_100000210303 [0,1,1,0,0,0|1,0,0]=3 2189 B10R0.4 CCCSCCCOC(=O)C 62a_100000042594_100000210303 [0,1,1,0,0,0|2,0,0]=4 2190 B10R0.4 CCCSCCCOC(=O)C 62a_100000210303_100000042594 [0,1,1,0,0,0|2,0,0]=4 2191 B10R0.4 CCCSCCCSC(=O)C 62a_100000038929_100000210303 [0,1,1,0,0,0|2,0,0]=4 2192 B10R0.4 CCCSCCCSC(=O)C 62a_100000210303_100000038929 [0,1,1,0,0,0|2,0,0]=4 2193 B10R0.4 CCCSCCNCC(=O)N 2230a_100020603323_100000747473 [0,1,1,0,0,0|2,0,0]=4 2194 B10R0.4 CCCSCCOCC(=O)N 34a_200000230433_100000187820 [0,1,1,0,0,0|2,0,0]=4 2195 B10R0.4 CCCSCCOCC(=O)N 62a_100000076697_100000210303 [0,1,1,0,0,0|2,0,0]=4 2196 B10R0.4 CCCSCCOCC(=O)N 62a_100000210303_100000076697 [0,1,1,0,0,0|2,0,0]=4 2197 B10R0.4 CCCSCCOCC(=O)N 7a_200000230433_100000187820 [0,1,1,0,0,0|2,0,0]=4 2198 B10R0.4 CCCSCCOCC(=O)[O-] 34a_200000230433_100020667443 [0,1,1,0,0,0|1,0,1]=4 2199 B10R0.4 CCNCCCCCB(O)O 2230a_100015525214_200009817188 [0,1,1,0,0,0|1,0,1]=4 2200 B10R0.4 CCNCCCCCC(=O)N 2230a_100015525214_100009817443 [0,1,1,0,0,0|1,0,0]=3 2201 B10R0.4 CCNCCCCNC(=O)C 2230a_200011368371_100000210202 [0,1,1,0,0,0|2,0,0]=4 2202 B10R0.4 CCNCCCCNC(=O)C 34a_200011368371_100000210202 [0,1,1,0,0,0|2,0,0]=4 2203 B10R0.4 CCNCCCCSC(=O)C 2230a_100015525214_200010402107 [0,1,1,0,0,0|2,0,0]=4 2204 B10R0.4 CCOCCCCCB(O)O 34a_100121572206_200009817188 [0,1,1,0,0,0|1,0,1]=4 2205 B10R0.4 CCOCCCCCC(=O)N 34a_100000123541_100000210202 [0,1,1,0,0,0|1,0,0]=3 2206 B10R0.4 CCOCCCCCC(=O)N 34a_100121572206_100009817443 [0,1,1,0,0,0|1,0,0]=3 2207 B10R0.4 CCOCCCCCC(=O)N 7a_100000123541_100000210202 [0,1,1,0,0,0|1,0,0]=3 2208 B10R0.4 CCOCCCCCC(=O)[O-] 7a_100102619762_100000210202 [0,1,1,0,0,0|0,0,1]=3 2209 B10R0.4 CCOCCCCOC(=O)C 34a_100000073216_100000210202 [0,1,1,0,0,0|2,0,0]=4 2210 B10R0.4 CCOCCCCOC(=O)C 34a_100121572206_100000033659 [0,1,1,0,0,0|2,0,0]=4 2211 B10R0.4 CCOCCCCOC(=O)C 7a_100000073216_100000210202 [0,1,1,0,0,0|2,0,0]=4 2212 B10R0.4 CCOCCCCSC(=O)C 34a_100121572206_200010402107 [0,1,1,0,0,0|2,0,0]=4 2213 B10R0.4 CCOCCCNCC(=O)N 2230a_100000210961_100000747473 [0,1,1,0,0,0|2,0,0]=4 2214 B10R0.4 CCOCCCNCC(=O)N 2230a_100000711301_100012232248 [0,1,1,0,0,0|2,0,0]=4 2215 B10R0.4 CCOCCCNCC(=O)N 34a_100000210961_100000187820 [0,1,1,0,0,0|2,0,0]=4 2216 B10R0.4 CCOCCCNCC(=O)O 269956a_100016091260_100012232248 [0,1,1,0,0,0|1,0,0]=3 2217 B10R0.4 CCOCCCNCC(=O)[O-] 34a_100000210961_100020667443 [0,1,1,0,0,0|1,0,1]=4 2218 B10R0.4 CCOCCCOCC(=O)C 34a_100000211253_100012232248 [0,1,1,0,0,0|2,0,0]=4 2219 B10R0.4 CCOCCCOCC(=O)N 34a_100000757476_100000187820 [0,1,1,0,0,0|2,0,0]=4 2220 B10R0.4 CCOCCCOCC(=O)N 7a_100000757476_100000187820 [0,1,1,0,0,0|2,0,0]=4 2221 B10R0.4 CCOCCCOCC(=O)[O-] 34a_100000757476_100020667443 [0,1,1,0,0,0|1,0,1]=4 2222 B10R0.4 CCOCCCSCC(=O)N 62a_100000747473_100012232248 [0,1,1,0,0,0|2,0,0]=4 2223 B10R0.4 CCOCCCSCC(=O)N 62a_100012232248_100000747473 [0,1,1,0,0,0|2,0,0]=4 2224 B10R0.4 CCOCCCSCC(=O)[O-] 62a_100012232248_100020667443 [0,1,1,0,0,0|1,0,1]=4 2225 B10R0.4 CCOCCCSCC(=O)[O-] 62a_100020667443_100012232248 [0,1,1,0,0,0|1,0,1]=4 2226 B10R0.4 CCOCCNCCC(=O)N 2230a_102516460346_100000744528 [0,1,1,0,0,0|2,0,0]=4 2227 B10R0.4 CCOCCNCCC(=O)N 34a_102516460346_100000731001 [0,1,1,0,0,0|2,0,0]=4 2228 B10R0.4 CCOCCNOCC(=O)O 269956a_100000106656_100000210147 [0,1,1,0,0,0|2,0,0]=4 2229 B10R0.4 CCOCCOCCC(=O)C 1458a_100000070787_100011211534 [0,1,1,0,0,0|2,0,0]=4 2230 B10R0.4 CCOCCOCCC(=O)C 34a_100000759926_100000210147 [0,1,1,0,0,0|2,0,0]=4 2231 B10R0.4 CCOCCOCCC(=O)C 7a_100000210136_100000053229 [0,1,1,0,0,0|2,0,0]=4 2232 B10R0.4 CCOCCOCCC(=O)C 7a_100000759926_100011215890 [0,1,1,0,0,0|2,0,0]=4 2233 B10R0.4 CCOCCOCCC(=O)N 34a_100000210136_100000731001 [0,1,1,0,0,0|2,0,0]=4 2234 B10R0.4 CCOCCOCCC(=O)N 34a_100000757172_100000210147 [0,1,1,0,0,0|2,0,0]=4 2235 B10R0.4 CCOCCOCCC(=O)N 7a_100000210136_100000744528 [0,1,1,0,0,0|2,0,0]=4 2236 B10R0.4 CCOCCOCCC(=O)N 7a_100000757172_100011215890 [0,1,1,0,0,0|2,0,0]=4 2237 B10R0.4 CCOCCSCCC(=O)C 62a_100000053229_100011215890 [0,1,1,0,0,0|2,0,0]=4 2238 B10R0.4 CCOCCSCCC(=O)C 62a_100000210147_100000053229 [0,1,1,0,0,0|2,0,0]=4 2239 B10R0.4 CCOCCSCCC(=O)N 62a_100000210147_100000744528 [0,1,1,0,0,0|2,0,0]=4 2240 B10R0.4 CCOCCSCCC(=O)N 62a_100000744528_100011215890 [0,1,1,0,0,0|2,0,0]=4 2241 B10R0.4 CCOCSCCCC(=O)C 62a_100000739092_100011215641 [0,1,1,0,0,0|2,0,0]=4 2242 B10R0.4 CCOCSCCCC(=O)C 62a_100011215641_100000739092 [0,1,1,0,0,0|2,0,0]=4 2243 B10R0.4 CCOCSCCCC(=O)N 62a_100000739092_100102525003 [0,1,1,0,0,0|2,0,0]=4 2244 B10R0.4 CCOCSCCCC(=O)N 62a_100102525003_100000739092 [0,1,1,0,0,0|2,0,0]=4 2245 B10R0.4 CCSCCCCCB(O)O 62a_100000210202_200009817188 [0,1,1,0,0,0|1,0,1]=4 2246 B10R0.4 CCSCCCCCB(O)O 62a_200009817188_100000210202 [0,1,1,0,0,0|1,0,1]=4 2247 B10R0.4 CCSCCCCCC(=O)N 62a_100000210202_100009817443 [0,1,1,0,0,0|1,0,0]=3 2248 B10R0.4 CCSCCCCCC(=O)N 62a_100009817443_100000210202 [0,1,1,0,0,0|1,0,0]=3 2249 B10R0.4 CCSCCCCOC(=O)C 62a_100000033659_100000210202 [0,1,1,0,0,0|2,0,0]=4 2250 B10R0.4 CCSCCCCOC(=O)C 62a_100000210202_100000033659 [0,1,1,0,0,0|2,0,0]=4 2251 B10R0.4 CCSCCCCSC(=O)C 62a_100000210202_200010402107 [0,1,1,0,0,0|2,0,0]=4 2252 B10R0.4 CCSCCCCSC(=O)C 62a_200010402107_100000210202 [0,1,1,0,0,0|2,0,0]=4 2253 B10R0.4 CCSCCCOCC(=O)N 34a_100011216438_100000187820 [0,1,1,0,0,0|2,0,0]=4 2254 B10R0.4 CCSCCCOCC(=O)N 7a_100011216438_100000187820 [0,1,1,0,0,0|2,0,0]=4 2255 B10R0.4 CCSCCCOCC(=O)[O-] 34a_100011216438_100020667443 [0,1,1,0,0,0|1,0,1]=4 2256 B10R0.4 CCSCCNCCC(=O)N 2230a_100000106463_100000744528 [0,1,1,0,0,0|2,0,0]=4 2257 B10R0.4 CCSCCNOCC(=O)O 269956a_100000106656_100000757381 [0,1,1,0,0,0|2,0,0]=4 2258 B10R0.4 CCSCCOCCC(=O)C 34a_100000759926_100000757381 [0,1,1,0,0,0|2,0,0]=4 2259 B10R0.4 CCSCCOCCC(=O)C 7a_100000212035_100000053229 [0,1,1,0,0,0|2,0,0]=4 2260 B10R0.4 CCSCCOCCC(=O)C 7a_100000759926_100000757381 [0,1,1,0,0,0|2,0,0]=4 2261 B10R0.4 CCSCCOCCC(=O)N 34a_100000212035_100000731001 [0,1,1,0,0,0|2,0,0]=4 2262 B10R0.4 CCSCCOCCC(=O)N 34a_100000757172_100000757381 [0,1,1,0,0,0|2,0,0]=4 2263 B10R0.4 CCSCCOCCC(=O)N 7a_100000212035_100000744528 [0,1,1,0,0,0|2,0,0]=4 2264 B10R0.4 CCSCCOCCC(=O)N 7a_100000757172_100000757381 [0,1,1,0,0,0|2,0,0]=4 2265 B10R0.4 CCSCCSCCC(=O)C 62a_100000053229_100000757381 [0,1,1,0,0,0|2,0,0]=4 2266 B10R0.4 CCSCCSCCC(=O)C 62a_100000757381_100000053229 [0,1,1,0,0,0|2,0,0]=4 2267 B10R0.4 CCSCCSCCC(=O)N 62a_100000744528_100000757381 [0,1,1,0,0,0|2,0,0]=4 2268 B10R0.4 CCSCCSCCC(=O)N 62a_100000757381_100000744528 [0,1,1,0,0,0|2,0,0]=4 2269 B10R0.4 CNCCCCCCB(O)O 2230a_106832991635_100009817187 [0,1,1,0,0,0|1,0,1]=4 2270 B10R0.4 CNCCCCCCB(O)O 34a_100102657272_100009817187 [0,1,1,0,0,0|1,0,1]=4 2271 B10R0.4 CNCCCCCCB(O)O 7a_106832991635_100009817187 [0,1,1,0,0,0|1,0,1]=4 2272 B10R0.4 CNCCCCCNC(=O)C 2230a_200012022750_200000210301 [0,1,1,0,0,0|2,0,0]=4 2273 B10R0.4 CNCCCCCNC(=O)C 34a_200012022750_200000210301 [0,1,1,0,0,0|2,0,0]=4 2274 B10R0.4 CNCCCCCOC(=O)C 2230a_106832991635_100009813381 [0,1,1,0,0,0|2,0,0]=4 2275 B10R0.4 CNCCCCCOC(=O)C 34a_100102657272_100000033007 [0,1,1,0,0,0|2,0,0]=4 2276 B10R0.4 CNCCCCCOC(=O)C 7a_106832991635_100000033007 [0,1,1,0,0,0|2,0,0]=4 2277 B10R0.4 CNCCCOCCC(=O)N 34a_100000213112_100000731001 [0,1,1,0,0,0|2,0,0]=4 2278 B10R0.4 COCCCCCCB(O)O 34a_100138415774_100009817187 [0,1,1,0,0,0|1,0,1]=4 2279 B10R0.4 COCCCCCCC(=O)C 1458a_100000070787_100011998445 [0,1,1,0,0,0|1,0,0]=3 2280 B10R0.4 COCCCCCNC(=O)C 11a_100000747528_100015343762 [0,1,1,0,0,0|2,0,0]=4 2281 B10R0.4 COCCCCCNC(=O)C 1626a_100000747528_100015343762 [0,1,1,0,0,0|2,0,0]=4 2282 B10R0.4 COCCCCCNC(=O)C 240690a_100000747528_100015343762 [0,1,1,0,0,0|2,0,0]=4 2283 B10R0.4 COCCCCCNC(=O)C 527a_100000747528_100103153847 [0,1,1,0,0,0|2,0,0]=4 2284 B10R0.4 COCCCCCOC(=O)C 34a_100138415774_100000033007 [0,1,1,0,0,0|2,0,0]=4 2285 B10R0.4 COCCCCNCC(=O)N 2230a_100000711301_100000730899 [0,1,1,0,0,0|2,0,0]=4 2286 B10R0.4 COCCCCNCC(=O)O 269956a_100016091260_100000730899 [0,1,1,0,0,0|1,0,0]=3 2287 B10R0.4 COCCCCOCC(=O)C 34a_100000211253_100000755781 [0,1,1,0,0,0|2,0,0]=4 2288 B10R0.4 COCCCCOCC(=O)N 34a_100000740925_100000187820 [0,1,1,0,0,0|2,0,0]=4 2289 B10R0.4 COCCCCOCC(=O)[O-] 34a_100000740925_100020667443 [0,1,1,0,0,0|1,0,1]=4 2290 B10R0.4 COCCCCSCC(=O)N 62a_100000730899_100000747473 [0,1,1,0,0,0|2,0,0]=4 2291 B10R0.4 COCCCCSCC(=O)N 62a_100000747473_100000730899 [0,1,1,0,0,0|2,0,0]=4 2292 B10R0.4 COCCCCSCC(=O)[O-] 62a_100000730899_100020667443 [0,1,1,0,0,0|1,0,1]=4 2293 B10R0.4 COCCCCSCC(=O)[O-] 62a_100020667443_100000730899 [0,1,1,0,0,0|1,0,1]=4 2294 B10R0.4 COCCCNCCC(=O)N 34a_100150723488_100000731001 [0,1,1,0,0,0|2,0,0]=4 2295 B10R0.4 COCCCNOCC(=O)O 269956a_100000106656_100000740836 [0,1,1,0,0,0|2,0,0]=4 2296 B10R0.4 COCCCOCCC(=O)C 34a_100000759926_100000740836 [0,1,1,0,0,0|2,0,0]=4 2297 B10R0.4 COCCCOCCC(=O)C 7a_100000759926_100000740836 [0,1,1,0,0,0|2,0,0]=4 2298 B10R0.4 COCCCOCCC(=O)N 34a_100000740835_100000731001 [0,1,1,0,0,0|2,0,0]=4 2299 B10R0.4 COCCCOCCC(=O)N 34a_100000757172_100000740836 [0,1,1,0,0,0|2,0,0]=4 2300 B10R0.4 COCCCOCCC(=O)N 7a_100000757172_100000740836 [0,1,1,0,0,0|2,0,0]=4 2301 B10R0.4 COCCCSCCC(=O)C 62a_100000053229_100000709357 [0,1,1,0,0,0|2,0,0]=4 2302 B10R0.4 COCCCSCCC(=O)C 62a_100000709357_100000053229 [0,1,1,0,0,0|2,0,0]=4 2303 B10R0.4 COCCCSCCC(=O)N 62a_100000709357_100000744528 [0,1,1,0,0,0|2,0,0]=4 2304 B10R0.4 COCCCSCCC(=O)N 62a_100000744528_100000709357 [0,1,1,0,0,0|2,0,0]=4 2305 B10R0.4 COCCNCCCC(=O)N 34a_100000739312_100011201679 [0,1,1,0,0,0|2,0,0]=4 2306 B10R0.4 COCCOCCCC(=O)C 1458a_100000070787_100011216529 [0,1,1,0,0,0|2,0,0]=4 2307 B10R0.4 COCCOCCCC(=O)C 34a_100000210237_100000685027 [0,1,1,0,0,0|2,0,0]=4 2308 B10R0.4 COCCOCCCC(=O)C 34a_100000759063_100011201679 [0,1,1,0,0,0|2,0,0]=4 2309 B10R0.4 COCCOCCCC(=O)C 7a_100000759063_100000233755 [0,1,1,0,0,0|2,0,0]=4 2310 B10R0.4 COCCOCCCC(=O)N 34a_100000210237_100102525003 [0,1,1,0,0,0|2,0,0]=4 2311 B10R0.4 COCCOCNCC(=O)O 269956a_100016091260_100000231047 [0,1,1,0,0,0|2,0,0]=4 2312 B10R0.4 COCCSCCCC(=O)C 62a_100000233755_100011215641 [0,1,1,0,0,0|2,0,0]=4 2313 B10R0.4 COCCSCCCC(=O)C 62a_100011215641_100000233755 [0,1,1,0,0,0|2,0,0]=4 2314 B10R0.4 COCCSCCCC(=O)N 62a_100000233755_100102525003 [0,1,1,0,0,0|2,0,0]=4 2315 B10R0.4 COCCSCCCC(=O)N 62a_100102525003_100000233755 [0,1,1,0,0,0|2,0,0]=4 2316 B10R0.4 COCNCCOCC(=O)O 269956a_100000700818_100000766300 [0,1,1,0,0,0|2,0,0]=4 2317 B10R0.4 COCSCCCCC(=O)C 62a_100000735457_100000766300 [0,1,1,0,0,0|2,0,0]=4 2318 B10R0.4 COCSCCCCC(=O)C 62a_100000766300_100000735457 [0,1,1,0,0,0|2,0,0]=4 2319 B10R0.4 CSCCCCCCB(O)O 62a_100009817187_200000210301 [0,1,1,0,0,0|1,0,1]=4 2320 B10R0.4 CSCCCCCCB(O)O 62a_200000210301_100009817187 [0,1,1,0,0,0|1,0,1]=4 2321 B10R0.4 CSCCCCCOC(=O)C 62a_100000033007_200000210301 [0,1,1,0,0,0|2,0,0]=4 2322 B10R0.4 CSCCCCCOC(=O)C 62a_200000210301_100000033007 [0,1,1,0,0,0|2,0,0]=4 2323 B10R0.4 CSCCCCOCC(=O)N 34a_100011217163_100000187820 [0,1,1,0,0,0|2,0,0]=4 2324 B10R0.4 CSCCCCOCC(=O)N 7a_100011217163_100000187820 [0,1,1,0,0,0|2,0,0]=4 2325 B10R0.4 CSCCCCOCC(=O)[O-] 34a_100011217163_100020667443 [0,1,1,0,0,0|1,0,1]=4 2326 B10R0.4 CSCCCNCCC(=O)N 2230a_100000749238_100000744528 [0,1,1,0,0,0|2,0,0]=4 2327 B10R0.4 CSCCCOCCC(=O)C 7a_100000690336_100000053229 [0,1,1,0,0,0|2,0,0]=4 2328 B10R0.4 CSCCCOCCC(=O)N 34a_100000690336_100000731001 [0,1,1,0,0,0|2,0,0]=4 2329 B10R0.4 CSCCCOCCC(=O)N 7a_100000690336_100000744528 [0,1,1,0,0,0|2,0,0]=4 2330 B10R0.4 CSCCNCCCC(=O)N 34a_100000739312_100000212216 [0,1,1,0,0,0|2,0,0]=4 2331 B10R0.4 CSCCOCCCC(=O)C 34a_100000230434_100000685027 [0,1,1,0,0,0|2,0,0]=4 2332 B10R0.4 CSCCOCCCC(=O)C 34a_100000759063_100000212216 [0,1,1,0,0,0|2,0,0]=4 2333 B10R0.4 CSCCOCCCC(=O)C 7a_100000230434_100011215641 [0,1,1,0,0,0|2,0,0]=4 2334 B10R0.4 CSCCOCCCC(=O)C 7a_100000759063_100000212216 [0,1,1,0,0,0|2,0,0]=4 2335 B10R0.4 CSCCOCCCC(=O)N 34a_100000230434_100102525003 [0,1,1,0,0,0|2,0,0]=4 2336 B10R0.4 CSCCOCCCC(=O)N 7a_100000230434_100102525003 [0,1,1,0,0,0|2,0,0]=4 2337 B10R0.4 CSCCSCCCC(=O)C 62a_100000212216_100011215641 [0,1,1,0,0,0|2,0,0]=4 2338 B10R0.4 CSCCSCCCC(=O)C 62a_100011215641_100000751147 [0,1,1,0,0,0|2,0,0]=4 2339 B10R0.4 CSCCSCCCC(=O)N 62a_100000212216_100102525003 [0,1,1,0,0,0|2,0,0]=4 2340 B10R0.4 CSCCSCCCC(=O)N 62a_100102525003_100000751147 [0,1,1,0,0,0|2,0,0]=4 2341 B10R0.4 CSCNCCCCC(=O)N 34a_100000696515_100011218213 [0,1,1,0,0,0|2,0,0]=4 2342 B10R0.4 CSCNCCOCC(=O)O 269956a_100000700818_100011218213 [0,1,1,0,0,0|2,0,0]=4 2343 B10R0.4 CSCOCCCCC(=O)N 34a_100012022536_100011218213 [0,1,1,0,0,0|2,0,0]=4 2344 B10R0.4 CSCSCCCCC(=O)C 62a_100000735457_100011218213 [0,1,1,0,0,0|2,0,0]=4 2345 B10R0.4 CSCSCCCCC(=O)C 62a_100011218213_100000735457 [0,1,1,0,0,0|2,0,0]=4 2346 B10R0.4 N#CCCCCNCC(=O)O 269956a_100016091260_100011219923 [0,1,1,0,0,0|1,0,1]=4 2347 B10R0.4 NC(=O)CCCCCOCF 34a_100000123541_100015361967 [0,1,1,0,0,0|2,0,0]=4 2348 B10R0.4 NC(=O)CCCCCOCF 7a_100000123541_100015361967 [0,1,1,0,0,0|2,0,0]=4 2349 B10R0.4 NC(=O)CCCCCSCF 62a_100009817443_100015361967 [0,1,1,0,0,0|2,0,0]=4 2350 B10R0.4 NC(=O)CCCCCSCF 62a_100015361967_100009817443 [0,1,1,0,0,0|2,0,0]=4 2351 B10R0.4 NC(=O)CCCCNCCF 34a_100000696515_100011217306 [0,1,1,0,0,0|2,0,0]=4 2352 B10R0.4 NC(=O)CCCCNCCO 34a_100000696515_100000211926 [0,1,1,0,0,0|2,0,0]=4 2353 B10R0.4 NC(=O)CCCCOCCF 34a_100012022536_100011217306 [0,1,1,0,0,0|2,0,0]=4 2354 B10R0.4 NC(=O)CCCCOCCF 7a_100012022536_100011217306 [0,1,1,0,0,0|2,0,0]=4 2355 B10R0.4 NC(=O)CCCCOCCO 34a_100012022536_100000211926 [0,1,1,0,0,0|2,0,0]=4 2356 B10R0.4 NC(=O)CCCCOCCO 7a_100012022536_100000211926 [0,1,1,0,0,0|2,0,0]=4 2357 B10R0.4 NC(=O)CCCNCCCF 34a_100000739312_100011934791 [0,1,1,0,0,0|2,0,0]=4 2358 B10R0.4 NC(=O)CCCNCCCF 34a_100015189416_100102525003 [0,1,1,0,0,0|2,0,0]=4 2359 B10R0.4 NC(=O)CCCNCCCO 34a_100000739312_100000230001 [0,1,1,0,0,0|2,0,0]=4 2360 B10R0.4 NC(=O)CCCOCCCBr 34a_100011217188_100102525003 [0,1,1,0,0,0|2,0,0]=4 2361 B10R0.4 NC(=O)CCCOCCCCl 34a_100000230001_100102525003 [0,1,1,0,0,0|2,0,0]=4 2362 B10R0.4 NC(=O)CCCOCCCF 34a_100000759539_100102525003 [0,1,1,0,0,0|2,0,0]=4 2363 B10R0.4 NC(=O)CCCSCCCF 62a_100011934791_100102525003 [0,1,1,0,0,0|2,0,0]=4 2364 B10R0.4 NC(=O)CCCSCCCF 62a_100102525003_100011934791 [0,1,1,0,0,0|2,0,0]=4 2365 B10R0.4 NC(=O)CCCSCCCO 62a_100011215043_100102525003 [0,1,1,0,0,0|2,0,0]=4 2366 B10R0.4 NC(=O)CCCSCCCO 62a_100102525003_100011215043 [0,1,1,0,0,0|2,0,0]=4 2367 B10R0.4 NC(=O)CCNCCCCO 2230a_100000750430_100000744528 [0,1,1,0,0,0|2,0,0]=4 2368 B10R0.4 NC(=O)CCNCCCCO 34a_100000750430_100000731001 [0,1,1,0,0,0|2,0,0]=4 2369 B10R0.4 NC(=O)CCOCCCCBr 34a_100011216708_100000731001 [0,1,1,0,0,0|2,0,0]=4 2370 B10R0.4 NC(=O)CCOCCCCCl 34a_100000210776_100000731001 [0,1,1,0,0,0|2,0,0]=4 2371 B10R0.4 NC(=O)CCOCCCCCl 7a_100000210776_100000744528 [0,1,1,0,0,0|2,0,0]=4 2372 B10R0.4 NC(=O)CCOCCCCF 34a_100000757172_100000729493 [0,1,1,0,0,0|2,0,0]=4 2373 B10R0.4 NC(=O)CCOCCCCF 34a_100011995726_100000731001 [0,1,1,0,0,0|2,0,0]=4 2374 B10R0.4 NC(=O)CCOCCCCF 7a_100000757172_100000729493 [0,1,1,0,0,0|2,0,0]=4 2375 B10R0.4 NC(=O)CCOCCCCF 7a_100011995726_100000744528 [0,1,1,0,0,0|2,0,0]=4 2376 B10R0.4 NC(=O)CCOCCCCI 34a_200012148704_100000731001 [0,1,1,0,0,0|2,0,0]=4 2377 B10R0.4 NC(=O)CCOCCCCO 34a_100000757172_100011216708 [0,1,1,0,0,0|2,0,0]=4 2378 B10R0.4 NC(=O)CCOCCCCO 7a_100000757172_100000210776 [0,1,1,0,0,0|2,0,0]=4 2379 B10R0.4 NC(=O)CCSCCCCF 62a_100000729493_100000744528 [0,1,1,0,0,0|2,0,0]=4 2380 B10R0.4 NC(=O)CCSCCCCF 62a_100000744528_100000729493 [0,1,1,0,0,0|2,0,0]=4 2381 B10R0.4 NC(=O)CCSCCCCO 62a_100000210776_100000744528 [0,1,1,0,0,0|2,0,0]=4 2382 B10R0.4 NC(=O)CCSCCCCO 62a_100000744528_100000210776 [0,1,1,0,0,0|2,0,0]=4 2383 B10R0.4 NC(=O)CNCCCCCF 2230a_100000711301_100000729378 [0,1,1,0,0,0|2,0,0]=4 2384 B10R0.4 NC(=O)CNCCCCCO 2230a_100000711301_100000746330 [0,1,1,0,0,0|2,0,0]=4 2385 B10R0.4 NC(=O)CNCCCCCO 2230a_100000762737_100000747473 [0,1,1,0,0,0|2,0,0]=4 2386 B10R0.4 NC(=O)CNCCCCCO 34a_100000762737_100000187820 [0,1,1,0,0,0|2,0,0]=4 2387 B10R0.4 NC(=O)COCCCCCBr 34a_100000746331_100000187820 [0,1,1,0,0,0|2,0,0]=4 2388 B10R0.4 NC(=O)COCCCCCBr 7a_100000746331_100000187820 [0,1,1,0,0,0|2,0,0]=4 2389 B10R0.4 NC(=O)COCCCCCCl 34a_100000746330_100000187820 [0,1,1,0,0,0|2,0,0]=4 2390 B10R0.4 NC(=O)COCCCCCCl 7a_100000746330_100000187820 [0,1,1,0,0,0|2,0,0]=4 2391 B10R0.4 NC(=O)COCCCCCI 34a_200012148887_100000187820 [0,1,1,0,0,0|2,0,0]=4 2392 B10R0.4 NC(=O)COCCCCCI 7a_200012148887_100000187820 [0,1,1,0,0,0|2,0,0]=4 2393 B10R0.4 NC(=O)CSCCCCCF 62a_100000729378_100000747473 [0,1,1,0,0,0|2,0,0]=4 2394 B10R0.4 NC(=O)CSCCCCCF 62a_100000747473_100000729378 [0,1,1,0,0,0|2,0,0]=4 2395 B10R0.4 NC(=O)CSCCCCCO 62a_100000746330_100000747473 [0,1,1,0,0,0|2,0,0]=4 2396 B10R0.4 NC(=O)CSCCCCCO 62a_100000747473_100000746330 [0,1,1,0,0,0|2,0,0]=4 2397 B10R0.4 NCCCCCOCC(=O)N 34a_100000762737_100000187820 [0,1,1,0,0,0|2,0,0]=4 2398 B10R0.4 NCCCCCOCC(=O)[O-] 34a_100000762737_100020667443 [0,1,1,0,0,0|1,0,1]=4 2399 B10R0.4 NCCCCOCCC(=O)N 34a_100000750430_100000731001 [0,1,1,0,0,0|2,0,0]=4 2400 B10R0.4 NCCCOCCCC(=O)N 34a_100000182051_100102525003 [0,1,1,0,0,0|2,0,0]=4 2401 B10R0.4 O=C(O)CNCCCCCF 269956a_100016091260_100000729378 [0,1,1,0,0,0|1,0,0]=3 2402 B10R0.4 O=C(O)CNCCCCCO 269956a_100016091260_100000746330 [0,1,1,0,0,0|1,0,0]=3 2403 B10R0.4 O=C(O)CNCCOCCO 269956a_100016091260_100011215305 [0,1,1,0,0,0|2,0,0]=4 2404 B10R0.4 O=C(O)COCCNCCF 269956a_100000700818_100011217306 [0,1,1,0,0,0|2,0,0]=4 2405 B10R0.4 O=C(O)COCCNCCO 269956a_100000700818_100000211926 [0,1,1,0,0,0|2,0,0]=4 2406 B10R0.4 O=C(O)CONCCCCF 269956a_100000106656_100000729493 [0,1,1,0,0,0|2,0,0]=4 2407 B10R0.4 O=C(O)CONCCCCO 269956a_100000106656_100000210776 [0,1,1,0,0,0|2,0,0]=4 2408 B10R0.4 O=C([O-])CCCCCOCF 7a_100102619762_100015361967 [0,1,1,0,0,0|1,0,1]=4 2409 B10R0.4 O=C([O-])CNCCCCCO 34a_100000762737_100020667443 [0,1,1,0,0,0|1,0,1]=4 2410 B10R0.4 O=C([O-])COCCCCCBr 34a_100000746331_100020667443 [0,1,1,0,0,0|1,0,1]=4 2411 B10R0.4 O=C([O-])COCCCCCCl 34a_100000746330_100020667443 [0,1,1,0,0,0|1,0,1]=4 2412 B10R0.4 O=C([O-])COCCCCCI 34a_200012148887_100020667443 [0,1,1,0,0,0|1,0,1]=4 2413 B10R0.4 O=C([O-])CSCCCCCF 62a_100000729378_100020667443 [0,1,1,0,0,0|1,0,1]=4 2414 B10R0.4 O=C([O-])CSCCCCCF 62a_100020667443_100000729378 [0,1,1,0,0,0|1,0,1]=4 2415 B10R0.4 O=C([O-])CSCCCCCO 62a_100000746330_100020667443 [0,1,1,0,0,0|1,0,1]=4 2416 B10R0.4 O=C([O-])CSCCCCCO 62a_100020667443_100000746330 [0,1,1,0,0,0|1,0,1]=4 2417 B10R0.4 O=CCCCCNCC(=O)O 269956a_100016091260_100000139335 [0,1,1,0,0,0|1,0,1]=4 2418 B10R0.4 [13CH3]C(=O)CCCCCCCO 1458a_100011219782_200025704644 [0,1,1,0,0,0|1,0,0]=3 2419 B10R0.4 [13CH3]SCCCCCCB(O)O 62a_100009817187_200025704644 [0,1,1,0,0,0|1,0,1]=4 2420 B10R0.4 [13CH3]SCCCCCCB(O)O 62a_200025704644_100009817187 [0,1,1,0,0,0|1,0,1]=4 2421 B10R0.6 CCCCCC(=O)CC(=O)C 1458a_100000070787_200012276598 [0,1,1,0,0,0|1,0,1]=4 2422 B10R0.6 CCCCCC(=O)CC(=O)N 1458a_100000212188_100000187820 [0,1,1,0,0,0|1,0,1]=4 2423 B10R0.6 CCCCCC(=O)CC(=O)N 1458a_100134613110_100000210326 [0,1,1,0,0,0|1,0,1]=4 2424 B10R0.6 CCCCCC(=O)CC(=O)[O-] 1458a_100000212188_100020667443 [0,1,1,0,0,0|0,0,2]=4 2425 B10R0.6 CCCCCC(C)NC(=O)C 11a_100000211957_100015343762 [0,1,1,0,0,0|2,0,0]=4 2426 B10R0.6 CCCCCC(C)NC(=O)C 1626a_100000211957_100015343762 [0,1,1,0,0,0|2,0,0]=4 2427 B10R0.6 CCCCCC(C)NC(=O)C 240690a_100000211957_100015343762 [0,1,1,0,0,0|2,0,0]=4 2428 B10R0.6 CCCCCC(C)NC(=O)C 527a_100000211957_100103153847 [0,1,1,0,0,0|2,0,0]=4 2429 B10R0.6 CCCCCN(C)CC(=O)N 2230a_100000223495_100000747473 [0,1,1,0,0,0|2,0,0]=4 2430 B10R0.6 CCCCCN(C)CC(=O)N 2230a_100000739694_100000210326 [0,1,1,0,0,0|2,0,0]=4 2431 B10R0.6 CCCCCN(C)CC(=O)N 269982a_100000223495_100000187820 [0,1,1,0,0,0|2,0,0]=4 2432 B10R0.6 CCCCCN(C)CC(=O)O 269956a_100000746989_100000210326 [0,1,1,0,0,0|1,0,0]=3 2433 B10R0.6 CCCCCN(C)CC(=O)[O-] 269982a_100000223495_100020667443 [0,1,1,0,0,0|1,0,1]=4 2434 B10R0.6 CCCNCC(O)CC(=O)O 269956a_100011218706_100000210207 [0,1,1,0,0,0|1,0,0]=3 2435 B10R0.6 CCOCCN(C)CC(=O)O 269956a_100000746989_100000210147 [0,1,1,0,0,0|2,0,0]=4 2436 B10R0.6 CCSCCN(C)CC(=O)O 269956a_100000746989_100000757381 [0,1,1,0,0,0|2,0,0]=4 2437 B10R0.6 CN(CCCCF)CC(=O)O 269956a_100000746989_100000729493 [0,1,1,0,0,0|2,0,0]=4 2438 B10R0.6 CN(CCCCO)CC(=O)O 269956a_100000746989_100000210776 [0,1,1,0,0,0|2,0,0]=4 2439 B10R0.6 COCCCN(C)CC(=O)O 269956a_100000746989_100000740836 [0,1,1,0,0,0|2,0,0]=4 2440 B10R0.6 COCNCC(O)CC(=O)O 269956a_100011218706_100000766300 [0,1,1,0,0,0|2,0,0]=4 2441 B10R0.6 CSCNCC(O)CC(=O)O 269956a_100011218706_100011218213 [0,1,1,0,0,0|2,0,0]=4 2442 B10R0.6 O=C(O)CC(O)CNCCF 269956a_100011218706_100011217306 [0,1,1,0,0,0|2,0,0]=4 2443 B10R0.6 O=C(O)CC(O)CNCCO 269956a_100011218706_100000211926 [0,1,1,0,0,0|2,0,0]=4 2444 B10R0.55 CCC(=O)CCCCC(=O)C 1458a_100000210414_100000735457 [0,1,1,0,0,0|1,0,1]=4 2445 B10R0.55 CCC(C)CCNCC(=O)N 2230a_100020591266_100000747473 [0,1,1,0,0,0|2,0,0]=4 2446 B10R0.55 CCC(C)CCOCC(=O)N 7a_100011215188_100000187820 [0,1,1,0,0,0|2,0,0]=4 2447 B10R0.55 CCC(C)CNCCC(=O)N 2230a_100020588543_100000744528 [0,1,1,0,0,0|2,0,0]=4 2448 B10R0.55 CCC(C)CNOCC(=O)O 269956a_100000106656_100000748023 [0,1,1,0,0,0|2,0,0]=4 2449 B10R0.55 CCC(C)COCCC(=O)C 34a_100000759926_100000748023 [0,1,1,0,0,0|2,0,0]=4 2450 B10R0.55 CCC(C)COCCC(=O)C 7a_100000759926_100000748023 [0,1,1,0,0,0|2,0,0]=4 2451 B10R0.55 CCC(C)COCCC(=O)N 34a_100000757172_100000748023 [0,1,1,0,0,0|2,0,0]=4 2452 B10R0.55 CCC(C)COCCC(=O)N 7a_100000757172_100000748023 [0,1,1,0,0,0|2,0,0]=4 2453 B10R0.55 CCC(C)CSCCC(=O)C 62a_100000053229_100000748023 [0,1,1,0,0,0|2,0,0]=4 2454 B10R0.55 CCC(C)CSCCC(=O)C 62a_100000748023_100000053229 [0,1,1,0,0,0|2,0,0]=4 2455 B10R0.55 CCC(C)CSCCC(=O)N 62a_100000744528_100000748023 [0,1,1,0,0,0|2,0,0]=4 2456 B10R0.55 CCC(C)CSCCC(=O)N 62a_100000748023_100000744528 [0,1,1,0,0,0|2,0,0]=4 2457 B10R0.55 CCC(C)NCCCC(=O)N 34a_100000739312_100011215416 [0,1,1,0,0,0|2,0,0]=4 2458 B10R0.55 CCC(C)OCCCC(=O)C 34a_100000759063_100011215416 [0,1,1,0,0,0|2,0,0]=4 2459 B10R0.55 CCC(C)OCCCC(=O)C 7a_100000210228_100011215641 [0,1,1,0,0,0|2,0,0]=4 2460 B10R0.55 CCC(C)OCCCC(=O)C 7a_100000759063_100000758301 [0,1,1,0,0,0|2,0,0]=4 2461 B10R0.55 CCC(C)OCCCC(=O)N 7a_100000210228_100102525003 [0,1,1,0,0,0|2,0,0]=4 2462 B10R0.55 CCC(C)SCCCC(=O)C 62a_100000758301_100011215641 [0,1,1,0,0,0|2,0,0]=4 2463 B10R0.55 CCC(C)SCCCC(=O)C 62a_100011215641_100000758301 [0,1,1,0,0,0|2,0,0]=4 2464 B10R0.55 CCC(C)SCCCC(=O)N 62a_100000758301_100102525003 [0,1,1,0,0,0|2,0,0]=4 2465 B10R0.55 CCC(C)SCCCC(=O)N 62a_100102525003_100000758301 [0,1,1,0,0,0|2,0,0]=4 2466 B10R0.55 CCC(O)CNCCC(=O)N 2230a_100011218483_100000744528 [0,1,1,0,0,0|2,0,0]=4 2467 B10R0.55 CCC(O)CNOCC(=O)O 269956a_100000106656_100011218378 [0,1,1,0,0,0|2,0,0]=4 2468 B10R0.55 CCC(O)COCCC(=O)C 34a_100000759926_100011218378 [0,1,1,0,0,0|2,0,0]=4 2469 B10R0.55 CCC(O)COCCC(=O)C 7a_100000759926_100011218378 [0,1,1,0,0,0|2,0,0]=4 2470 B10R0.55 CCC(O)COCCC(=O)N 34a_100000757172_100011218378 [0,1,1,0,0,0|2,0,0]=4 2471 B10R0.55 CCC(O)COCCC(=O)N 7a_100000757172_100011218378 [0,1,1,0,0,0|2,0,0]=4 2472 B10R0.55 CCC(O)CSCCC(=O)C 62a_100000053229_100011218378 [0,1,1,0,0,0|2,0,0]=4 2473 B10R0.55 CCC(O)CSCCC(=O)C 62a_100011218378_100000053229 [0,1,1,0,0,0|2,0,0]=4 2474 B10R0.55 CCC(O)CSCCC(=O)N 62a_100000744528_100011218378 [0,1,1,0,0,0|2,0,0]=4 2475 B10R0.55 CCC(O)CSCCC(=O)N 62a_100011218378_100000744528 [0,1,1,0,0,0|2,0,0]=4 2476 B10R0.55 CCN(C)CCCCC(=O)C 269982a_100000225621_100000735457 [0,1,1,0,0,0|2,0,0]=4 2477 B10R0.55 CC[C@H](C)CNOCC(=O)O 269956a_100000106656_100009816398 [0,1,1,0,0,0|2,0,0]=4 2478 B10R0.55 CC[C@H](C)COCCC(=O)C 34a_100000759926_100009816398 [0,1,1,0,0,0|2,0,0]=4 2479 B10R0.55 CC[C@H](C)COCCC(=O)C 7a_100000759926_100009816398 [0,1,1,0,0,0|2,0,0]=4 2480 B10R0.55 CC[C@H](C)COCCC(=O)C 7a_100009816381_100000053229 [0,1,1,0,0,0|2,0,0]=4 2481 B10R0.55 CC[C@H](C)COCCC(=O)N 34a_100000757172_100009816398 [0,1,1,0,0,0|2,0,0]=4 2482 B10R0.55 CC[C@H](C)COCCC(=O)N 7a_100000757172_100009816398 [0,1,1,0,0,0|2,0,0]=4 2483 B10R0.55 CC[C@H](C)COCCC(=O)N 7a_100009816381_100000744528 [0,1,1,0,0,0|2,0,0]=4 2484 B10R0.55 CC[C@H](C)CSCCC(=O)C 62a_100000053229_100009816398 [0,1,1,0,0,0|2,0,0]=4 2485 B10R0.55 CC[C@H](C)CSCCC(=O)C 62a_100009816398_100000053229 [0,1,1,0,0,0|2,0,0]=4 2486 B10R0.55 CC[C@H](C)CSCCC(=O)N 62a_100000744528_100009816398 [0,1,1,0,0,0|2,0,0]=4 2487 B10R0.55 CC[C@H](C)CSCCC(=O)N 62a_100009816398_100000744528 [0,1,1,0,0,0|2,0,0]=4 2488 B10R0.74 C#CC(=O)CCCCCCC 1458a_100000211873_100000210614 [0,1,1,0,0,0|1,0,0]=3 2489 B10R0.74 C#CC(=O)CCCCCCF 1458a_100000211873_100015922095 [0,1,1,0,0,0|2,0,0]=4 2490 B10R0.74 C#CC(=O)CCCCCCO 1458a_100000211873_100000766143 [0,1,1,0,0,0|2,0,0]=4 2491 B10R0.74 C#CC(=O)CCOCCCC 1458a_100000211873_100000743108 [0,1,1,0,0,0|2,0,0]=4 2492 B10R0.74 C#CCCCCCC(=O)CO 1458a_100000210174_100012094781 [0,1,1,0,0,0|0,0,2]=4 2493 B10R0.74 C=CC(=O)CCCCCCC 1458a_100000185746_100000210614 [0,1,1,0,0,0|1,0,0]=3 2494 B10R0.74 C=CC(=O)CCCCCCF 1458a_100000185746_100015922095 [0,1,1,0,0,0|2,0,0]=4 2495 B10R0.74 C=CC(=O)CCCCCCO 1458a_100000185746_100000766143 [0,1,1,0,0,0|2,0,0]=4 2496 B10R0.74 C=CC(=O)CCOCCCC 1458a_100000185746_100000743108 [0,1,1,0,0,0|2,0,0]=4 2497 B10R0.74 C=CC(=O)NCCCCCC 1626a_100000210581_100000185746 [0,1,1,0,0,0|2,0,0]=4 2498 B10R0.74 C=CC(=O)NCCCCCC 240690a_100000210581_200121576911 [0,1,1,0,0,0|2,0,0]=4 2499 B10R0.74 C=CCCCCCC(=O)CO 1458a_100000210174_100000700193 [0,1,1,0,0,0|0,0,2]=4 2500 B10R0.74 CCC(=O)CCCCCCF 1458a_100000210414_100015922095 [0,1,1,0,0,0|2,0,0]=4 2501 B10R0.74 CCC(=O)CCCCCCO 1458a_100000210414_100000766143 [0,1,1,0,0,0|2,0,0]=4 2502 B10R0.74 CCC(=O)CCCCCCO 1458a_100011996774_100000210202 [0,1,1,0,0,0|2,0,0]=4 2503 B10R0.74 CCC(=O)CCCCCOC 1458a_100011935119_100000210202 [0,1,1,0,0,0|2,0,0]=4 2504 B10R0.74 CCCCCCCC(=O)CC 1458a_100000210414_100000210614 [0,1,1,0,0,0|1,0,0]=3 2505 B10R0.74 CCCCCCCC(=O)CC 1458a_100000211969_100000210202 [0,1,1,0,0,0|1,0,0]=3 2506 B10R0.74 CCCCCCCC(=O)CF 1458a_100000211969_100015361967 [0,1,1,0,0,0|1,0,0]=3 2507 B10R0.74 CCCCCCCC(=O)CO 1458a_100000210174_100000210614 [0,1,1,0,0,0|0,0,0]=2 2508 B10R0.74 CCCCCCCC(=O)NC 11a_106832991635_100000211969 [0,1,1,0,0,0|1,0,0]=3 2509 B10R0.74 CCCCCCCC(=O)NC 1626a_100102657272_100000211969 [0,1,1,0,0,0|1,0,0]=3 2510 B10R0.74 CCCCCCCC(=O)NC 240690a_100102657272_100000211969 [0,1,1,0,0,0|1,0,0]=3 2511 B10R0.74 CCCCCCCC(=O)NC 527a_100102657272_100000211969 [0,1,1,0,0,0|1,0,0]=3 2512 B10R0.74 CCCCCCCC(C)OC 34a_100138415774_200011218727 [0,1,1,0,0,0|1,0,1]=4 2513 B10R0.74 CCCCCCCC(C)OC 34a_200011215852_200000210301 [0,1,1,0,0,0|1,0,1]=4 2514 B10R0.74 CCCCCCCC(C)OC 7a_200011215852_200000210301 [0,1,1,0,0,0|1,0,1]=4 2515 B10R0.74 CCCCCCCC(C)O[13CH3] 34a_200011215852_200025704644 [0,1,1,0,0,0|1,0,1]=4 2516 B10R0.74 CCCCCCCC(C)O[13CH3] 7a_200011215852_200025704644 [0,1,1,0,0,0|1,0,1]=4 2517 B10R0.74 CCCCCCNC(=O)CC 11a_100000210581_100000210414 [0,1,1,0,0,0|2,0,0]=4 2518 B10R0.74 CCCCCCNC(=O)CC 1626a_100000210581_100000210414 [0,1,1,0,0,0|2,0,0]=4 2519 B10R0.74 CCCCCCNC(=O)CC 240690a_100000210581_100000210414 [0,1,1,0,0,0|2,0,0]=4 2520 B10R0.74 CCCCCCNC(=O)CC 527a_100000210581_100000210414 [0,1,1,0,0,0|2,0,0]=4 2521 B10R0.74 CCCCCCNC(=O)CO 240690a_100000210581_100000210174 [0,1,1,0,0,0|1,0,0]=3 2522 B10R0.74 CCCCCCNC(=O)CO 527a_100000210581_100000210174 [0,1,1,0,0,0|1,0,0]=3 2523 B10R0.74 CCCCCCNC(=O)NC 2708a_100000210581_106832991635 [0,1,1,0,0,0|2,0,0]=4 2524 B10R0.74 CCCCCCNC(=O)NC 2708a_100102657272_100000210581 [0,1,1,0,0,0|2,0,0]=4 2525 B10R0.74 CCCCCCNC(=O)NC 273464a_100000210581_100102657272 [0,1,1,0,0,0|2,0,0]=4 2526 B10R0.74 CCCCCCNC(=O)NC 273464a_100102657272_100000210581 [0,1,1,0,0,0|2,0,0]=4 2527 B10R0.74 CCCCCCNC(=O)NC 512a_100000210581_100102657272 [0,1,1,0,0,0|2,0,0]=4 2528 B10R0.74 CCCCCCNC(=O)NC 512a_106832991638_100000210581 [0,1,1,0,0,0|2,0,0]=4 2529 B10R0.74 CCCCCNCC(=O)NC 2230a_100000209983_100000183359 [0,1,1,0,0,0|2,0,0]=4 2530 B10R0.74 CCCCCNCC(=O)NC 2230a_100000693194_100000210326 [0,1,1,0,0,0|2,0,0]=4 2531 B10R0.74 CCCCCNCC(=O)OC 2230a_100000209983_100000747449 [0,1,1,0,0,0|1,0,0]=3 2532 B10R0.74 CCCCCNNC(=O)CO 22a_100000694160_100000210174 [0,1,1,0,0,0|2,0,0]=4 2533 B10R0.74 CCCCCOCC(=O)CC 34a_100000725409_100000718602 [0,1,1,0,0,0|2,0,0]=4 2534 B10R0.74 CCCCCOCC(=O)CC 7a_100000210253_100000747405 [0,1,1,0,0,0|2,0,0]=4 2535 B10R0.74 CCCCCOCC(=O)NC 34a_100000210253_100000183359 [0,1,1,0,0,0|2,0,0]=4 2536 B10R0.74 CCCCCOCC(=O)NC 34a_100000750040_100000718602 [0,1,1,0,0,0|2,0,0]=4 2537 B10R0.74 CCCCCOCC(=O)NC 7a_100000210253_100000183359 [0,1,1,0,0,0|2,0,0]=4 2538 B10R0.74 CCCCCOCC(=O)OC 34a_100000210253_100000747449 [0,1,1,0,0,0|1,0,0]=3 2539 B10R0.74 CCCCCOCC(=O)OC 7a_100000210253_100000747449 [0,1,1,0,0,0|1,0,0]=3 2540 B10R0.74 CCCCCSCC(=O)CC 62a_100000210326_100000747405 [0,1,1,0,0,0|2,0,0]=4 2541 B10R0.74 CCCCCSCC(=O)CC 62a_100000747405_100000210326 [0,1,1,0,0,0|2,0,0]=4 2542 B10R0.74 CCCCCSCC(=O)NC 62a_100000183359_100000210326 [0,1,1,0,0,0|2,0,0]=4 2543 B10R0.74 CCCCCSCC(=O)NC 62a_100000210326_100000183359 [0,1,1,0,0,0|2,0,0]=4 2544 B10R0.74 CCCCCSCC(=O)OC 62a_100000210326_100000747449 [0,1,1,0,0,0|1,0,0]=3 2545 B10R0.74 CCCCCSCC(=O)OC 62a_100000747449_100000210326 [0,1,1,0,0,0|1,0,0]=3 2546 B10R0.74 CCCCNCCC(=O)NC 2230a_100000102301_100000737683 [0,1,1,0,0,0|2,0,0]=4 2547 B10R0.74 CCCCNCCC(=O)NC 2230a_100000738227_100000210211 [0,1,1,0,0,0|2,0,0]=4 2548 B10R0.74 CCCCNCCC(=O)NC 34a_100000738227_100000210210 [0,1,1,0,0,0|2,0,0]=4 2549 B10R0.74 CCCCNCCC(=O)NC 7a_106832991798_100000737683 [0,1,1,0,0,0|2,0,0]=4 2550 B10R0.74 CCCCNCCC(=O)OC 2230a_100000102301_100000204255 [0,1,1,0,0,0|1,0,0]=3 2551 B10R0.74 CCCCNCCC(=O)OC 7a_106832991798_100000204255 [0,1,1,0,0,0|1,0,0]=3 2552 B10R0.74 CCCCOCCC(=NO)N 34a_100000749954_100000210210 [0,1,1,0,0,0|2,0,0]=4 2553 B10R0.74 CCCCOCCC(=O)CC 1458a_100000210414_100000743108 [0,1,1,0,0,0|2,0,0]=4 2554 B10R0.74 CCCCOCCC(=O)CO 1458a_100000210174_100000743108 [0,1,1,0,0,0|1,0,0]=3 2555 B10R0.74 CCCCOCCC(=O)NC 34a_100000210227_100012179268 [0,1,1,0,0,0|2,0,0]=4 2556 B10R0.74 CCCCOCCC(=O)NC 34a_100000754576_100000210210 [0,1,1,0,0,0|2,0,0]=4 2557 B10R0.74 CCCCOCCC(=O)NC 7a_100000210227_100000737683 [0,1,1,0,0,0|2,0,0]=4 2558 B10R0.74 CCCCOCCC(=O)OC 34a_100000210227_100000742370 [0,1,1,0,0,0|1,0,0]=3 2559 B10R0.74 CCCCOCCC(=O)OC 7a_100000210227_100000204255 [0,1,1,0,0,0|1,0,0]=3 2560 B10R0.74 CCCCSCCC(=O)NC 62a_100000210211_100000737683 [0,1,1,0,0,0|2,0,0]=4 2561 B10R0.74 CCCCSCCC(=O)NC 62a_100000737683_100000210210 [0,1,1,0,0,0|2,0,0]=4 2562 B10R0.74 CCCCSCCC(=O)OC 62a_100000204255_100000210210 [0,1,1,0,0,0|1,0,0]=3 2563 B10R0.74 CCCCSCCC(=O)OC 62a_100000210211_100000204255 [0,1,1,0,0,0|1,0,0]=3 2564 B10R0.74 CCCCSCOC(=O)OC 62a_100000210211_100000139417 [0,1,1,0,0,0|2,0,0]=4 2565 B10R0.74 CCCNCCCC(=O)NC 2230a_100000740002_100000210303 [0,1,1,0,0,0|2,0,0]=4 2566 B10R0.74 CCCNCCCC(=O)NC 34a_100000740002_100000210303 [0,1,1,0,0,0|2,0,0]=4 2567 B10R0.74 CCCOCCCC(=O)NC 34a_100000210258_100000741757 [0,1,1,0,0,0|2,0,0]=4 2568 B10R0.74 CCCOCCCC(=O)NN 34a_100000211488_100000210303 [0,1,1,0,0,0|2,0,0]=4 2569 B10R0.74 CCCOCCCC(=O)OC 34a_100000210258_100000742333 [0,1,1,0,0,0|1,0,0]=3 2570 B10R0.74 CCCOCCNC(=O)CO 240690a_100161115042_100000210174 [0,1,1,0,0,0|2,0,0]=4 2571 B10R0.74 CCCOCCNC(=O)CO 527a_100161115042_100000210174 [0,1,1,0,0,0|2,0,0]=4 2572 B10R0.74 CCCOCCNC(=O)OC 34a_100000757965_100000210303 [0,1,1,0,0,0|2,0,0]=4 2573 B10R0.74 CCCOCCOC(=O)OC 34a_100010262106_100000210303 [0,1,1,0,0,0|2,0,0]=4 2574 B10R0.74 CCCSCCCC(=O)NC 62a_100000210303_100000741757 [0,1,1,0,0,0|2,0,0]=4 2575 B10R0.74 CCCSCCCC(=O)NC 62a_100000741757_100000210303 [0,1,1,0,0,0|2,0,0]=4 2576 B10R0.74 CCCSCCCC(=O)OC 62a_100000210303_100011218270 [0,1,1,0,0,0|1,0,0]=3 2577 B10R0.74 CCCSCCCC(=O)OC 62a_100011218270_100000210303 [0,1,1,0,0,0|1,0,0]=3 2578 B10R0.74 CCCSCCNC(=O)CO 240690a_100020603323_100000210174 [0,1,1,0,0,0|2,0,0]=4 2579 B10R0.74 CCCSCCNC(=O)CO 527a_100020603323_100000210174 [0,1,1,0,0,0|2,0,0]=4 2580 B10R0.74 CCNCCCCC(=O)OC 2230a_100015525214_100000204269 [0,1,1,0,0,0|1,0,0]=3 2581 B10R0.74 CCNCCOCC(=O)OC 2230a_100015525214_100000090808 [0,1,1,0,0,0|2,0,0]=4 2582 B10R0.74 CCOCCCCC(=O)OC 34a_100000059025_100000210202 [0,1,1,0,0,0|1,0,0]=3 2583 B10R0.74 CCOCCCCC(=O)OC 34a_100121572206_100000204269 [0,1,1,0,0,0|1,0,0]=3 2584 B10R0.74 CCOCCCCC(=O)OC 7a_100000059025_100000210202 [0,1,1,0,0,0|1,0,0]=3 2585 B10R0.74 CCOCCCNC(=O)CO 240690a_100000210961_100000210174 [0,1,1,0,0,0|2,0,0]=4 2586 B10R0.74 CCOCCCNC(=O)CO 527a_100000210961_100000210174 [0,1,1,0,0,0|2,0,0]=4 2587 B10R0.74 CCOCCNCC(=O)OC 2230a_102516460346_100000747449 [0,1,1,0,0,0|2,0,0]=4 2588 B10R0.74 CCOCCNCC(=O)OC 34a_102516460346_100000747449 [0,1,1,0,0,0|2,0,0]=4 2589 B10R0.74 CCOCCOCC(=O)OC 34a_100000210136_100000747449 [0,1,1,0,0,0|2,0,0]=4 2590 B10R0.74 CCOCCOCC(=O)OC 34a_100121572206_100000090808 [0,1,1,0,0,0|2,0,0]=4 2591 B10R0.74 CCOCCOCC(=O)OC 7a_100000210136_100000747449 [0,1,1,0,0,0|2,0,0]=4 2592 B10R0.74 CCOCCSCC(=O)OC 62a_100000210147_100000747449 [0,1,1,0,0,0|2,0,0]=4 2593 B10R0.74 CCOCCSCC(=O)OC 62a_100000747449_100011215890 [0,1,1,0,0,0|2,0,0]=4 2594 B10R0.74 CCOCSCCC(=O)OC 62a_100000204255_100000739092 [0,1,1,0,0,0|2,0,0]=4 2595 B10R0.74 CCOCSCCC(=O)OC 62a_100000739092_100000204255 [0,1,1,0,0,0|2,0,0]=4 2596 B10R0.74 CCSCCCCC(=O)OC 62a_100000204269_100000210202 [0,1,1,0,0,0|1,0,0]=3 2597 B10R0.74 CCSCCCCC(=O)OC 62a_100000210202_100000204269 [0,1,1,0,0,0|1,0,0]=3 2598 B10R0.74 CCSCCNCC(=O)OC 2230a_100000106463_100000747449 [0,1,1,0,0,0|2,0,0]=4 2599 B10R0.74 CCSCCOCC(=O)OC 34a_100000212035_100000747449 [0,1,1,0,0,0|2,0,0]=4 2600 B10R0.74 CCSCCOCC(=O)OC 62a_100000090808_100000210202 [0,1,1,0,0,0|2,0,0]=4 2601 B10R0.74 CCSCCOCC(=O)OC 62a_100000210202_100000090808 [0,1,1,0,0,0|2,0,0]=4 2602 B10R0.74 CCSCCOCC(=O)OC 7a_100000212035_100000747449 [0,1,1,0,0,0|2,0,0]=4 2603 B10R0.74 CCSCCSCC(=O)OC 62a_100000747449_100000757381 [0,1,1,0,0,0|2,0,0]=4 2604 B10R0.74 CCSCCSCC(=O)OC 62a_100000757381_100000747449 [0,1,1,0,0,0|2,0,0]=4 2605 B10R0.74 CNC(=O)CCCCCCO 240690a_100102657272_100011996774 [0,1,1,0,0,0|2,0,0]=4 2606 B10R0.74 CNC(=O)CCCCCOC 11a_106832991635_100011935119 [0,1,1,0,0,0|2,0,0]=4 2607 B10R0.74 CNC(=O)CCCCCOC 1626a_100102657272_100011935119 [0,1,1,0,0,0|2,0,0]=4 2608 B10R0.74 CNC(=O)CCCCCOC 240690a_100102657272_100011935119 [0,1,1,0,0,0|2,0,0]=4 2609 B10R0.74 CNC(=O)CCCCCOC 527a_100102657272_100011935119 [0,1,1,0,0,0|2,0,0]=4 2610 B10R0.74 CNCCCCCC(=O)OC 2230a_106832991635_100009816466 [0,1,1,0,0,0|1,0,0]=3 2611 B10R0.74 CNCCCCCC(=O)OC 34a_100102657272_100009816466 [0,1,1,0,0,0|1,0,0]=3 2612 B10R0.74 CNCCCCCC(=O)OC 7a_106832991635_100009816466 [0,1,1,0,0,0|1,0,0]=3 2613 B10R0.74 CNCCCOCC(=O)OC 34a_100000213112_100000747449 [0,1,1,0,0,0|2,0,0]=4 2614 B10R0.74 COC(=O)CCCCCO[13CH3] 34a_100000074720_200025704644 [0,1,1,0,0,0|1,0,0]=3 2615 B10R0.74 COC(=O)CCCCCO[13CH3] 7a_100000074720_200025704644 [0,1,1,0,0,0|1,0,0]=3 2616 B10R0.74 COC(=O)CCCCCSC 62a_100009816466_200000210301 [0,1,1,0,0,0|1,0,0]=3 2617 B10R0.74 COC(=O)CCCCCSC 62a_200000210301_100009816466 [0,1,1,0,0,0|1,0,0]=3 2618 B10R0.74 COC(=O)CCCCCS[13CH3] 62a_100009816466_200025704644 [0,1,1,0,0,0|1,0,0]=3 2619 B10R0.74 COC(=O)CCCCCS[13CH3] 62a_200025704644_100009816466 [0,1,1,0,0,0|1,0,0]=3 2620 B10R0.74 COC(=O)CCCCOCF 34a_100000059025_100015361967 [0,1,1,0,0,0|2,0,0]=4 2621 B10R0.74 COC(=O)CCCCOCF 7a_100000059025_100015361967 [0,1,1,0,0,0|2,0,0]=4 2622 B10R0.74 COC(=O)CCCCSCF 62a_100000204269_100015361967 [0,1,1,0,0,0|2,0,0]=4 2623 B10R0.74 COC(=O)CCCCSCF 62a_100015361967_100000204269 [0,1,1,0,0,0|2,0,0]=4 2624 B10R0.74 COC(=O)CCCNCCF 34a_100000724931_100000742333 [0,1,1,0,0,0|2,0,0]=4 2625 B10R0.74 COC(=O)CCCNCCO 2230a_100016997473_100011218270 [0,1,1,0,0,0|2,0,0]=4 2626 B10R0.74 COC(=O)CCCNCCO 34a_100016990907_100000742333 [0,1,1,0,0,0|2,0,0]=4 2627 B10R0.74 COC(=O)CCCOCCBr 34a_100000211926_100000742333 [0,1,1,0,0,0|2,0,0]=4 2628 B10R0.74 COC(=O)CCCOCCN 34a_100000210304_100000742333 [0,1,1,0,0,0|2,0,0]=4 2629 B10R0.74 COC(=O)CCCSCCF 62a_100011217306_100011218270 [0,1,1,0,0,0|2,0,0]=4 2630 B10R0.74 COC(=O)CCCSCCF 62a_100011218270_100011217306 [0,1,1,0,0,0|2,0,0]=4 2631 B10R0.74 COC(=O)CCCSCCO 62a_100000211926_100011218270 [0,1,1,0,0,0|2,0,0]=4 2632 B10R0.74 COC(=O)CCCSCCO 62a_100011218270_100000211926 [0,1,1,0,0,0|2,0,0]=4 2633 B10R0.74 COC(=O)CCCSCSC 62a_100011218213_100011218270 [0,1,1,0,0,0|2,0,0]=4 2634 B10R0.74 COC(=O)CCCSCSC 62a_100011218270_100011218213 [0,1,1,0,0,0|2,0,0]=4 2635 B10R0.74 COC(=O)CCNCCCF 2230a_100015189416_100000204255 [0,1,1,0,0,0|2,0,0]=4 2636 B10R0.74 COC(=O)CCNCCCF 34a_100015189416_100000742370 [0,1,1,0,0,0|2,0,0]=4 2637 B10R0.74 COC(=O)CCNCCSC 2230a_100020590264_100000204255 [0,1,1,0,0,0|2,0,0]=4 2638 B10R0.74 COC(=O)CCOCCCBr 34a_100011217188_100000742370 [0,1,1,0,0,0|2,0,0]=4 2639 B10R0.74 COC(=O)CCOCCCCl 34a_100000230001_100000742370 [0,1,1,0,0,0|2,0,0]=4 2640 B10R0.74 COC(=O)CCOCCCF 34a_100000759539_100000742370 [0,1,1,0,0,0|2,0,0]=4 2641 B10R0.74 COC(=O)CCOCCCN 34a_100000182051_100000742370 [0,1,1,0,0,0|2,0,0]=4 2642 B10R0.74 COC(=O)CCOCCSC 34a_100000230434_100000742370 [0,1,1,0,0,0|2,0,0]=4 2643 B10R0.74 COC(=O)CCOCCSC 7a_100000230434_100000204255 [0,1,1,0,0,0|2,0,0]=4 2644 B10R0.74 COC(=O)CCSCCCF 62a_100000204255_100011934791 [0,1,1,0,0,0|2,0,0]=4 2645 B10R0.74 COC(=O)CCSCCCF 62a_100011934791_100000204255 [0,1,1,0,0,0|2,0,0]=4 2646 B10R0.74 COC(=O)CCSCCCO 62a_100000204255_100011215043 [0,1,1,0,0,0|2,0,0]=4 2647 B10R0.74 COC(=O)CCSCCCO 62a_100011215043_100000204255 [0,1,1,0,0,0|2,0,0]=4 2648 B10R0.74 COC(=O)CCSCCSC 62a_100000204255_100000751147 [0,1,1,0,0,0|2,0,0]=4 2649 B10R0.74 COC(=O)CCSCCSC 62a_100000212216_100000204255 [0,1,1,0,0,0|2,0,0]=4 2650 B10R0.74 COC(=O)CNCCCCO 2230a_100000750430_100000747449 [0,1,1,0,0,0|2,0,0]=4 2651 B10R0.74 COC(=O)CNCCCCO 34a_100000750430_100000747449 [0,1,1,0,0,0|2,0,0]=4 2652 B10R0.74 COC(=O)CNCCCSC 2230a_100000749238_100000747449 [0,1,1,0,0,0|2,0,0]=4 2653 B10R0.74 COC(=O)COCCCCBr 34a_100011216708_100000747449 [0,1,1,0,0,0|2,0,0]=4 2654 B10R0.74 COC(=O)COCCCCCl 34a_100000210776_100000747449 [0,1,1,0,0,0|2,0,0]=4 2655 B10R0.74 COC(=O)COCCCCCl 7a_100000210776_100000747449 [0,1,1,0,0,0|2,0,0]=4 2656 B10R0.74 COC(=O)COCCCCF 34a_100011995726_100000747449 [0,1,1,0,0,0|2,0,0]=4 2657 B10R0.74 COC(=O)COCCCCF 7a_100011995726_100000747449 [0,1,1,0,0,0|2,0,0]=4 2658 B10R0.74 COC(=O)COCCCCI 34a_200012148704_100000747449 [0,1,1,0,0,0|2,0,0]=4 2659 B10R0.74 COC(=O)COCCCCN 34a_100000750430_100000747449 [0,1,1,0,0,0|2,0,0]=4 2660 B10R0.74 COC(=O)COCCCSC 34a_100000690336_100000747449 [0,1,1,0,0,0|2,0,0]=4 2661 B10R0.74 COC(=O)COCCCSC 7a_100000690336_100000747449 [0,1,1,0,0,0|2,0,0]=4 2662 B10R0.74 COC(=O)CSCCCCF 62a_100000729493_100000747449 [0,1,1,0,0,0|2,0,0]=4 2663 B10R0.74 COC(=O)CSCCCCF 62a_100000747449_100000729493 [0,1,1,0,0,0|2,0,0]=4 2664 B10R0.74 COC(=O)CSCCCCO 62a_100000210776_100000747449 [0,1,1,0,0,0|2,0,0]=4 2665 B10R0.74 COC(=O)CSCCCCO 62a_100000747449_100000210776 [0,1,1,0,0,0|2,0,0]=4 2666 B10R0.74 COCCCCCC(=O)CF 1458a_100011935119_100015361967 [0,1,1,0,0,0|2,0,0]=4 2667 B10R0.74 COCCCCCC(=O)OC 34a_100000074720_200000210301 [0,1,1,0,0,0|1,0,0]=3 2668 B10R0.74 COCCCCCC(=O)OC 34a_100138415774_100009816466 [0,1,1,0,0,0|1,0,0]=3 2669 B10R0.74 COCCCCCC(=O)OC 7a_100000074720_200000210301 [0,1,1,0,0,0|1,0,0]=3 2670 B10R0.74 COCCCNCC(=O)OC 34a_100150723488_100000747449 [0,1,1,0,0,0|2,0,0]=4 2671 B10R0.74 COCCCOCC(=O)OC 34a_100000740835_100000747449 [0,1,1,0,0,0|2,0,0]=4 2672 B10R0.74 COCCCSCC(=O)OC 62a_100000709357_100000747449 [0,1,1,0,0,0|2,0,0]=4 2673 B10R0.74 COCCCSCC(=O)OC 62a_100000747449_100000709357 [0,1,1,0,0,0|2,0,0]=4 2674 B10R0.74 COCCNCCC(=O)OC 2230a_100000209980_100000204255 [0,1,1,0,0,0|2,0,0]=4 2675 B10R0.74 COCCOCCC(=O)CO 1458a_100000210174_100000695917 [0,1,1,0,0,0|2,0,0]=4 2676 B10R0.74 COCCOCCC(=O)OC 34a_100000210237_100000742370 [0,1,1,0,0,0|2,0,0]=4 2677 B10R0.74 COCCSCCC(=O)OC 62a_100000204255_100000233755 [0,1,1,0,0,0|2,0,0]=4 2678 B10R0.74 COCCSCCC(=O)OC 62a_100000233755_100000204255 [0,1,1,0,0,0|2,0,0]=4 2679 B10R0.74 COCSCCCC(=O)OC 62a_100000766300_100011218270 [0,1,1,0,0,0|2,0,0]=4 2680 B10R0.74 COCSCCCC(=O)OC 62a_100011218270_100000766300 [0,1,1,0,0,0|2,0,0]=4 2681 B10R0.74 N#CCCCCCC(=O)CO 1458a_100000210174_100009813376 [0,1,1,0,0,0|1,0,1]=4 2682 B10R0.74 O=C(CF)CCCCCCO 1458a_100011996774_100015361967 [0,1,1,0,0,0|2,0,0]=4 2683 B10R0.74 O=C(CO)CCCCCCF 1458a_100000210174_100015922095 [0,1,1,0,0,0|1,0,0]=3 2684 B10R0.74 O=C(CO)CCCCCCO 1458a_100000210174_100000766143 [0,1,1,0,0,0|1,0,0]=3 2685 B10R0.74 O=C(CO)NCCCCCO 240690a_100000762737_100000210174 [0,1,1,0,0,0|2,0,0]=4 2686 B10R0.75 CC(CNCCCF)C(=O)O 269956a_100000749485_100011934791 [0,1,1,0,0,0|2,0,0]=4 2687 B10R0.75 CC(CNCCCO)C(=O)O 269956a_100000749485_100011215043 [0,1,1,0,0,0|2,0,0]=4 2688 B10R0.75 CCCCCCC(C)C(=O)C 1458a_100000070787_100011215978 [0,1,1,0,0,0|1,0,0]=3 2689 B10R0.75 CCCCCCC(O)C(=O)C 1458a_100011215828_200000210301 [0,1,1,0,0,0|1,0,0]=3 2690 B10R0.75 CCCCCCC(O)C(=O)[13CH3] 1458a_100011215828_200025704644 [0,1,1,0,0,0|1,0,0]=3 2691 B10R0.75 CCCCCCN(C)C(=O)C 11a_106256046315_100015343762 [0,1,1,0,0,0|2,0,0]=4 2692 B10R0.75 CCCCCCN(C)C(=O)C 1626a_106256046315_100015343762 [0,1,1,0,0,0|2,0,0]=4 2693 B10R0.75 CCCCCCN(C)C(=O)C 240690a_106256046315_100015343762 [0,1,1,0,0,0|2,0,0]=4 2694 B10R0.75 CCCCCCN(C)C(=O)C 527a_106256046315_100103153847 [0,1,1,0,0,0|2,0,0]=4 2695 B10R0.75 CCCCCNC(C)C(=O)C 2230a_100000209983_100009814033 [0,1,1,0,0,0|2,0,0]=4 2696 B10R0.75 CCCCCNC(C)C(=O)N 2230a_100000209983_100000702099 [0,1,1,0,0,0|2,0,0]=4 2697 B10R0.75 CCCCCNC(F)C(=O)N 2230a_100000209983_100009813875 [0,1,1,0,0,0|2,0,0]=4 2698 B10R0.75 CCCCCN[C@@H](C)C(=O)O 269956a_100000743915_100000210326 [0,1,1,0,0,0|1,0,0]=3 2699 B10R0.75 CCCCCN[C@H](C)C(=O)N 2230a_100000119354_100000210326 [0,1,1,0,0,0|2,0,0]=4 2700 B10R0.75 CCCCCN[C@H](C)C(=O)N 34a_100000119354_100000718602 [0,1,1,0,0,0|2,0,0]=4 2701 B10R0.75 CCCCCOC(C)C(=O)C 34a_100000212229_100000718602 [0,1,1,0,0,0|2,0,0]=4 2702 B10R0.75 CCCCCOC(C)C(=O)C 7a_100000210253_100000179758 [0,1,1,0,0,0|2,0,0]=4 2703 B10R0.75 CCCCCOC(C)C(=O)N 34a_100000210253_100000702099 [0,1,1,0,0,0|2,0,0]=4 2704 B10R0.75 CCCCCOC(C)C(=O)N 7a_100000210253_100000702099 [0,1,1,0,0,0|2,0,0]=4 2705 B10R0.75 CCCCCOC(F)C(=O)N 34a_100000210253_100009813875 [0,1,1,0,0,0|2,0,0]=4 2706 B10R0.75 CCCCCOC(F)C(=O)N 7a_100000210253_100009813875 [0,1,1,0,0,0|2,0,0]=4 2707 B10R0.75 CCCCCOC(F)C(=O)[O-] 34a_100000210253_100020610796 [0,1,1,0,0,0|1,0,1]=4 2708 B10R0.75 CCCCCO[C@@H](C)C(=O)[O-] 7a_217856618621_100000210326 [0,1,1,0,0,0|1,0,1]=4 2709 B10R0.75 CCCCCO[C@H](C)C(=O)N 34a_100000731257_100000718602 [0,1,1,0,0,0|2,0,0]=4 2710 B10R0.75 CCCCCO[C@H](C)C(=O)N 7a_100000731257_100000210326 [0,1,1,0,0,0|2,0,0]=4 2711 B10R0.75 CCCCCSC(C)C(=O)C 62a_100000210326_100009814033 [0,1,1,0,0,0|2,0,0]=4 2712 B10R0.75 CCCCCSC(C)C(=O)C 62a_100009814033_100000210326 [0,1,1,0,0,0|2,0,0]=4 2713 B10R0.75 CCCCCSC(C)C(=O)N 62a_100000210326_100000702099 [0,1,1,0,0,0|2,0,0]=4 2714 B10R0.75 CCCCCSC(C)C(=O)N 62a_100000702099_100000210326 [0,1,1,0,0,0|2,0,0]=4 2715 B10R0.75 CCCCCSC(F)C(=O)N 62a_100000210326_100009813875 [0,1,1,0,0,0|2,0,0]=4 2716 B10R0.75 CCCCCSC(F)C(=O)N 62a_100009813875_100000210326 [0,1,1,0,0,0|2,0,0]=4 2717 B10R0.75 CCCCCSC(F)C(=O)[O-] 62a_100000210326_100020610796 [0,1,1,0,0,0|1,0,1]=4 2718 B10R0.75 CCCCCSC(F)C(=O)[O-] 62a_100020610796_100000210326 [0,1,1,0,0,0|1,0,1]=4 2719 B10R0.75 CCCCNCC(C)C(=O)O 269956a_100000749485_100000210211 [0,1,1,0,0,0|1,0,0]=3 2720 B10R0.75 CCCCNCC(F)C(=O)O 269956a_100000084737_100000210211 [0,1,1,0,0,0|1,0,0]=3 2721 B10R0.75 CCCCOCC(C)C(=O)C 34a_100000032740_100000210210 [0,1,1,0,0,0|2,0,0]=4 2722 B10R0.75 CCCCOCC(C)C(=O)C 7a_100000032740_100000210211 [0,1,1,0,0,0|2,0,0]=4 2723 B10R0.75 CCCCOC[C@H](N)C(=O)N 34a_100000729942_100000210210 [0,1,1,0,0,0|2,0,0]=4 2724 B10R0.75 CCOCCN[C@@H](C)C(=O)O 269956a_100000743915_100000210147 [0,1,1,0,0,0|2,0,0]=4 2725 B10R0.75 CCOCNCC(C)C(=O)O 269956a_100000749485_100000739092 [0,1,1,0,0,0|2,0,0]=4 2726 B10R0.75 CCOCNCC(F)C(=O)O 269956a_100000084737_100000739092 [0,1,1,0,0,0|2,0,0]=4 2727 B10R0.75 CCSCCN[C@@H](C)C(=O)O 269956a_100000743915_100000757381 [0,1,1,0,0,0|2,0,0]=4 2728 B10R0.75 COCCCN[C@@H](C)C(=O)O 269956a_100000743915_100000740836 [0,1,1,0,0,0|2,0,0]=4 2729 B10R0.75 COCCNCC(C)C(=O)O 269956a_100000749485_100000233755 [0,1,1,0,0,0|2,0,0]=4 2730 B10R0.75 COCCNCC(F)C(=O)O 269956a_100000084737_100000233755 [0,1,1,0,0,0|2,0,0]=4 2731 B10R0.75 CSCCNCC(C)C(=O)O 269956a_100000749485_100000212216 [0,1,1,0,0,0|2,0,0]=4 2732 B10R0.75 CSCCNCC(F)C(=O)O 269956a_100000084737_100000212216 [0,1,1,0,0,0|2,0,0]=4 2733 B10R0.75 C[C@H](NCCCCF)C(=O)O 269956a_100000743915_100000729493 [0,1,1,0,0,0|2,0,0]=4 2734 B10R0.75 C[C@H](NCCCCO)C(=O)O 269956a_100000743915_100000210776 [0,1,1,0,0,0|2,0,0]=4 2735 B10R0.75 O=C(O)C(F)CNCCCF 269956a_100000084737_100011934791 [0,1,1,0,0,0|2,0,0]=4 2736 B10R0.75 O=C(O)C(F)CNCCCO 269956a_100000084737_100011215043 [0,1,1,0,0,0|2,0,0]=4 2737 B10R0.78 CCCCC(=O)CCC(=O)N 1458a_100011215257_100000210211 [0,1,1,0,0,0|1,0,1]=4 2738 B10R0.78 CCCCC(C)CCC(=O)C 1458a_100000033779_200000210301 [0,1,1,0,0,0|1,0,0]=3 2739 B10R0.78 CCCCC(C)CCC(=O)[13CH3] 1458a_100000033779_200025704644 [0,1,1,0,0,0|1,0,0]=3 2740 B10R0.78 CCCCC(C)NCC(=O)N 2230a_100000126638_100000747473 [0,1,1,0,0,0|2,0,0]=4 2741 B10R0.78 CCCCC(C)NCC(=O)N 2230a_100000711301_200011215066 [0,1,1,0,0,0|2,0,0]=4 2742 B10R0.78 CCCCC(C)NCC(=O)O 269956a_100016091260_200011215066 [0,1,1,0,0,0|1,0,0]=3 2743 B10R0.78 CCCCC(C)OCC(=O)C 34a_100000211253_200011215066 [0,1,1,0,0,0|2,0,0]=4 2744 B10R0.78 CCCCC(C)OCC(=O)N 34a_100000687866_100000187820 [0,1,1,0,0,0|2,0,0]=4 2745 B10R0.78 CCCCC(C)OCC(=O)N 7a_100000687866_100000187820 [0,1,1,0,0,0|2,0,0]=4 2746 B10R0.78 CCCCC(C)OCC(=O)[O-] 34a_100000687866_100020667443 [0,1,1,0,0,0|1,0,1]=4 2747 B10R0.78 CCCCC(C)SCC(=O)N 62a_100000747473_200011215066 [0,1,1,0,0,0|2,0,0]=4 2748 B10R0.78 CCCCC(C)SCC(=O)N 62a_200011215066_100000747473 [0,1,1,0,0,0|2,0,0]=4 2749 B10R0.78 CCCCC(C)SCC(=O)[O-] 62a_100020667443_200011215066 [0,1,1,0,0,0|1,0,1]=4 2750 B10R0.78 CCCCC(C)SCC(=O)[O-] 62a_200011215066_100020667443 [0,1,1,0,0,0|1,0,1]=4 2751 B10R0.78 CCCCN(C)CCC(=O)C 269982a_100000207549_100000053229 [0,1,1,0,0,0|2,0,0]=4 2752 B10R0.78 CCCCN(C)CCC(=O)N 2230a_100000207549_100000744528 [0,1,1,0,0,0|2,0,0]=4 2753 B10R0.78 CCCCN(C)CCC(=O)N 2230a_100000730477_100000210211 [0,1,1,0,0,0|2,0,0]=4 2754 B10R0.78 CCCCN(C)CCC(=O)N 269982a_100000207549_100000744528 [0,1,1,0,0,0|2,0,0]=4 2755 B10R0.97 CC(=O)CCCCCC(=O)N 1458a_100000070787_100009817443 [0,1,1,0,0,0|1,0,1]=4 2756 B10R0.97 CC(=O)CCCCCC(C)C 1458a_100000070787_100000210682 [0,1,1,0,0,0|1,0,0]=3 2757 B10R0.97 CC(=O)CCCCCC(C)C 1458a_100000766313_200000210301 [0,1,1,0,0,0|1,0,0]=3 2758 B10R0.97 CC(=O)CCCCNC(C)C 34a_100138425928_100009817362 [0,1,1,0,0,0|2,0,0]=4 2759 B10R0.97 CC(=O)CCCCOC(C)C 34a_100000212225_100009817362 [0,1,1,0,0,0|2,0,0]=4 2760 B10R0.97 CC(=O)CCCCSC(C)C 62a_100000210206_100000735457 [0,1,1,0,0,0|2,0,0]=4 2761 B10R0.97 CC(=O)CCCCSC(C)C 62a_100000735457_100000210206 [0,1,1,0,0,0|2,0,0]=4 2762 B10R0.97 CC(=O)CCCNCC(=O)O 269956a_100016091260_100011215641 [0,1,1,0,0,0|1,0,1]=4 2763 B10R0.97 CC(=O)CCCNCC(C)C 34a_100000210953_100000685027 [0,1,1,0,0,0|2,0,0]=4 2764 B10R0.97 CC(=O)CCCNCC(C)O 34a_100000210904_100000685027 [0,1,1,0,0,0|2,0,0]=4 2765 B10R0.97 CC(=O)CCCOCC(C)Br 34a_100012180447_100000685027 [0,1,1,0,0,0|2,0,0]=4 2766 B10R0.97 CC(=O)CCCOCC(C)C 34a_100000210257_100000685027 [0,1,1,0,0,0|2,0,0]=4 2767 B10R0.97 CC(=O)CCCOCC(C)C 34a_100000759063_100000210624 [0,1,1,0,0,0|2,0,0]=4 2768 B10R0.97 CC(=O)CCCOCC(C)C 7a_100000759063_100000210760 [0,1,1,0,0,0|2,0,0]=4 2769 B10R0.97 CC(=O)CCCOCC(C)F 34a_100015925927_100000685027 [0,1,1,0,0,0|2,0,0]=4 2770 B10R0.97 CC(=O)CCCOCC(C)O 34a_100000759063_100011218427 [0,1,1,0,0,0|2,0,0]=4 2771 B10R0.97 CC(=O)CCCOCC(C)O 7a_100000759063_100011218427 [0,1,1,0,0,0|2,0,0]=4 2772 B10R0.97 CC(=O)CCCOC[C@@H](C)Cl 34a_100016084084_100000685027 [0,1,1,0,0,0|2,0,0]=4 2773 B10R0.97 CC(=O)CCCOC[C@@H](C)N 34a_100000737577_100000685027 [0,1,1,0,0,0|2,0,0]=4 2774 B10R0.97 CC(=O)CCCOC[C@@H](C)O 34a_100000759063_100009817552 [0,1,1,0,0,0|2,0,0]=4 2775 B10R0.97 CC(=O)CCCOC[C@@H](C)O 7a_100000759063_100009817552 [0,1,1,0,0,0|2,0,0]=4 2776 B10R0.97 CC(=O)CCCSCC(C)C 62a_100000210624_100011215641 [0,1,1,0,0,0|2,0,0]=4 2777 B10R0.97 CC(=O)CCCSCC(C)C 62a_100011215641_100000210760 [0,1,1,0,0,0|2,0,0]=4 2778 B10R0.97 CC(=O)CCCSCC(C)O 62a_100011215641_100011218427 [0,1,1,0,0,0|2,0,0]=4 2779 B10R0.97 CC(=O)CCCSCC(C)O 62a_100011218427_100011215641 [0,1,1,0,0,0|2,0,0]=4 2780 B10R0.97 CC(=O)CCCSC[C@@H](C)O 62a_100009817552_100011215641 [0,1,1,0,0,0|2,0,0]=4 2781 B10R0.97 CC(=O)CCCSC[C@@H](C)O 62a_100011215641_100009817552 [0,1,1,0,0,0|2,0,0]=4 2782 B10R0.97 CC(=O)CCOCCC(C)C 34a_100000759926_100000210312 [0,1,1,0,0,0|2,0,0]=4 2783 B10R0.97 CC(=O)CCOCCC(C)C 7a_100000210254_100000053229 [0,1,1,0,0,0|2,0,0]=4 2784 B10R0.97 CC(=O)CCOCCC(C)C 7a_100000759926_100000210626 [0,1,1,0,0,0|2,0,0]=4 2785 B10R0.97 CC(=O)CCOCCC(C)O 34a_100000759926_100012276601 [0,1,1,0,0,0|2,0,0]=4 2786 B10R0.97 CC(=O)CCOCCC(C)O 7a_100000759926_100012276601 [0,1,1,0,0,0|2,0,0]=4 2787 B10R0.97 CC(=O)CCSCCC(C)C 62a_100000053229_100000210312 [0,1,1,0,0,0|2,0,0]=4 2788 B10R0.97 CC(=O)CCSCCC(C)C 62a_100000210312_100000053229 [0,1,1,0,0,0|2,0,0]=4 2789 B10R0.97 CC(=O)CCSCCC(C)O 62a_100000053229_100012276601 [0,1,1,0,0,0|2,0,0]=4 2790 B10R0.97 CC(=O)CCSCCC(C)O 62a_100012276601_100000053229 [0,1,1,0,0,0|2,0,0]=4 2791 B10R0.97 CC(=O)COCCCC(C)C 34a_100000211253_100011214892 [0,1,1,0,0,0|2,0,0]=4 2792 B10R0.97 CC(=O)COCCCC(C)O 34a_100000211253_200000718107 [0,1,1,0,0,0|2,0,0]=4 2793 B10R0.97 CC(Br)CCOCCC(=O)N 34a_100009893172_100000731001 [0,1,1,0,0,0|2,0,0]=4 2794 B10R0.97 CC(Br)COCCCC(=O)N 34a_100012180447_100102525003 [0,1,1,0,0,0|2,0,0]=4 2795 B10R0.97 CC(C)CCCCCC(=O)[13CH3] 1458a_100000766313_200025704644 [0,1,1,0,0,0|1,0,0]=3 2796 B10R0.97 CC(C)CCCNCC(=O)N 2230a_100000711301_100011214892 [0,1,1,0,0,0|2,0,0]=4 2797 B10R0.97 CC(C)CCCNCC(=O)N 2230a_200000737386_100000747473 [0,1,1,0,0,0|2,0,0]=4 2798 B10R0.97 CC(C)CCCNCC(=O)N 34a_200000737386_100000187820 [0,1,1,0,0,0|2,0,0]=4 2799 B10R0.97 CC(C)CCCNCC(=O)O 269956a_100016091260_100011214892 [0,1,1,0,0,0|1,0,0]=3 2800 B10R0.97 CC(C)CCCNCC(=O)[O-] 34a_200000737386_100020667443 [0,1,1,0,0,0|1,0,1]=4 2801 B10R0.97 CC(C)CCCOCC(=O)N 34a_100000210774_100000187820 [0,1,1,0,0,0|2,0,0]=4 2802 B10R0.97 CC(C)CCCOCC(=O)N 7a_100000210774_100000187820 [0,1,1,0,0,0|2,0,0]=4 2803 B10R0.97 CC(C)CCCOCC(=O)[O-] 34a_100000210774_100020667443 [0,1,1,0,0,0|1,0,1]=4 2804 B10R0.97 CC(C)CCCSCC(=O)N 62a_100000747473_100011214892 [0,1,1,0,0,0|2,0,0]=4 2805 B10R0.97 CC(C)CCCSCC(=O)N 62a_100011214892_100000747473 [0,1,1,0,0,0|2,0,0]=4 2806 B10R0.97 CC(C)CCCSCC(=O)[O-] 62a_100011214892_100020667443 [0,1,1,0,0,0|1,0,1]=4 2807 B10R0.97 CC(C)CCCSCC(=O)[O-] 62a_100020667443_100011214892 [0,1,1,0,0,0|1,0,1]=4 2808 B10R0.97 CC(C)CCNCCC(=O)N 269862a_100000740010_100000185833 [0,1,1,0,0,0|2,0,0]=4 2809 B10R0.97 CC(C)CCNOCC(=O)O 269956a_100000106656_100000210312 [0,1,1,0,0,0|2,0,0]=4 2810 B10R0.97 CC(C)CCOCCC(=O)N 34a_100000210254_100000731001 [0,1,1,0,0,0|2,0,0]=4 2811 B10R0.97 CC(C)CCOCCC(=O)N 34a_100000757172_100000210312 [0,1,1,0,0,0|2,0,0]=4 2812 B10R0.97 CC(C)CCOCCC(=O)N 7a_100000210254_100000744528 [0,1,1,0,0,0|2,0,0]=4 2813 B10R0.97 CC(C)CCOCCC(=O)N 7a_100000757172_100000210626 [0,1,1,0,0,0|2,0,0]=4 2814 B10R0.97 CC(C)CCSCCC(=O)N 62a_100000210312_100000744528 [0,1,1,0,0,0|2,0,0]=4 2815 B10R0.97 CC(C)CCSCCC(=O)N 62a_100000744528_100000210312 [0,1,1,0,0,0|2,0,0]=4 2816 B10R0.97 CC(C)CNCCCC(=O)N 34a_100000210953_100102525003 [0,1,1,0,0,0|2,0,0]=4 2817 B10R0.97 CC(C)CNCCCC(=O)N 34a_100000739312_100000210624 [0,1,1,0,0,0|2,0,0]=4 2818 B10R0.97 CC(C)COCCCC(=O)N 34a_100000210257_100102525003 [0,1,1,0,0,0|2,0,0]=4 2819 B10R0.97 CC(C)CSCCCC(=O)N 62a_100000210624_100102525003 [0,1,1,0,0,0|2,0,0]=4 2820 B10R0.97 CC(C)CSCCCC(=O)N 62a_100102525003_100000210760 [0,1,1,0,0,0|2,0,0]=4 2821 B10R0.97 CC(C)NCCCCC(=O)N 34a_100000696515_100000210206 [0,1,1,0,0,0|2,0,0]=4 2822 B10R0.97 CC(C)NCCOCC(=O)O 269956a_100000700818_100000210206 [0,1,1,0,0,0|2,0,0]=4 2823 B10R0.97 CC(C)OCCCCC(=O)N 34a_100012022536_100000210206 [0,1,1,0,0,0|2,0,0]=4 2824 B10R0.97 CC(C)OCCCCC(=O)N 7a_100012022536_100000210206 [0,1,1,0,0,0|2,0,0]=4 2825 B10R0.97 CC(C)OCCNCC(=O)O 269956a_100016091260_100000211751 [0,1,1,0,0,0|2,0,0]=4 2826 B10R0.97 CC(C)SCCNCC(=O)O 269956a_100016091260_100000730970 [0,1,1,0,0,0|2,0,0]=4 2827 B10R0.97 CC(F)COCCCC(=O)N 34a_100015925927_100102525003 [0,1,1,0,0,0|2,0,0]=4 2828 B10R0.97 CC(O)CCCNCC(=O)N 2230a_100000711301_200000718107 [0,1,1,0,0,0|2,0,0]=4 2829 B10R0.97 CC(O)CCCNCC(=O)O 269956a_100016091260_200000718107 [0,1,1,0,0,0|1,0,0]=3 2830 B10R0.97 CC(O)CCCSCC(=O)N 62a_100000747473_200000718107 [0,1,1,0,0,0|2,0,0]=4 2831 B10R0.97 CC(O)CCCSCC(=O)N 62a_200000718107_100000747473 [0,1,1,0,0,0|2,0,0]=4 2832 B10R0.97 CC(O)CCCSCC(=O)[O-] 62a_100020667443_200000718107 [0,1,1,0,0,0|1,0,1]=4 2833 B10R0.97 CC(O)CCCSCC(=O)[O-] 62a_200000718107_100020667443 [0,1,1,0,0,0|1,0,1]=4 2834 B10R0.97 CC(O)CCNCCC(=O)N 2230a_200000755665_100000744528 [0,1,1,0,0,0|2,0,0]=4 2835 B10R0.97 CC(O)CCNOCC(=O)O 269956a_100000106656_100012276601 [0,1,1,0,0,0|2,0,0]=4 2836 B10R0.97 CC(O)CCOCCC(=O)N 34a_100000757172_100012276601 [0,1,1,0,0,0|2,0,0]=4 2837 B10R0.97 CC(O)CCOCCC(=O)N 7a_100000757172_100012276601 [0,1,1,0,0,0|2,0,0]=4 2838 B10R0.97 CC(O)CCSCCC(=O)N 62a_100000744528_100012276601 [0,1,1,0,0,0|2,0,0]=4 2839 B10R0.97 CC(O)CCSCCC(=O)N 62a_100012276601_100000744528 [0,1,1,0,0,0|2,0,0]=4 2840 B10R0.97 CC(O)CNCCCC(=O)N 34a_100000210904_100102525003 [0,1,1,0,0,0|2,0,0]=4 2841 B10R0.97 CC(O)CNCCCC(=O)N 34a_100000739312_100011218427 [0,1,1,0,0,0|2,0,0]=4 2842 B10R0.97 CC(O)CSCCCC(=O)N 62a_100011218427_100102525003 [0,1,1,0,0,0|2,0,0]=4 2843 B10R0.97 CC(O)CSCCCC(=O)N 62a_100102525003_100011218427 [0,1,1,0,0,0|2,0,0]=4 2844 B10R0.97 CN(C)CCCCCC(=O)N 2230a_100102631434_100009817443 [0,1,1,0,0,0|2,0,0]=4 2845 B10R0.97 CN(C)CCCCCC(=O)N 269982a_100102631434_100009817443 [0,1,1,0,0,0|2,0,0]=4 2846 B10R0.97 CN(C)CCCNCC(=O)O 269956a_100016091260_100000757444 [0,1,1,0,0,0|2,0,0]=4 2847 B10R0.97 C[C@@H](Cl)COCCCC(=O)N 34a_100016084084_100102525003 [0,1,1,0,0,0|2,0,0]=4 2848 B10R0.97 C[C@@H](N)CCOCCC(=O)N 34a_100000706166_100000731001 [0,1,1,0,0,0|2,0,0]=4 2849 B10R0.97 C[C@@H](N)COCCCC(=O)N 34a_100000737577_100102525003 [0,1,1,0,0,0|2,0,0]=4 2850 B10R0.97 C[C@@H](O)CNCCCC(=O)N 34a_100000739312_100009817552 [0,1,1,0,0,0|2,0,0]=4 2851 B10R0.97 C[C@@H](O)CSCCCC(=O)N 62a_100009817552_100102525003 [0,1,1,0,0,0|2,0,0]=4 2852 B10R0.97 C[C@@H](O)CSCCCC(=O)N 62a_100102525003_100009817552 [0,1,1,0,0,0|2,0,0]=4 2853 B10R0.18 C=CC(=O)NC(C)CCCC 1626a_100000126638_100000185746 [0,1,1,0,0,0|2,0,0]=4 2854 B10R0.18 C=CC(=O)NC(C)CCCC 240690a_100000126638_200121576911 [0,1,1,0,0,0|2,0,0]=4 2855 B10R0.18 CCCCC(=O)CC(=O)OC 1458a_100000210183_100000747449 [0,1,1,0,0,0|1,0,1]=4 2856 B10R0.18 CCCCC(=O)CC(=O)OC 1458a_100000211351_100000210211 [0,1,1,0,0,0|1,0,1]=4 2857 B10R0.18 CCCCC(C)NC(=O)CC 11a_100000126638_100000210414 [0,1,1,0,0,0|2,0,0]=4 2858 B10R0.18 CCCCC(C)NC(=O)CC 1626a_100000126638_100000210414 [0,1,1,0,0,0|2,0,0]=4 2859 B10R0.18 CCCCC(C)NC(=O)CC 240690a_100000126638_100000210414 [0,1,1,0,0,0|2,0,0]=4 2860 B10R0.18 CCCCC(C)NC(=O)CC 527a_100000126638_100000210414 [0,1,1,0,0,0|2,0,0]=4 2861 B10R0.18 CCCCC(C)NC(=O)CO 240690a_100000126638_100000210174 [0,1,1,0,0,0|1,0,0]=3 2862 B10R0.18 CCCCC(C)NC(=O)CO 527a_100000126638_100000210174 [0,1,1,0,0,0|1,0,0]=3 2863 B10R0.18 CCCCC(C)NC(=O)NC 2708a_100000126638_106832991635 [0,1,1,0,0,0|2,0,0]=4 2864 B10R0.18 CCCCC(C)NC(=O)NC 2708a_100102657272_100000126638 [0,1,1,0,0,0|2,0,0]=4 2865 B10R0.18 CCCCC(C)NC(=O)NC 273464a_100000126638_100102657272 [0,1,1,0,0,0|2,0,0]=4 2866 B10R0.18 CCCCC(C)NC(=O)NC 273464a_100102657272_100000126638 [0,1,1,0,0,0|2,0,0]=4 2867 B10R0.18 CCCCC(C)NC(=O)NC 512a_100000126638_100102657272 [0,1,1,0,0,0|2,0,0]=4 2868 B10R0.18 CCCCC(C)NC(=O)NC 512a_106832991638_100000126638 [0,1,1,0,0,0|2,0,0]=4 2869 B10R0.18 CCCCN(C)CC(=O)CC 269982a_100000207549_100000747405 [0,1,1,0,0,0|2,0,0]=4 2870 B10R0.18 CCCCN(C)CC(=O)NC 2230a_100000189611_100000210211 [0,1,1,0,0,0|2,0,0]=4 2871 B10R0.18 CCCCN(C)CC(=O)NC 2230a_100000207549_100000183359 [0,1,1,0,0,0|2,0,0]=4 2872 B10R0.18 CCCCN(C)CC(=O)NC 269982a_100000207549_100000183359 [0,1,1,0,0,0|2,0,0]=4 2873 B10R0.18 CCCCN(C)CC(=O)OC 2230a_100000198492_100000210211 [0,1,1,0,0,0|1,0,0]=3 2874 B10R0.18 CCCCN(C)CC(=O)OC 2230a_100000207549_100000747449 [0,1,1,0,0,0|1,0,0]=3 2875 B10R0.18 CCCCN(C)CC(=O)OC 269982a_100000207549_100000747449 [0,1,1,0,0,0|1,0,0]=3 2876 B10R0.18 CCCOC(C)CC(=O)OC 34a_100000210258_100009817358 [0,1,1,0,0,0|1,0,0]=3 2877 B10R0.18 CCCSC(C)CC(=O)OC 62a_100000210303_100009817358 [0,1,1,0,0,0|1,0,0]=3 2878 B10R0.18 CCCSC(C)CC(=O)OC 62a_100009817358_100000210303 [0,1,1,0,0,0|1,0,0]=3 2879 B10R0.18 CCOC[C@H](O)CC(=O)OC 34a_100121572206_100000754131 [0,1,1,0,0,0|2,0,0]=4 2880 B10R0.18 CCSC[C@H](O)CC(=O)OC 62a_100000210202_100000754131 [0,1,1,0,0,0|2,0,0]=4 2881 B10R0.18 CCSC[C@H](O)CC(=O)OC 62a_100000754131_100000210202 [0,1,1,0,0,0|2,0,0]=4 2882 B10R0.18 COC(=O)CC(C)NCCF 34a_100000724931_100009817358 [0,1,1,0,0,0|2,0,0]=4 2883 B10R0.18 COC(=O)CC(C)NCCO 2230a_100016997473_100009817358 [0,1,1,0,0,0|2,0,0]=4 2884 B10R0.18 COC(=O)CC(C)NCCO 34a_100016990907_100009817358 [0,1,1,0,0,0|2,0,0]=4 2885 B10R0.18 COC(=O)CC(C)OCCBr 34a_100000211926_100009817358 [0,1,1,0,0,0|2,0,0]=4 2886 B10R0.18 COC(=O)CC(C)OCCN 34a_100000210304_100009817358 [0,1,1,0,0,0|2,0,0]=4 2887 B10R0.18 COC(=O)CC(C)SCCF 62a_100009817358_100011217306 [0,1,1,0,0,0|2,0,0]=4 2888 B10R0.18 COC(=O)CC(C)SCCF 62a_100011217306_100009817358 [0,1,1,0,0,0|2,0,0]=4 2889 B10R0.18 COC(=O)CC(C)SCCO 62a_100000211926_100009817358 [0,1,1,0,0,0|2,0,0]=4 2890 B10R0.18 COC(=O)CC(C)SCCO 62a_100009817358_100000211926 [0,1,1,0,0,0|2,0,0]=4 2891 B10R0.18 COC(=O)CC(C)SCSC 62a_100009817358_100011218213 [0,1,1,0,0,0|2,0,0]=4 2892 B10R0.18 COC(=O)CC(C)SCSC 62a_100011218213_100009817358 [0,1,1,0,0,0|2,0,0]=4 2893 B10R0.18 COC(=O)CN(C)CCCF 2230a_100000198492_100011934791 [0,1,1,0,0,0|2,0,0]=4 2894 B10R0.18 COC(=O)CN(C)CCCO 2230a_100000198492_100000230001 [0,1,1,0,0,0|2,0,0]=4 2895 B10R0.18 COC(=O)CN(C)CCCO 2230a_100000213112_100000747449 [0,1,1,0,0,0|2,0,0]=4 2896 B10R0.18 COC(=O)CN(C)CCCO 269982a_100000213112_100000747449 [0,1,1,0,0,0|2,0,0]=4 2897 B10R0.18 COC(=O)CN(C)CCSC 2230a_100000198492_100000751147 [0,1,1,0,0,0|2,0,0]=4 2898 B10R0.18 COC(=O)CN(C)CCSC 2230a_100000686725_100000747449 [0,1,1,0,0,0|2,0,0]=4 2899 B10R0.18 COC(=O)CN(C)CCSC 269982a_100000686725_100000747449 [0,1,1,0,0,0|2,0,0]=4 2900 B10R0.18 COCCN(C)CC(=O)OC 2230a_100000198492_100011201679 [0,1,1,0,0,0|2,0,0]=4 2901 B10R0.18 COCCN(C)CC(=O)OC 2230a_100000743101_100000747449 [0,1,1,0,0,0|2,0,0]=4 2902 B10R0.18 COCCN(C)CC(=O)OC 269982a_100000743101_100000747449 [0,1,1,0,0,0|2,0,0]=4 2903 B10R0.18 COCSC(C)CC(=O)OC 62a_100000766300_100009817358 [0,1,1,0,0,0|2,0,0]=4 2904 B10R0.18 COCSC(C)CC(=O)OC 62a_100009817358_100000766300 [0,1,1,0,0,0|2,0,0]=4 2905 B10R0.32 CC(CCO)N(C)CC(=O)O 269956a_100000746989_100009893172 [0,1,1,0,0,0|2,0,0]=4 2906 B10R0.32 CCCC(C)N(C)CC(=O)N 2230a_100000739694_100000766640 [0,1,1,0,0,0|2,0,0]=4 2907 B10R0.32 CCCC(C)N(C)CC(=O)N 270004a_100000739694_100000211909 [0,1,1,0,0,0|2,0,0]=4 2908 B10R0.32 CCCC(C)N(C)CC(=O)O 269956a_100000746989_100000766640 [0,1,1,0,0,0|1,0,0]=3 2909 B10R0.32 COCC(C)N(C)CC(=O)O 269956a_100000746989_100000765312 [0,1,1,0,0,0|2,0,0]=4 2910 B10R0.44 CCC(=O)CN(C)CC(=O)O 269956a_100000746989_100000747405 [0,1,1,0,0,0|1,0,1]=4 2911 B10R0.44 CCC(C)CC(C)NC(=O)C 11a_100000763565_100015343762 [0,1,1,0,0,0|2,0,0]=4 2912 B10R0.44 CCC(C)CC(C)NC(=O)C 1626a_100000763565_100015343762 [0,1,1,0,0,0|2,0,0]=4 2913 B10R0.44 CCC(C)CC(C)NC(=O)C 240690a_100000763565_100015343762 [0,1,1,0,0,0|2,0,0]=4 2914 B10R0.44 CCC(C)CC(C)NC(=O)C 527a_100000763565_100103153847 [0,1,1,0,0,0|2,0,0]=4 2915 B10R0.44 CCC(C)CN(C)CC(=O)N 2230a_100000739694_100000748023 [0,1,1,0,0,0|2,0,0]=4 2916 B10R0.44 CCC(C)CN(C)CC(=O)N 2230a_100000753921_100000747473 [0,1,1,0,0,0|2,0,0]=4 2917 B10R0.44 CCC(C)CN(C)CC(=O)N 269982a_100000753921_100000187820 [0,1,1,0,0,0|2,0,0]=4 2918 B10R0.44 CCC(C)CN(C)CC(=O)N 270004a_100000739694_100000243153 [0,1,1,0,0,0|2,0,0]=4 2919 B10R0.44 CCC(C)CN(C)CC(=O)O 269956a_100000746989_100000748023 [0,1,1,0,0,0|1,0,0]=3 2920 B10R0.44 CCC(C)CN(C)CC(=O)[O-] 269982a_100000753921_100020667443 [0,1,1,0,0,0|1,0,1]=4 2921 B10R0.44 CCC(O)CN(C)CC(=O)N 2230a_100000739694_100011218378 [0,1,1,0,0,0|2,0,0]=4 2922 B10R0.44 CCC(O)CN(C)CC(=O)O 269956a_100000746989_100011218378 [0,1,1,0,0,0|1,0,0]=3 2923 B10R0.44 CC[C@H](C)CN(C)CC(=O)N 2230a_100000739694_100009816398 [0,1,1,0,0,0|2,0,0]=4 2924 B10R0.44 CC[C@H](C)CN(C)CC(=O)O 269956a_100000746989_100009816398 [0,1,1,0,0,0|1,0,0]=3 2925 B10R0.44 CN(CC(=O)O)CC(O)CO 269956a_100000746989_100011219619 [0,1,1,0,0,0|2,0,0]=4 2926 B10R0.44 CN(CC(=O)O)C[C@@H](O)CF 269956a_100000746989_100015614560 [0,1,1,0,0,0|2,0,0]=4 2927 B10R0.44 CN(CC(=O)O)C[C@@H](O)CO 269956a_100000746989_100009815848 [0,1,1,0,0,0|2,0,0]=4 2928 B10R0.44 C[C@@H](CO)CN(C)CC(=O)O 269956a_100000746989_100000059175 [0,1,1,0,0,0|2,0,0]=4 2929 B10R0.81 CC(C(=O)O)N(C)CCCF 269956a_100000749554_100011934791 [0,1,1,0,0,0|2,0,0]=4 2930 B10R0.81 CC(C(=O)O)N(C)CCCO 269956a_100000749554_100011215043 [0,1,1,0,0,0|2,0,0]=4 2931 B10R0.81 CCCCN(C)C(C)C(=O)C 2230a_100000207549_100009814033 [0,1,1,0,0,0|2,0,0]=4 2932 B10R0.81 CCCCN(C)C(C)C(=O)C 269982a_100000207549_100009814033 [0,1,1,0,0,0|2,0,0]=4 2933 B10R0.81 CCCCN(C)C(C)C(=O)N 2230a_100000207549_100000702099 [0,1,1,0,0,0|2,0,0]=4 2934 B10R0.81 CCCCN(C)C(C)C(=O)N 269982a_100000207549_100000184083 [0,1,1,0,0,0|2,0,0]=4 2935 B10R0.81 CCCCN(C)C(C)C(=O)O 269956a_100000749554_100000210211 [0,1,1,0,0,0|1,0,0]=3 2936 B10R0.81 CCCCN(C)C(F)C(=O)N 2230a_100000207549_100009813875 [0,1,1,0,0,0|2,0,0]=4 2937 B10R0.81 CCCCN(C)C(F)C(=O)N 269982a_100000207549_100009813875 [0,1,1,0,0,0|2,0,0]=4 2938 B10R0.81 CCCO[C@H](C)[C@H](N)C(=O)N 34a_100000003557_100000210303 [0,1,1,0,0,0|2,0,0]=4 2939 B10R0.81 CCOCN(C)C(C)C(=O)O 269956a_100000749554_100000739092 [0,1,1,0,0,0|2,0,0]=4 2940 B10R0.81 COCCN(C)C(C)C(=O)O 269956a_100000749554_100000233755 [0,1,1,0,0,0|2,0,0]=4 2941 B10R0.81 CSCCN(C)C(C)C(=O)O 269956a_100000749554_100000212216 [0,1,1,0,0,0|2,0,0]=4 2942 B10R0.87 CCCCC(CC)CC(=O)C 1458a_100000070787_100000211942 [0,1,1,0,0,0|1,0,0]=3 2943 B10R0.87 CCCCN(CC)CC(=O)N 2230a_100000207695_100000747473 [0,1,1,0,0,0|2,0,0]=4 2944 B10R0.87 CCCCN(CC)CC(=O)N 269982a_100000207695_100000187820 [0,1,1,0,0,0|2,0,0]=4 2945 B10R0.87 CCCCN(CC)CC(=O)O 269956a_100000746405_100000210211 [0,1,1,0,0,0|1,0,0]=3 2946 B10R0.87 CCCCN(CC)CC(=O)[O-] 269982a_100000207695_100020667443 [0,1,1,0,0,0|1,0,1]=4 2947 B10R0.87 CCCCN(CO)CC(=O)[O-] 269956a_100016989150_100000210211 [0,1,1,0,0,0|1,0,1]=4 2948 B10R0.87 CCCC[C@@H](CO)NC(=O)C 240690a_100011934283_100015343762 [0,1,1,0,0,0|2,0,0]=4 2949 B10R0.87 CCCC[C@@H](CO)NC(=O)C 527a_100011934283_100103153847 [0,1,1,0,0,0|2,0,0]=4 2950 B10R0.87 CCCN[C@H](CC)CC(=O)O 269956a_100016995926_100000210207 [0,1,1,0,0,0|1,0,0]=3 2951 B10R0.87 CCCN[C@H](CO)CC(=O)O 269956a_100009816507_100000210207 [0,1,1,0,0,0|1,0,0]=3 2952 B10R0.87 CCN(CCCF)CC(=O)O 269956a_100000746405_100011934791 [0,1,1,0,0,0|2,0,0]=4 2953 B10R0.87 CCN(CCCO)CC(=O)O 269956a_100000746405_100011215043 [0,1,1,0,0,0|2,0,0]=4 2954 B10R0.87 CCN(CCOC)CC(=O)O 269956a_100000746405_100000233755 [0,1,1,0,0,0|2,0,0]=4 2955 B10R0.87 CCN(CCSC)CC(=O)O 269956a_100000746405_100000212216 [0,1,1,0,0,0|2,0,0]=4 2956 B10R0.87 CCOCN(CC)CC(=O)O 269956a_100000746405_100000739092 [0,1,1,0,0,0|2,0,0]=4 2957 B10R0.87 CC[C@H](CC(=O)O)NCCF 269956a_100016995926_100011217306 [0,1,1,0,0,0|2,0,0]=4 2958 B10R0.87 CC[C@H](CC(=O)O)NCCO 269956a_100016995926_100000211926 [0,1,1,0,0,0|2,0,0]=4 2959 B10R0.87 CC[C@H](CC(=O)O)NCOC 269956a_100016995926_100000766300 [0,1,1,0,0,0|2,0,0]=4 2960 B10R0.87 CC[C@H](CC(=O)O)NCSC 269956a_100016995926_100011218213 [0,1,1,0,0,0|2,0,0]=4 2961 B10R0.87 COCN[C@H](CO)CC(=O)O 269956a_100009816507_100000766300 [0,1,1,0,0,0|2,0,0]=4 2962 B10R0.87 CSCN[C@H](CO)CC(=O)O 269956a_100009816507_100011218213 [0,1,1,0,0,0|2,0,0]=4 2963 B10R0.87 O=C(O)C[C@@H](CO)NCCF 269956a_100009816507_100011217306 [0,1,1,0,0,0|2,0,0]=4 2964 B10R0.87 O=C(O)C[C@@H](CO)NCCO 269956a_100009816507_100000211926 [0,1,1,0,0,0|2,0,0]=4 2965 B10R0.96 C=C(C)CCN(C)CC(=O)O 269956a_100000746989_100000730704 [0,1,1,0,0,0|1,0,1]=4 2966 B10R0.96 CC(=O)CCN(C)CC(=O)O 269956a_100000746989_100000053229 [0,1,1,0,0,0|1,0,1]=4 2967 B10R0.96 CC(=O)NC(C)CCC(C)C 11a_100138410893_100015343762 [0,1,1,0,0,0|2,0,0]=4 2968 B10R0.96 CC(=O)NC(C)CCC(C)C 1626a_100138410893_100015343762 [0,1,1,0,0,0|2,0,0]=4 2969 B10R0.96 CC(=O)NC(C)CCC(C)C 240690a_100138410893_100015343762 [0,1,1,0,0,0|2,0,0]=4 2970 B10R0.96 CC(=O)NC(C)CCC(C)C 527a_100138410893_100103153847 [0,1,1,0,0,0|2,0,0]=4 2971 B10R0.96 CC(C)CCN(C)CC(=O)N 2230a_100000739694_100000210312 [0,1,1,0,0,0|2,0,0]=4 2972 B10R0.96 CC(C)CCN(C)CC(=O)N 2230a_100000742789_100000747473 [0,1,1,0,0,0|2,0,0]=4 2973 B10R0.96 CC(C)CCN(C)CC(=O)N 269982a_100000742789_100000187820 [0,1,1,0,0,0|2,0,0]=4 2974 B10R0.96 CC(C)CCN(C)CC(=O)O 269956a_100000746989_100000210312 [0,1,1,0,0,0|1,0,0]=3 2975 B10R0.96 CC(C)CCN(C)CC(=O)[O-] 269982a_100000742789_100020667443 [0,1,1,0,0,0|1,0,1]=4 2976 B10R0.96 CC(C)NCC(O)CC(=O)O 269956a_100011218706_100000210206 [0,1,1,0,0,0|2,0,0]=4 2977 B10R0.96 CC(C)OCN(C)CC(=O)O 269956a_100000746989_100000709892 [0,1,1,0,0,0|2,0,0]=4 2978 B10R0.96 CC(O)CCN(C)CC(=O)N 2230a_100000739694_100012276601 [0,1,1,0,0,0|2,0,0]=4 2979 B10R0.96 CC(O)CCN(C)CC(=O)O 269956a_100000746989_100012276601 [0,1,1,0,0,0|1,0,0]=3 2980 B10R0.96 CN(C)CCN(C)CC(=O)O 269956a_100000746989_100000755713 [0,1,1,0,0,0|2,0,0]=4 2981 B10R0.122 CC(C)(CC(=O)O)NCCF 269956a_100000755897_100011217306 [0,1,1,0,0,0|2,0,0]=4 2982 B10R0.122 CC(C)(CC(=O)O)NCCO 269956a_100000755897_100000211926 [0,1,1,0,0,0|2,0,0]=4 2983 B10R0.122 CCCC[Si](C)(C)CC(=O)C 1458a_100000070787_200000073895 [0,1,1,0,0,0|1,1,0]=4 2984 B10R0.122 CCCNC(C)(C)CC(=O)N 2230a_100000763158_100000210303 [0,1,1,0,0,0|2,0,0]=4 2985 B10R0.122 CCCNC(C)(C)CC(=O)O 269956a_100000755897_100000210207 [0,1,1,0,0,0|1,0,0]=3 2986 B10R0.122 CCCOC(C)(C)CC(=O)C 7a_100000210262_100000210303 [0,1,1,0,0,0|2,0,0]=4 2987 B10R0.122 COCNC(C)(C)CC(=O)O 269956a_100000755897_100000766300 [0,1,1,0,0,0|2,0,0]=4 2988 B10R0.122 CSCNC(C)(C)CC(=O)O 269956a_100000755897_100011218213 [0,1,1,0,0,0|2,0,0]=4 2989 B10R0.23 CC(C)C(CC(=O)O)NCF 269956a_100000695669_100015361967 [0,1,1,0,0,0|2,0,0]=4 2990 B10R0.23 CC(C)N(CCO)CC(=O)O 269956a_100000747938_100000210206 [0,1,1,0,0,0|2,0,0]=4 2991 B10R0.23 CCCN(CC(=O)N)C(C)C 2230a_106256033942_100000747473 [0,1,1,0,0,0|2,0,0]=4 2992 B10R0.23 CCCN(CC(=O)N)C(C)C 269982a_106256033942_100000187820 [0,1,1,0,0,0|2,0,0]=4 2993 B10R0.23 CCCN(CC(=O)[O-])C(C)C 269982a_106256033942_100020667443 [0,1,1,0,0,0|1,0,1]=4 2994 B10R0.23 CCNC(CC(=O)O)C(C)C 269956a_100000695669_100000210202 [0,1,1,0,0,0|1,0,0]=3 2995 B10R0.25 CCCN(CC)C(C)C(=O)C 2230a_100000226822_100009814033 [0,1,1,0,0,0|2,0,0]=4 2996 B10R0.25 CCCN(CC)C(C)C(=O)C 269982a_100000226822_100009814033 [0,1,1,0,0,0|2,0,0]=4 2997 B10R0.25 CCCN(CC)C(C)C(=O)N 2230a_100000226822_100000702099 [0,1,1,0,0,0|2,0,0]=4 2998 B10R0.25 CCCN(CC)C(C)C(=O)N 2230a_100020603310_100000210303 [0,1,1,0,0,0|2,0,0]=4 2999 B10R0.25 CCCN(CC)C(C)C(=O)N 269982a_100000226822_100000184083 [0,1,1,0,0,0|2,0,0]=4 3000 B10R0.25 CCCN(CC)C(C)C(=O)N 269982a_100020603310_100000210303 [0,1,1,0,0,0|2,0,0]=4 3001 B10R0.25 CCCN(CC)C(F)C(=O)N 2230a_100000226822_100009813875 [0,1,1,0,0,0|2,0,0]=4 3002 B10R0.25 CCCN(CC)C(F)C(=O)N 269982a_100000226822_100009813875 [0,1,1,0,0,0|2,0,0]=4 3003 B10R0.25 CCC[C@@H](NC)C(O)C(=O)N 2230a_200132311066_200000210301 [0,1,1,0,0,0|2,0,0]=4 3004 B10R0.25 CCC[C@@H](N[13CH3])C(O)C(=O)N 2230a_200132311066_200025704644 [0,1,1,0,0,0|2,0,0]=4 3005 B10R0.25 CCN(CCO)C(C)C(=O)O 269956a_100011300695_100000210202 [0,1,1,0,0,0|2,0,0]=4 3006 B10R0.29 C=CC(=O)NC(CC)CCC 1626a_100000747048_100000185746 [0,1,1,0,0,0|2,0,0]=4 3007 B10R0.29 C=CC(=O)NC(CC)CCC 240690a_100000747048_200121576911 [0,1,1,0,0,0|2,0,0]=4 3008 B10R0.29 CCC(COC)NC(=O)CO 240690a_100000757820_100000210174 [0,1,1,0,0,0|2,0,0]=4 3009 B10R0.29 CCC(COC)NC(=O)CO 527a_100000757820_100000210174 [0,1,1,0,0,0|2,0,0]=4 3010 B10R0.29 CCCC(CC(=O)OC)OC 7a_100000065524_200000210301 [0,1,1,0,0,0|1,0,0]=3 3011 B10R0.29 CCCC(CC(=O)OC)O[13CH3] 7a_100000065524_200025704644 [0,1,1,0,0,0|1,0,0]=3 3012 B10R0.29 CCCC(CC)NC(=O)CC 11a_100000747048_100000210414 [0,1,1,0,0,0|2,0,0]=4 3013 B10R0.29 CCCC(CC)NC(=O)CC 1626a_100000747048_100000210414 [0,1,1,0,0,0|2,0,0]=4 3014 B10R0.29 CCCC(CC)NC(=O)CC 240690a_100000747048_100000210414 [0,1,1,0,0,0|2,0,0]=4 3015 B10R0.29 CCCC(CC)NC(=O)CC 527a_100000747048_100000210414 [0,1,1,0,0,0|2,0,0]=4 3016 B10R0.29 CCCC(CC)NC(=O)CO 240690a_100000747048_100000210174 [0,1,1,0,0,0|1,0,0]=3 3017 B10R0.29 CCCC(CC)NC(=O)CO 527a_100000747048_100000210174 [0,1,1,0,0,0|1,0,0]=3 3018 B10R0.29 CCCC(CC)NC(=O)NC 2708a_100000747048_106832991635 [0,1,1,0,0,0|2,0,0]=4 3019 B10R0.29 CCCC(CC)NC(=O)NC 2708a_100102657272_100000747048 [0,1,1,0,0,0|2,0,0]=4 3020 B10R0.29 CCCC(CC)NC(=O)NC 273464a_100000747048_100102657272 [0,1,1,0,0,0|2,0,0]=4 3021 B10R0.29 CCCC(CC)NC(=O)NC 273464a_100102657272_100000747048 [0,1,1,0,0,0|2,0,0]=4 3022 B10R0.29 CCCC(CC)NC(=O)NC 512a_100000747048_100102657272 [0,1,1,0,0,0|2,0,0]=4 3023 B10R0.29 CCCC(CC)NC(=O)NC 512a_106832991638_100000747048 [0,1,1,0,0,0|2,0,0]=4 3024 B10R0.29 CCCN(CC)CC(=O)CC 269982a_100000226822_100000747405 [0,1,1,0,0,0|2,0,0]=4 3025 B10R0.29 CCCN(CC)CC(=O)NC 2230a_100000226822_100000183359 [0,1,1,0,0,0|2,0,0]=4 3026 B10R0.29 CCCN(CC)CC(=O)NC 269982a_100000226822_100000183359 [0,1,1,0,0,0|2,0,0]=4 3027 B10R0.29 CCCN(CC)CC(=O)OC 2230a_100000226822_100000747449 [0,1,1,0,0,0|1,0,0]=3 3028 B10R0.29 CCCN(CC)CC(=O)OC 269982a_100000226822_100000747449 [0,1,1,0,0,0|1,0,0]=3 3029 B10R0.29 CCC[C@@H](CO)NC(=O)CO 240690a_100000732646_100000210174 [0,1,1,0,0,0|2,0,0]=4 3030 B10R0.29 CCC[C@@H](CO)NC(=O)CO 527a_100000732646_100000210174 [0,1,1,0,0,0|2,0,0]=4 3031 B10R0.29 CCN(CCO)CC(=O)OC 2230a_100000210973_100000747449 [0,1,1,0,0,0|2,0,0]=4 3032 B10R0.29 CCN(CCO)CC(=O)OC 269982a_100000210973_100000747449 [0,1,1,0,0,0|2,0,0]=4 3033 B10R0.29 CCO[C@@H](CC)CC(=O)OC 7a_200015357724_100000210202 [0,1,1,0,0,0|1,0,0]=3 3034 B10R0.29 CCO[C@@H](CCl)CC(=O)OC 7a_100000754131_100000210202 [0,1,1,0,0,0|2,0,0]=4 3035 B10R0.29 CC[C@@H](CC(=O)OC)OCF 7a_200015357724_100015361967 [0,1,1,0,0,0|2,0,0]=4 3036 B10R0.54 CCC(C)N(CC)CC(=O)N 2230a_100000732650_100000747473 [0,1,1,0,0,0|2,0,0]=4 3037 B10R0.54 CCC(C)N(CC)CC(=O)N 269982a_100000732650_100000187820 [0,1,1,0,0,0|2,0,0]=4 3038 B10R0.54 CCC(C)N(CC)CC(=O)O 269956a_100000746405_100000758301 [0,1,1,0,0,0|1,0,0]=3 3039 B10R0.54 CCC(C)N(CC)CC(=O)[O-] 269982a_100000732650_100020667443 [0,1,1,0,0,0|1,0,1]=4 3040 B10R0.54 CCN(CC(=O)O)C(C)OC 269956a_100000746405_100009879195 [0,1,1,0,0,0|2,0,0]=4 3041 B10R0.54 CCN(CC(=O)O)[C@H](C)CO 269956a_100000746405_100016084084 [0,1,1,0,0,0|2,0,0]=4 3042 B10R0.54 CC[C@H](C)[C@@H](CC(=O)O)NC 269956a_100020625877_200000210301 [0,1,1,0,0,0|1,0,0]=3 3043 B10R0.54 CC[C@H](C)[C@@H](CC(=O)O)N[13CH3] 269956a_100020625877_200025704644 [0,1,1,0,0,0|1,0,0]=3 3044 B10R0.70 C=C(C)CN(CC)CC(=O)O 269956a_100000746405_100000748629 [0,1,1,0,0,0|1,0,1]=4 3045 B10R0.70 CC(C)N[C@H](CO)CC(=O)O 269956a_100009816507_100000210206 [0,1,1,0,0,0|2,0,0]=4 3046 B10R0.70 CCN(CC(=O)N)CC(C)C 2230a_100000738554_100000747473 [0,1,1,0,0,0|2,0,0]=4 3047 B10R0.70 CCN(CC(=O)N)CC(C)C 269982a_100000738554_100000187820 [0,1,1,0,0,0|2,0,0]=4 3048 B10R0.70 CCN(CC(=O)N)C[C@H](C)O 2230a_100000729506_100000747473 [0,1,1,0,0,0|2,0,0]=4 3049 B10R0.70 CCN(CC(=O)N)C[C@H](C)O 269982a_100000729506_100000187820 [0,1,1,0,0,0|2,0,0]=4 3050 B10R0.70 CCN(CC(=O)O)CC(C)C 269956a_100000746405_100000210760 [0,1,1,0,0,0|1,0,0]=3 3051 B10R0.70 CCN(CC(=O)O)CC(C)O 269956a_100000746405_100011218427 [0,1,1,0,0,0|1,0,0]=3 3052 B10R0.70 CCN(CC(=O)O)CC(F)F 269956a_100000746405_100011934356 [0,1,1,0,0,0|2,0,0]=4 3053 B10R0.70 CCN(CC(=O)O)C[C@@H](C)O 269956a_100000746405_100009817552 [0,1,1,0,0,0|1,0,0]=3 3054 B10R0.70 CCN(CC(=O)[O-])CC(C)C 269982a_100000738554_100020667443 [0,1,1,0,0,0|1,0,1]=4 3055 B10R0.70 CCN(CC(=O)[O-])C[C@H](C)O 269982a_100000729506_100020667443 [0,1,1,0,0,0|1,0,1]=4 3056 B10R0.70 CC[C@H](CC(=O)O)NC(C)C 269956a_100016995926_100000210206 [0,1,1,0,0,0|1,0,0]=3 3057 B10R0.79 C#CCN(CCC)CC(=O)O 269956a_100011236498_100000210207 [0,1,1,0,0,0|1,0,1]=4 3058 B10R0.79 C=CCN(CCC)CC(=O)O 269956a_100000744315_100000210207 [0,1,1,0,0,0|1,0,1]=4 3059 B10R0.79 CCCC(CCC)NC(=O)C 11a_100011207992_100015343762 [0,1,1,0,0,0|2,0,0]=4 3060 B10R0.79 CCCC(CCC)NC(=O)C 1626a_100011207992_100015343762 [0,1,1,0,0,0|2,0,0]=4 3061 B10R0.79 CCCC(CCC)NC(=O)C 240690a_100011207992_100015343762 [0,1,1,0,0,0|2,0,0]=4 3062 B10R0.79 CCCC(CCC)NC(=O)C 527a_100011207992_100103153847 [0,1,1,0,0,0|2,0,0]=4 3063 B10R0.79 CCCN(CCC)CC(=O)C 1458a_200011243382_200000210301 [0,1,1,0,0,0|2,0,0]=4 3064 B10R0.79 CCCN(CCC)CC(=O)N 2230a_100000210455_100000747473 [0,1,1,0,0,0|2,0,0]=4 3065 B10R0.79 CCCN(CCC)CC(=O)N 269982a_100000210455_100000187820 [0,1,1,0,0,0|2,0,0]=4 3066 B10R0.79 CCCN(CCC)CC(=O)[13CH3] 1458a_200011243382_200025704644 [0,1,1,0,0,0|2,0,0]=4 3067 B10R0.79 CCCN(CCC)CC(=O)[O-] 269982a_100000210455_100020667443 [0,1,1,0,0,0|1,0,1]=4 3068 B10R0.79 CCCN(CCO)CC(=O)N 2230a_100000211420_100000747473 [0,1,1,0,0,0|2,0,0]=4 3069 B10R0.79 CCCN(CCO)CC(=O)N 269982a_100000211420_100000187820 [0,1,1,0,0,0|2,0,0]=4 3070 B10R0.79 CCCN(CCO)CC(=O)O 269956a_100000747938_100000210207 [0,1,1,0,0,0|1,0,0]=3 3071 B10R0.79 CCCN(CCO)CC(=O)[O-] 269982a_100000211420_100020667443 [0,1,1,0,0,0|1,0,1]=4 3072 B10R0.79 CCC[C@@H](CCO)NC(=O)C 240690a_100015193777_100015343762 [0,1,1,0,0,0|2,0,0]=4 3073 B10R0.79 CCC[C@@H](CCO)NC(=O)C 527a_100015193777_100103153847 [0,1,1,0,0,0|2,0,0]=4 3074 B10R0.79 CCOC(CC(=O)C)OCC 1458a_100000070787_100000210512 [0,1,1,0,0,0|2,0,0]=4 3075 B10R0.79 CCOC(CC(=O)C)OCC 1458a_100000082722_200000210301 [0,1,1,0,0,0|2,0,0]=4 3076 B10R0.79 CCOC(CC(=O)[13CH3])OCC 1458a_100000082722_200025704644 [0,1,1,0,0,0|2,0,0]=4 3077 B10R0.79 COCN(CCO)CC(=O)O 269956a_100000747938_100000766300 [0,1,1,0,0,0|2,0,0]=4 3078 B10R0.79 CSCN(CCO)CC(=O)O 269956a_100000747938_100011218213 [0,1,1,0,0,0|2,0,0]=4 3079 B10R0.79 O=C(O)CN(CCO)CCF 269956a_100000747938_100011217306 [0,1,1,0,0,0|2,0,0]=4 3080 B10R0.79 O=C(O)CN(CCO)CCO 269956a_100000747938_100000211926 [0,1,1,0,0,0|2,0,0]=4 3081 B10R1.1 C=C1CCN(CC1)CC=O 2230a_100000752442_200015260668 [1,1,0,0,0,0|1,0,1]=4 3082 B10R1.1 C=C1CCN(CC1)CC=O 269982a_100000752442_200015260668 [1,1,0,0,0,0|1,0,1]=4 3083 B10R1.1 C=C1CCN(CC1)CC=O 34a_100000752442_200009817547 [1,1,0,0,0,0|1,0,1]=4 3084 B10R1.1 C=CCN1CCC(CC1)C 2230a_100000188429_100000210623 [1,1,0,0,0,0|2,0,0]=4 3085 B10R1.1 C=CCN1CCC(CC1)C 269982a_100000188429_100000210623 [1,1,0,0,0,0|2,0,0]=4 3086 B10R1.1 C=CCN1CCC(CC1)C 34a_100000188429_100015514636 [1,1,0,0,0,0|2,0,0]=4 3087 B10R1.1 C=CCN1CCC(CC1)F 2230a_100015193889_100000210623 [1,1,0,0,0,0|2,0,0]=4 3088 B10R1.1 C=CCN1CCC(CC1)F 269982a_100015193889_100000210623 [1,1,0,0,0,0|2,0,0]=4 3089 B10R1.1 C=CCN1CCC(CC1)F 34a_100015193889_100015514636 [1,1,0,0,0,0|2,0,0]=4 3090 B10R1.1 C=CCN1CCC(CC1)O 2230a_100025773856_100000210623 [1,1,0,0,0,0|2,0,0]=4 3091 B10R1.1 C=CCN1CCC(CC1)O 269982a_100025773856_100000210623 [1,1,0,0,0,0|2,0,0]=4 3092 B10R1.1 CC1CCC(CC1)CN[13CH3] 2230a_103436935547_200025704644 [1,1,0,0,0,0|2,0,0]=4 3093 B10R1.1 CC1CCC(CC1)CN[13CH3] 34a_103436935547_200025704644 [1,1,0,0,0,0|2,0,0]=4 3094 B10R1.1 CC1CCC(CC1)CO[13CH3] 34a_100000701341_200025704644 [1,1,0,0,0,0|2,0,0]=4 3095 B10R1.1 CC1CCN(CC1)CC=O 2230a_100000188429_200015260668 [1,1,0,0,0,0|1,0,0]=3 3096 B10R1.1 CC1CCN(CC1)CC=O 269982a_100000188429_200015260668 [1,1,0,0,0,0|1,0,0]=3 3097 B10R1.1 CC1CCN(CC1)CC=O 34a_100000188429_200009817547 [1,1,0,0,0,0|1,0,0]=3 3098 B10R1.1 CC1CCN(CC1)CCO 2230a_100000188429_100000211926 [1,1,0,0,0,0|1,0,1]=4 3099 B10R1.1 CC1CCN(CC1)CCO 269982a_100000188429_100000211926 [1,1,0,0,0,0|1,0,1]=4 3100 B10R1.1 CC1CCN(CC1)CCO 34a_100000188429_100000211926 [1,1,0,0,0,0|1,0,1]=4 3101 B10R1.1 CN1CCC(CC1)CCO 2230a_100015190746_200000210301 [1,1,0,0,0,0|1,0,1]=4 3102 B10R1.1 CN1CCC(CC1)CCO 269982a_100015190746_200000210301 [1,1,0,0,0,0|1,0,1]=4 3103 B10R1.1 CN1CCC(CC1)CCO 34a_100015190746_200000210301 [1,1,0,0,0,0|1,0,1]=4 3104 B10R1.1 CN1CCN(CC1)CC=O 2230a_100000188432_200015260668 [1,1,0,0,0,0|2,0,0]=4 3105 B10R1.1 CN1CCN(CC1)CC=O 269982a_100000188432_200015260668 [1,1,0,0,0,0|2,0,0]=4 3106 B10R1.1 CNCC1CCC(CC1)C 2230a_103436935547_200000210301 [1,1,0,0,0,0|2,0,0]=4 3107 B10R1.1 CNCC1CCC(CC1)C 34a_103436935547_200000210301 [1,1,0,0,0,0|2,0,0]=4 3108 B10R1.1 COCC1CCC(CC1)C 34a_100000701341_200000210301 [1,1,0,0,0,0|2,0,0]=4 3109 B10R1.1 COC[C@H]1CC[C@@H](CC1)N 34a_100009821084_200000210301 [1,1,0,0,0,0|2,0,0]=4 3110 B10R1.1 O=CCN1CCC(CC1)F 2230a_100015193889_200015260668 [1,1,0,0,0,0|1,0,0]=3 3111 B10R1.1 O=CCN1CCC(CC1)F 269982a_100015193889_200015260668 [1,1,0,0,0,0|1,0,0]=3 3112 B10R1.1 O=CCN1CCC(CC1)F 34a_100015193889_200009817547 [1,1,0,0,0,0|1,0,0]=3 3113 B10R1.1 O=CCN1CCC(CC1)O 2230a_100025773856_200015260668 [1,1,0,0,0,0|1,0,0]=3 3114 B10R1.1 O=CCN1CCC(CC1)O 269982a_100025773856_200015260668 [1,1,0,0,0,0|1,0,0]=3 3115 B10R1.1 O=CCN1CCS(=O)CC1 2230a_100000752083_200015260668 [1,1,0,0,0,0|2,0,0]=4 3116 B10R1.1 O=CCN1CCS(=O)CC1 269982a_100000752083_200015260668 [1,1,0,0,0,0|2,0,0]=4 3117 B10R1.1 OCCN1CCC(CC1)F 2230a_100015193889_100000211926 [1,1,0,0,0,0|1,0,1]=4 3118 B10R1.1 OCCN1CCC(CC1)F 269982a_100015193889_100000211926 [1,1,0,0,0,0|1,0,1]=4 3119 B10R1.1 OCCN1CCC(CC1)F 34a_100015193889_100000211926 [1,1,0,0,0,0|1,0,1]=4 3120 B10R1.1 OCCN1CCC(CC1)O 2230a_100025773856_100000211926 [1,1,0,0,0,0|1,0,1]=4 3121 B10R1.1 OCCN1CCC(CC1)O 269982a_100025773856_100000211926 [1,1,0,0,0,0|1,0,1]=4 3122 B10R1.1 [13CH3]N1CCC(CC1)CCO 2230a_100015190746_200025704644 [1,1,0,0,0,0|1,0,1]=4 3123 B10R1.1 [13CH3]N1CCC(CC1)CCO 269982a_100015190746_200025704644 [1,1,0,0,0,0|1,0,1]=4 3124 B10R1.1 [13CH3]N1CCC(CC1)CCO 34a_100015190746_200025704644 [1,1,0,0,0,0|1,0,1]=4 3125 B10R1.1 [13CH3]OC[C@H]1CC[C@@H](CC1)N 34a_100009821084_200025704644 [1,1,0,0,0,0|2,0,0]=4 3126 B10R1.4 C=CCN1CCCCC1C 2230a_100000211376_100000210623 [1,1,0,0,0,0|2,0,0]=4 3127 B10R1.4 C=CCN1CCCCC1C 269982a_100000211376_100000210623 [1,1,0,0,0,0|2,0,0]=4 3128 B10R1.4 C=CCN1CCCCC1C 34a_100000211376_100015514636 [1,1,0,0,0,0|2,0,0]=4 3129 B10R1.4 CC1CCCCN1CC=O 2230a_100000211376_200015260668 [1,1,0,0,0,0|1,0,0]=3 3130 B10R1.4 CC1CCCCN1CC=O 269982a_100000211376_200015260668 [1,1,0,0,0,0|1,0,0]=3 3131 B10R1.4 CC1CCCCN1CC=O 34a_100000211376_200009817547 [1,1,0,0,0,0|1,0,0]=3 3132 B10R1.4 CC1CCCCN1CCO 2230a_100000211376_100000211926 [1,1,0,0,0,0|1,0,1]=4 3133 B10R1.4 CC1CCCCN1CCO 269982a_100000211376_100000211926 [1,1,0,0,0,0|1,0,1]=4 3134 B10R1.4 CC1CCCCN1CCO 34a_100000211376_100000211926 [1,1,0,0,0,0|1,0,1]=4 3135 B10R1.4 CN1CCCCC1CCO 2230a_100000211664_200000210301 [1,1,0,0,0,0|1,0,1]=4 3136 B10R1.4 CN1CCCCC1CCO 269982a_100000211664_200000210301 [1,1,0,0,0,0|1,0,1]=4 3137 B10R1.4 CN1CCCCC1CCO 34a_100000211664_200000210301 [1,1,0,0,0,0|1,0,1]=4 3138 B10R1.4 CNCC1CCCCC1O 34a_100011216029_200000210301 [1,1,0,0,0,0|2,0,0]=4 3139 B10R1.4 C[C@H]1COCCN1CC=O 2230a_100009815349_200015260668 [1,1,0,0,0,0|2,0,0]=4 3140 B10R1.4 C[C@H]1COCCN1CC=O 269982a_100009815349_200015260668 [1,1,0,0,0,0|2,0,0]=4 3141 B10R1.4 C[C@H]1COCCN1CC=O 34a_100009815349_200009817547 [1,1,0,0,0,0|2,0,0]=4 3142 B10R1.4 [13CH3]N1CCCCC1CCO 2230a_100000211664_200025704644 [1,1,0,0,0,0|1,0,1]=4 3143 B10R1.4 [13CH3]N1CCCCC1CCO 269982a_100000211664_200025704644 [1,1,0,0,0,0|1,0,1]=4 3144 B10R1.4 [13CH3]N1CCCCC1CCO 34a_100000211664_200025704644 [1,1,0,0,0,0|1,0,1]=4 3145 B10R1.4 [13CH3]NCC1CCCCC1O 34a_100011216029_200025704644 [1,1,0,0,0,0|2,0,0]=4 3146 B10R1.10 C=CCN1CCCC(C1)F 2230a_100000697950_100000210623 [1,1,0,0,0,0|2,0,0]=4 3147 B10R1.10 C=CCN1CCCC(C1)F 269982a_100000697950_100000210623 [1,1,0,0,0,0|2,0,0]=4 3148 B10R1.10 C=CCN1CCCC(C1)F 34a_100000697950_100015514636 [1,1,0,0,0,0|2,0,0]=4 3149 B10R1.10 C=CCN1CCCC(C1)O 2230a_100000211013_100000210623 [1,1,0,0,0,0|2,0,0]=4 3150 B10R1.10 C=CCN1CCCC(C1)O 269982a_100000211013_100000210623 [1,1,0,0,0,0|2,0,0]=4 3151 B10R1.10 C=CCN1CCC[C@@H](C1)C 2230a_100000717927_100000210623 [1,1,0,0,0,0|2,0,0]=4 3152 B10R1.10 C=CCN1CCC[C@@H](C1)C 269982a_100000717927_100000210623 [1,1,0,0,0,0|2,0,0]=4 3153 B10R1.10 C=CCN1CCC[C@@H](C1)C 34a_100000717927_100015514636 [1,1,0,0,0,0|2,0,0]=4 3154 B10R1.10 CC1CN(CCO1)CC=O 2230a_100000729577_200015260668 [1,1,0,0,0,0|2,0,0]=4 3155 B10R1.10 CC1CN(CCO1)CC=O 269982a_100000729577_200015260668 [1,1,0,0,0,0|2,0,0]=4 3156 B10R1.10 CC1CN(CCO1)CC=O 34a_100000729577_200009817547 [1,1,0,0,0,0|2,0,0]=4 3157 B10R1.10 CN1CCCC(C1)CCO 2230a_100000752241_200000210301 [1,1,0,0,0,0|1,0,1]=4 3158 B10R1.10 CN1CCCC(C1)CCO 269982a_100000752241_200000210301 [1,1,0,0,0,0|1,0,1]=4 3159 B10R1.10 CN1CCCC(C1)CCO 34a_100000752241_200000210301 [1,1,0,0,0,0|1,0,1]=4 3160 B10R1.10 CNCC1CCCC(C1)O 2230a_100011254705_200000210301 [1,1,0,0,0,0|2,0,0]=4 3161 B10R1.10 C[C@H]1CCCN(C1)CC=O 2230a_100000717927_200015260668 [1,1,0,0,0,0|1,0,0]=3 3162 B10R1.10 C[C@H]1CCCN(C1)CC=O 269982a_100000717927_200015260668 [1,1,0,0,0,0|1,0,0]=3 3163 B10R1.10 C[C@H]1CCCN(C1)CC=O 34a_100000717927_200009817547 [1,1,0,0,0,0|1,0,0]=3 3164 B10R1.10 C[C@H]1CCCN(C1)CCO 2230a_100000717927_100000211926 [1,1,0,0,0,0|1,0,1]=4 3165 B10R1.10 C[C@H]1CCCN(C1)CCO 269982a_100000717927_100000211926 [1,1,0,0,0,0|1,0,1]=4 3166 B10R1.10 C[C@H]1CCCN(C1)CCO 34a_100000717927_100000211926 [1,1,0,0,0,0|1,0,1]=4 3167 B10R1.10 O=CCN1CCCC(C1)F 2230a_100000697950_200015260668 [1,1,0,0,0,0|1,0,0]=3 3168 B10R1.10 O=CCN1CCCC(C1)F 269982a_100000697950_200015260668 [1,1,0,0,0,0|1,0,0]=3 3169 B10R1.10 O=CCN1CCCC(C1)F 34a_100000697950_200009817547 [1,1,0,0,0,0|1,0,0]=3 3170 B10R1.10 O=CCN1CCCC(C1)O 2230a_100000211013_200015260668 [1,1,0,0,0,0|1,0,0]=3 3171 B10R1.10 O=CCN1CCCC(C1)O 269982a_100000211013_200015260668 [1,1,0,0,0,0|1,0,0]=3 3172 B10R1.10 O=CCN1CCOC(C1)O 2230a_100000688207_200015260668 [1,1,0,0,0,0|2,0,0]=4 3173 B10R1.10 O=CCN1CCOC(C1)O 269982a_100000688207_200015260668 [1,1,0,0,0,0|2,0,0]=4 3174 B10R1.10 OCCN1CCCC(C1)F 2230a_100000697950_100000211926 [1,1,0,0,0,0|1,0,1]=4 3175 B10R1.10 OCCN1CCCC(C1)F 269982a_100000697950_100000211926 [1,1,0,0,0,0|1,0,1]=4 3176 B10R1.10 OCCN1CCCC(C1)F 34a_100000697950_100000211926 [1,1,0,0,0,0|1,0,1]=4 3177 B10R1.10 OCCN1CCCC(C1)O 2230a_100000211013_100000211926 [1,1,0,0,0,0|1,0,1]=4 3178 B10R1.10 OCCN1CCCC(C1)O 269982a_100000211013_100000211926 [1,1,0,0,0,0|1,0,1]=4 3179 B10R1.10 [13CH3]N1CCCC(C1)CCO 2230a_100000752241_200025704644 [1,1,0,0,0,0|1,0,1]=4 3180 B10R1.10 [13CH3]N1CCCC(C1)CCO 269982a_100000752241_200025704644 [1,1,0,0,0,0|1,0,1]=4 3181 B10R1.10 [13CH3]N1CCCC(C1)CCO 34a_100000752241_200025704644 [1,1,0,0,0,0|1,0,1]=4 3182 B10R1.10 [13CH3]NCC1CCCC(C1)O 2230a_100011254705_200025704644 [1,1,0,0,0,0|2,0,0]=4 3183 B10R1.15 C=CC(=O)C1CCCCC1 1458a_100000185746_100000210327 [1,1,0,0,0,0|1,0,1]=4 3184 B10R1.15 CC(O[13CH3])C1CCCCC1 34a_100011216961_200025704644 [1,1,0,0,0,0|2,0,0]=4 3185 B10R1.15 CC(O[13CH3])C1CCCCC1 7a_100011216961_200025704644 [1,1,0,0,0,0|2,0,0]=4 3186 B10R1.15 CNC(C)C1CCCCC1 269862a_106832991636_100000210989 [1,1,0,0,0,0|2,0,0]=4 3187 B10R1.15 CN[C@H](C)C1CCCCC1 2230a_100025707633_200000210301 [1,1,0,0,0,0|2,0,0]=4 3188 B10R1.15 CN[C@H](C)C1CCCCC1 34a_100025707633_200000210301 [1,1,0,0,0,0|2,0,0]=4 3189 B10R1.15 COC(C)C1CCCCC1 34a_100011216961_200000210301 [1,1,0,0,0,0|2,0,0]=4 3190 B10R1.15 COC(C)C1CCCCC1 7a_100011216961_200000210301 [1,1,0,0,0,0|2,0,0]=4 3191 B10R1.15 C[C@@H](N[13CH3])C1CCCCC1 2230a_100025707633_200025704644 [1,1,0,0,0,0|2,0,0]=4 3192 B10R1.15 C[C@@H](N[13CH3])C1CCCCC1 34a_100025707633_200025704644 [1,1,0,0,0,0|2,0,0]=4 3193 B10R1.15 O=C(CO)C1CCCCC1 1458a_100000210174_100000210327 [1,1,0,0,0,0|0,0,2]=4 3194 B10R1.17 BrCCOC1CCCCC1 34a_100000211926_100000210327 [1,1,0,0,0,0|1,0,1]=4 3195 B10R1.17 C#CCNC1CCCCC1 2230a_100000182618_100000038162 [1,1,0,0,0,0|1,0,1]=4 3196 B10R1.17 C#CCNC1CCCCC1 34a_100000182618_100000184674 [1,1,0,0,0,0|1,0,1]=4 3197 B10R1.17 C#CCNC1CCCCC1 34a_100000212058_100000210327 [1,1,0,0,0,0|1,0,1]=4 3198 B10R1.17 C#CCOC1CCCCC1 34a_100000210231_100000184674 [1,1,0,0,0,0|1,0,1]=4 3199 B10R1.17 C#CCOC1CCCCC1 34a_100000210247_100000210327 [1,1,0,0,0,0|1,0,1]=4 3200 B10R1.17 C#CCOC1CCCCC1 7a_100000210231_100000038162 [1,1,0,0,0,0|1,0,1]=4 3201 B10R1.17 C#CCSC1CCCCC1 62a_100000038162_100000210327 [1,1,0,0,0,0|1,0,1]=4 3202 B10R1.17 C=CCNC1CCCCC1 2230a_100000182618_100000210623 [1,1,0,0,0,0|1,0,0]=3 3203 B10R1.17 C=CCNC1CCCCC1 270004a_100020586998_100000210434 [1,1,0,0,0,0|1,0,0]=3 3204 B10R1.17 C=CCNC1CCCCC1 34a_100000182618_100015514636 [1,1,0,0,0,0|1,0,0]=3 3205 B10R1.17 C=CCNC1CCCOC1 2230a_100000719290_100000210623 [1,1,0,0,0,0|2,0,0]=4 3206 B10R1.17 C=CCNC1CCCOC1 270004a_100020586998_100000753404 [1,1,0,0,0,0|2,0,0]=4 3207 B10R1.17 C=CCNC1CCCOC1 34a_100000719290_100015514636 [1,1,0,0,0,0|2,0,0]=4 3208 B10R1.17 C=CCNC1CCCSC1 270004a_100020586998_100000057913 [1,1,0,0,0,0|2,0,0]=4 3209 B10R1.17 C=CCNC1CCNCC1 270004a_100020586998_100015192401 [1,1,0,0,0,0|2,0,0]=4 3210 B10R1.17 C=CCNC1CCOCC1 2230a_100000741149_100000210623 [1,1,0,0,0,0|2,0,0]=4 3211 B10R1.17 C=CCNC1CCOCC1 270004a_100020586998_100011217826 [1,1,0,0,0,0|2,0,0]=4 3212 B10R1.17 C=CCNC1CCOCC1 34a_100000741149_100015514636 [1,1,0,0,0,0|2,0,0]=4 3213 B10R1.17 C=CCNC1CCSCC1 2230a_100000748639_100000210623 [1,1,0,0,0,0|2,0,0]=4 3214 B10R1.17 C=CCNC1CCSCC1 270004a_100020586998_100000203788 [1,1,0,0,0,0|2,0,0]=4 3215 B10R1.17 C=CCNC1CCSCC1 34a_100000748639_100015514636 [1,1,0,0,0,0|2,0,0]=4 3216 B10R1.17 C=CCOC1CCCCC1 34a_100000210231_100015514636 [1,1,0,0,0,0|1,0,0]=3 3217 B10R1.17 C=CCOC1CCCCC1 34a_200000210373_100000210327 [1,1,0,0,0,0|1,0,0]=3 3218 B10R1.17 C=CCOC1CCCCC1 7a_100000210231_100015514636 [1,1,0,0,0,0|1,0,0]=3 3219 B10R1.17 C=CCOC1CCCCO1 34a_100000033831_100015514636 [1,1,0,0,0,0|2,0,0]=4 3220 B10R1.17 C=CCOC1CCCOC1 34a_100000754041_100015514636 [1,1,0,0,0,0|2,0,0]=4 3221 B10R1.17 C=CCOC1CCCOC1 34a_200000210373_100000693364 [1,1,0,0,0,0|2,0,0]=4 3222 B10R1.17 C=CCOC1CCCSC1 7a_100015962668_100015514636 [1,1,0,0,0,0|2,0,0]=4 3223 B10R1.17 C=CCOC1CCOCC1 34a_100000744328_100015514636 [1,1,0,0,0,0|2,0,0]=4 3224 B10R1.17 C=CCOC1CCSCC1 34a_100000731022_100015514636 [1,1,0,0,0,0|2,0,0]=4 3225 B10R1.17 C=CCOC1CCSCC1 34a_200000210373_100000069128 [1,1,0,0,0,0|2,0,0]=4 3226 B10R1.17 C=CCOC1CCSCC1 7a_100000731022_100015514636 [1,1,0,0,0,0|2,0,0]=4 3227 B10R1.17 C=CCSC1CCCCC1 62a_100000210327_100000210623 [1,1,0,0,0,0|1,0,0]=3 3228 B10R1.17 C=CCSC1CCCCC1 62a_100000210623_100000210327 [1,1,0,0,0,0|1,0,0]=3 3229 B10R1.17 C=CCSC1CCCOC1 62a_100000210623_100000693364 [1,1,0,0,0,0|2,0,0]=4 3230 B10R1.17 C=CCSC1CCOCC1 62a_100000210623_100011324220 [1,1,0,0,0,0|2,0,0]=4 3231 B10R1.17 C=CCSC1CCSCC1 62a_100000210623_100000069128 [1,1,0,0,0,0|2,0,0]=4 3232 B10R1.17 CC=NNC1CCCCC1 4a_100000709804_200000210099 [1,1,0,0,0,0|2,0,0]=4 3233 B10R1.17 CCCNC1CCCCC1 2230a_100000182618_100000210303 [1,1,0,0,0,0|1,0,1]=4 3234 B10R1.17 CCCNC1CCCCC1 270004a_100020643023_100000210434 [1,1,0,0,0,0|1,0,1]=4 3235 B10R1.17 CCCNC1CCCCC1 34a_100000182618_100000210303 [1,1,0,0,0,0|1,0,1]=4 3236 B10R1.17 CCCOC1CCCCC1 34a_100000210231_100000210303 [1,1,0,0,0,0|1,0,1]=4 3237 B10R1.17 CCCOC1CCCCC1 34a_100000210258_100000210327 [1,1,0,0,0,0|1,0,1]=4 3238 B10R1.17 CCCOC1CCCCC1 7a_100000210231_100000210303 [1,1,0,0,0,0|1,0,1]=4 3239 B10R1.17 CCCSC1CCCCC1 62a_100000210303_100000210327 [1,1,0,0,0,0|1,0,1]=4 3240 B10R1.17 CCCSC1CCCCC1 62a_100000210327_100000210303 [1,1,0,0,0,0|1,0,1]=4 3241 B10R1.17 CCNCC1CCCCC1 2230a_100000210473_100000210202 [1,1,0,0,0,0|1,0,1]=4 3242 B10R1.17 CCNCC1CCCCC1 2230a_100015525214_100000211423 [1,1,0,0,0,0|1,0,1]=4 3243 B10R1.17 CCNCC1CCCCC1 269862a_100015525214_100000211278 [1,1,0,0,0,0|1,0,1]=4 3244 B10R1.17 CCNCC1CCCCC1 34a_100000210473_100000210202 [1,1,0,0,0,0|1,0,1]=4 3245 B10R1.17 CCOCC1CCCCC1 34a_100000212181_100000210202 [1,1,0,0,0,0|1,0,1]=4 3246 B10R1.17 CCOCC1CCCCC1 34a_100121572206_100000211423 [1,1,0,0,0,0|1,0,1]=4 3247 B10R1.17 CCOCC1CCCCC1 7a_100000212181_100000210202 [1,1,0,0,0,0|1,0,1]=4 3248 B10R1.17 CCSCC1CCCCC1 62a_100000210202_100000211423 [1,1,0,0,0,0|1,0,1]=4 3249 B10R1.17 CCSCC1CCCCC1 62a_100000211423_100000210202 [1,1,0,0,0,0|1,0,1]=4 3250 B10R1.17 CNCCC1CCCCC1 2230a_100000738074_200000210301 [1,1,0,0,0,0|1,0,1]=4 3251 B10R1.17 CNCCC1CCCCC1 2230a_106832991635_100012355289 [1,1,0,0,0,0|1,0,1]=4 3252 B10R1.17 CNCCC1CCCCC1 270004a_106832991635_100011713444 [1,1,0,0,0,0|1,0,1]=4 3253 B10R1.17 CNCCC1CCCCC1 34a_100000738074_200000210301 [1,1,0,0,0,0|1,0,1]=4 3254 B10R1.17 CNCCC1CCCCC1 34a_100102657272_100011209188 [1,1,0,0,0,0|1,0,1]=4 3255 B10R1.17 CNCCC1CCCCC1 7a_106832991635_100011273959 [1,1,0,0,0,0|1,0,1]=4 3256 B10R1.17 CNCOC1CCCCC1 2230a_106832991635_100011935260 [1,1,0,0,0,0|2,0,0]=4 3257 B10R1.17 CNCOC1CCCCC1 34a_100102657272_100011935260 [1,1,0,0,0,0|2,0,0]=4 3258 B10R1.17 CNCOC1CCCCC1 7a_106832991635_100011935260 [1,1,0,0,0,0|2,0,0]=4 3259 B10R1.17 COCCC1CCCCC1 34a_100011217863_200000210301 [1,1,0,0,0,0|0,0,1]=3 3260 B10R1.17 COCCC1CCCCC1 34a_100138415774_100011209188 [1,1,0,0,0,0|0,0,1]=3 3261 B10R1.17 COCCC1CCCCC1 7a_100011217863_200000210301 [1,1,0,0,0,0|0,0,1]=3 3262 B10R1.17 COCCC1CCCCN1 34a_100000211664_200000210301 [1,1,0,0,0,0|1,0,1]=4 3263 B10R1.17 COCCC1CCCNC1 34a_100000752241_200000210301 [1,1,0,0,0,0|1,0,1]=4 3264 B10R1.17 COCCC1CCNCC1 34a_100015190746_200000210301 [1,1,0,0,0,0|1,0,1]=4 3265 B10R1.17 COCCC1CCOCC1 34a_100011933979_200000210301 [1,1,0,0,0,0|1,0,1]=4 3266 B10R1.17 COCCC1CCOCC1 34a_100138415774_100011934994 [1,1,0,0,0,0|1,0,1]=4 3267 B10R1.17 COCCC1CCOCC1 7a_100011933979_200000210301 [1,1,0,0,0,0|1,0,1]=4 3268 B10R1.17 COCCN1CCCCC1 34a_100138415774_100000739454 [1,1,0,0,0,0|1,0,1]=4 3269 B10R1.17 COCNC1CCCCC1 2230a_100000182618_100000766300 [1,1,0,0,0,0|1,0,1]=4 3270 B10R1.17 COCOC1CCCCC1 34a_100138415774_100011935260 [1,1,0,0,0,0|1,0,1]=4 3271 B10R1.17 COCSC1CCCCC1 62a_100000210327_100000766300 [1,1,0,0,0,0|1,0,1]=4 3272 B10R1.17 COCSC1CCCCC1 62a_100000766300_100000210327 [1,1,0,0,0,0|1,0,1]=4 3273 B10R1.17 CSCCC1CCCCC1 62a_100012355289_200000210301 [1,1,0,0,0,0|0,1,1]=4 3274 B10R1.17 CSCCC1CCCCC1 62a_200000210301_100012355289 [1,1,0,0,0,0|0,1,1]=4 3275 B10R1.17 CSCNC1CCCCC1 2230a_100000182618_100011218213 [1,1,0,0,0,0|2,0,0]=4 3276 B10R1.17 CSCNC1CCCCC1 34a_100000182618_100011218213 [1,1,0,0,0,0|2,0,0]=4 3277 B10R1.17 CSCOC1CCCCC1 34a_100000210231_100011218213 [1,1,0,0,0,0|2,0,0]=4 3278 B10R1.17 CSCOC1CCCCC1 62a_100011935260_200000210301 [1,1,0,0,0,0|2,0,0]=4 3279 B10R1.17 CSCOC1CCCCC1 62a_200000210301_100011935260 [1,1,0,0,0,0|2,0,0]=4 3280 B10R1.17 CSCSC1CCCCC1 62a_100000210327_100011218213 [1,1,0,0,0,0|2,0,0]=4 3281 B10R1.17 CSCSC1CCCCC1 62a_100011218213_100000210327 [1,1,0,0,0,0|2,0,0]=4 3282 B10R1.17 FCCNC1CCCCC1 2230a_100000182618_100011217306 [1,1,0,0,0,0|1,0,1]=4 3283 B10R1.17 FCCNC1CCCCC1 34a_100000182618_100011217306 [1,1,0,0,0,0|1,0,1]=4 3284 B10R1.17 FCCNC1CCCCC1 34a_100000724931_100000210327 [1,1,0,0,0,0|1,0,1]=4 3285 B10R1.17 FCCOC1CCCCC1 34a_100000210231_100011217306 [1,1,0,0,0,0|1,0,1]=4 3286 B10R1.17 FCCOC1CCCCC1 7a_100000210231_100011217306 [1,1,0,0,0,0|1,0,1]=4 3287 B10R1.17 FCCSC1CCCCC1 62a_100000210327_100011217306 [1,1,0,0,0,0|1,0,1]=4 3288 B10R1.17 FCCSC1CCCCC1 62a_100011217306_100000210327 [1,1,0,0,0,0|1,0,1]=4 3289 B10R1.17 FCNCC1CCCCC1 34a_100000210473_100015361967 [1,1,0,0,0,0|1,0,1]=4 3290 B10R1.17 FCOCC1CCCCC1 34a_100000212181_100015361967 [1,1,0,0,0,0|1,0,1]=4 3291 B10R1.17 FCOCC1CCCCC1 7a_100000212181_100015361967 [1,1,0,0,0,0|1,0,1]=4 3292 B10R1.17 FCSCC1CCCCC1 62a_100000211423_100015361967 [1,1,0,0,0,0|1,0,1]=4 3293 B10R1.17 FCSCC1CCCCC1 62a_100015361967_100000211423 [1,1,0,0,0,0|1,0,1]=4 3294 B10R1.17 N#CCNC1CCCCC1 2230a_100000182618_100011215382 [1,1,0,0,0,0|1,0,1]=4 3295 B10R1.17 N#CCOC1CCCCC1 7a_100000210231_100011215382 [1,1,0,0,0,0|1,0,1]=4 3296 B10R1.17 N#CCSC1CCCCC1 62a_100000210327_100011215382 [1,1,0,0,0,0|1,0,1]=4 3297 B10R1.17 N#CCSC1CCCCC1 62a_100011215382_100000210327 [1,1,0,0,0,0|1,0,1]=4 3298 B10R1.17 NCCOC1CCCCC1 34a_100000210304_100000210327 [1,1,0,0,0,0|1,0,1]=4 3299 B10R1.17 O=CCNC1CCCCC1 2230a_100000182618_200015260668 [1,1,0,0,0,0|0,0,0]=2 3300 B10R1.17 O=CCNC1CCCCC1 34a_100000182618_200009817547 [1,1,0,0,0,0|0,0,0]=2 3301 B10R1.17 O=CCNC1CCCOC1 2230a_100000719290_200015260668 [1,1,0,0,0,0|1,0,0]=3 3302 B10R1.17 O=CCNC1CCCOC1 34a_100000719290_200009817547 [1,1,0,0,0,0|1,0,0]=3 3303 B10R1.17 O=CCNC1CCOCC1 2230a_100000741149_200015260668 [1,1,0,0,0,0|1,0,0]=3 3304 B10R1.17 O=CCNC1CCOCC1 34a_100000741149_200009817547 [1,1,0,0,0,0|1,0,0]=3 3305 B10R1.17 O=CCNC1CCSCC1 2230a_100000748639_200015260668 [1,1,0,0,0,0|1,0,0]=3 3306 B10R1.17 O=CCNC1CCSCC1 34a_100000748639_200009817547 [1,1,0,0,0,0|1,0,0]=3 3307 B10R1.17 O=CCOC1C=CCCC1 34a_100011215024_200009817547 [1,1,0,0,0,0|0,0,2]=4 3308 B10R1.17 O=CCOC1CC=CCC1 34a_100000073881_200009817547 [1,1,0,0,0,0|0,0,2]=4 3309 B10R1.17 O=CCOC1CCCCC1 34a_100000210231_200009817547 [1,1,0,0,0,0|0,0,0]=2 3310 B10R1.17 O=CCOC1CCCCC1 7a_100000210231_200015260668 [1,1,0,0,0,0|0,0,0]=2 3311 B10R1.17 O=CCOC1CCCCO1 34a_100000033831_200009817547 [1,1,0,0,0,0|1,0,0]=3 3312 B10R1.17 O=CCOC1CCCOC1 34a_100000754041_200009817547 [1,1,0,0,0,0|1,0,0]=3 3313 B10R1.17 O=CCOC1CCCSC1 7a_100015962668_200015260668 [1,1,0,0,0,0|1,0,0]=3 3314 B10R1.17 O=CCOC1CCOCC1 34a_100000744328_200009817547 [1,1,0,0,0,0|1,0,0]=3 3315 B10R1.17 O=CCOC1CCSCC1 34a_100000731022_200009817547 [1,1,0,0,0,0|1,0,0]=3 3316 B10R1.17 O=CCOC1CCSCC1 7a_100000731022_200015260668 [1,1,0,0,0,0|1,0,0]=3 3317 B10R1.17 O=CCSC1C=CCCC1 62a_100000751183_200015260668 [1,1,0,0,0,0|0,0,2]=4 3318 B10R1.17 O=CCSC1C=CCCC1 62a_200015260668_100000751183 [1,1,0,0,0,0|0,0,2]=4 3319 B10R1.17 O=CCSC1CCCCC1 62a_100000210327_200015260668 [1,1,0,0,0,0|0,0,0]=2 3320 B10R1.17 O=CCSC1CCCCC1 62a_200015260668_100000210327 [1,1,0,0,0,0|0,0,0]=2 3321 B10R1.17 O=CCSC1CCCOC1 62a_200015260668_100000693364 [1,1,0,0,0,0|1,0,0]=3 3322 B10R1.17 O=CCSC1CCOCC1 62a_200015260668_100011324220 [1,1,0,0,0,0|1,0,0]=3 3323 B10R1.17 O=CCSC1CCSCC1 62a_200015260668_100000069128 [1,1,0,0,0,0|1,0,0]=3 3324 B10R1.17 OCCNC1CCCCC1 2230a_100000182618_100000211926 [1,1,0,0,0,0|0,0,1]=3 3325 B10R1.17 OCCNC1CCCCC1 270004a_100000210304_100000210434 [1,1,0,0,0,0|0,0,1]=3 3326 B10R1.17 OCCNC1CCCCC1 34a_100000182618_100000211926 [1,1,0,0,0,0|0,0,1]=3 3327 B10R1.17 OCCNC1CCCCC1 34a_100016990907_100000210327 [1,1,0,0,0,0|0,0,1]=3 3328 B10R1.17 OCCNC1CCCOC1 2230a_100000719290_100000211926 [1,1,0,0,0,0|1,0,1]=4 3329 B10R1.17 OCCNC1CCCOC1 270004a_100000210304_100000753404 [1,1,0,0,0,0|1,0,1]=4 3330 B10R1.17 OCCNC1CCCOC1 34a_100000719290_100000211926 [1,1,0,0,0,0|1,0,1]=4 3331 B10R1.17 OCCNC1CCCOC1 34a_100016990907_100000693364 [1,1,0,0,0,0|1,0,1]=4 3332 B10R1.17 OCCNC1CCCSC1 270004a_100000210304_100000057913 [1,1,0,0,0,0|1,0,1]=4 3333 B10R1.17 OCCNC1CCNCC1 270004a_100000210304_100015192401 [1,1,0,0,0,0|1,0,1]=4 3334 B10R1.17 OCCNC1CCOCC1 2230a_100000741149_100000211926 [1,1,0,0,0,0|1,0,1]=4 3335 B10R1.17 OCCNC1CCOCC1 270004a_100000210304_100011217826 [1,1,0,0,0,0|1,0,1]=4 3336 B10R1.17 OCCNC1CCOCC1 34a_100000741149_100000211926 [1,1,0,0,0,0|1,0,1]=4 3337 B10R1.17 OCCNC1CCSCC1 2230a_100000748639_100000211926 [1,1,0,0,0,0|1,0,1]=4 3338 B10R1.17 OCCNC1CCSCC1 270004a_100000210304_100000203788 [1,1,0,0,0,0|1,0,1]=4 3339 B10R1.17 OCCNC1CCSCC1 34a_100000748639_100000211926 [1,1,0,0,0,0|1,0,1]=4 3340 B10R1.17 OCCNC1CCSCC1 34a_100016990907_100000069128 [1,1,0,0,0,0|1,0,1]=4 3341 B10R1.17 OCCOC1CCCCC1 34a_100000210231_100000211926 [1,1,0,0,0,0|0,0,1]=3 3342 B10R1.17 OCCOC1CCCCC1 7a_100000210231_100000211926 [1,1,0,0,0,0|0,0,1]=3 3343 B10R1.17 OCCOC1CCCCO1 34a_100000033831_100000211926 [1,1,0,0,0,0|1,0,1]=4 3344 B10R1.17 OCCOC1CCCOC1 34a_100000754041_100000211926 [1,1,0,0,0,0|1,0,1]=4 3345 B10R1.17 OCCOC1CCCSC1 7a_100015962668_100000211926 [1,1,0,0,0,0|1,0,1]=4 3346 B10R1.17 OCCOC1CCOCC1 34a_100000744328_100000211926 [1,1,0,0,0,0|1,0,1]=4 3347 B10R1.17 OCCOC1CCSCC1 34a_100000731022_100000211926 [1,1,0,0,0,0|1,0,1]=4 3348 B10R1.17 OCCOC1CCSCC1 7a_100000731022_100000211926 [1,1,0,0,0,0|1,0,1]=4 3349 B10R1.17 OCCSC1CCCCC1 62a_100000210327_100000211926 [1,1,0,0,0,0|0,0,1]=3 3350 B10R1.17 OCCSC1CCCCC1 62a_100000211926_100000210327 [1,1,0,0,0,0|0,0,1]=3 3351 B10R1.17 OCCSC1CCCOC1 62a_100000211926_100000693364 [1,1,0,0,0,0|1,0,1]=4 3352 B10R1.17 OCCSC1CCOCC1 62a_100000211926_100011324220 [1,1,0,0,0,0|1,0,1]=4 3353 B10R1.17 OCCSC1CCSCC1 62a_100000211926_100000069128 [1,1,0,0,0,0|1,0,1]=4 3354 B10R1.17 [13CH3]NCCC1CCCCC1 2230a_100000738074_200025704644 [1,1,0,0,0,0|1,0,1]=4 3355 B10R1.17 [13CH3]NCCC1CCCCC1 34a_100000738074_200025704644 [1,1,0,0,0,0|1,0,1]=4 3356 B10R1.17 [13CH3]OCCC1CCCCC1 34a_100011217863_200025704644 [1,1,0,0,0,0|0,0,1]=3 3357 B10R1.17 [13CH3]OCCC1CCCCC1 7a_100011217863_200025704644 [1,1,0,0,0,0|0,0,1]=3 3358 B10R1.17 [13CH3]OCCC1CCCCN1 34a_100000211664_200025704644 [1,1,0,0,0,0|1,0,1]=4 3359 B10R1.17 [13CH3]OCCC1CCCNC1 34a_100000752241_200025704644 [1,1,0,0,0,0|1,0,1]=4 3360 B10R1.17 [13CH3]OCCC1CCNCC1 34a_100015190746_200025704644 [1,1,0,0,0,0|1,0,1]=4 3361 B10R1.17 [13CH3]OCCC1CCOCC1 34a_100011933979_200025704644 [1,1,0,0,0,0|1,0,1]=4 3362 B10R1.17 [13CH3]OCCC1CCOCC1 7a_100011933979_200025704644 [1,1,0,0,0,0|1,0,1]=4 3363 B10R1.17 [13CH3]SCCC1CCCCC1 62a_100012355289_200025704644 [1,1,0,0,0,0|0,1,1]=4 3364 B10R1.17 [13CH3]SCCC1CCCCC1 62a_200025704644_100012355289 [1,1,0,0,0,0|0,1,1]=4 3365 B10R1.17 [13CH3]SCOC1CCCCC1 62a_100011935260_200025704644 [1,1,0,0,0,0|2,0,0]=4 3366 B10R1.17 [13CH3]SCOC1CCCCC1 62a_200025704644_100011935260 [1,1,0,0,0,0|2,0,0]=4 3367 B10R1.377 CC1(CCCCC1)CN[13CH3] 2230a_100000706052_200025704644 [1,1,0,0,0,0|2,0,0]=4 3368 B10R1.377 CC1(CCCCC1)CN[13CH3] 34a_100000706052_200025704644 [1,1,0,0,0,0|2,0,0]=4 3369 B10R1.377 CC1(CCCCC1)CO[13CH3] 34a_100000688186_200025704644 [1,1,0,0,0,0|2,0,0]=4 3370 B10R1.377 CC1(CCCCC1)CO[13CH3] 7a_100000688186_200025704644 [1,1,0,0,0,0|2,0,0]=4 3371 B10R1.377 CNCC1(CCCCC1)C 2230a_100000706052_200000210301 [1,1,0,0,0,0|2,0,0]=4 3372 B10R1.377 CNCC1(CCCCC1)C 269862a_106832991636_100011935227 [1,1,0,0,0,0|2,0,0]=4 3373 B10R1.377 CNCC1(CCCCC1)C 34a_100000706052_200000210301 [1,1,0,0,0,0|2,0,0]=4 3374 B10R1.377 CNCC1(CCCCC1)O 2230a_100000748649_200000210301 [1,1,0,0,0,0|2,0,0]=4 3375 B10R1.377 CNCC1(CCCCC1)O 34a_100000748649_200000210301 [1,1,0,0,0,0|2,0,0]=4 3376 B10R1.377 COCC1(CCCCC1)C 34a_100000688186_200000210301 [1,1,0,0,0,0|2,0,0]=4 3377 B10R1.377 COCC1(CCCCC1)C 7a_100000688186_200000210301 [1,1,0,0,0,0|2,0,0]=4 3378 B10R1.377 COCC1(CCCCC1)F 34a_100000090305_200000210301 [1,1,0,0,0,0|2,0,0]=4 3379 B10R1.377 COCC1(CCCCC1)F 7a_100000090305_200000210301 [1,1,0,0,0,0|2,0,0]=4 3380 B10R1.377 COCC1(CCCCC1)N 34a_100000740034_200000210301 [1,1,0,0,0,0|2,0,0]=4 3381 B10R1.377 [13CH3]NCC1(CCCCC1)O 2230a_100000748649_200025704644 [1,1,0,0,0,0|2,0,0]=4 3382 B10R1.377 [13CH3]NCC1(CCCCC1)O 34a_100000748649_200025704644 [1,1,0,0,0,0|2,0,0]=4 3383 B10R1.377 [13CH3]OCC1(CCCCC1)F 34a_100000090305_200025704644 [1,1,0,0,0,0|2,0,0]=4 3384 B10R1.377 [13CH3]OCC1(CCCCC1)F 7a_100000090305_200025704644 [1,1,0,0,0,0|2,0,0]=4 3385 B10R1.377 [13CH3]OCC1(CCCCC1)N 34a_100000740034_200025704644 [1,1,0,0,0,0|2,0,0]=4 3386 B10R1.13 C=C1CCC(CC1)C(=O)C 1458a_200000138047_200000210301 [0,1,0,0,1,0|1,0,1]=4 3387 B10R1.13 C=C1CCC(CC1)C(=O)[13CH3] 1458a_200000138047_200025704644 [0,1,0,0,1,0|1,0,1]=4 3388 B10R1.13 CC(=O)C1CCC(CC1)C 1458a_100000070787_200011216234 [0,1,0,0,1,0|1,0,0]=3 3389 B10R1.13 CC(=O)C1CCC(CC1)O 1458a_100000743365_200000210301 [0,1,0,0,1,0|1,0,0]=3 3390 B10R1.13 CC(=O)C1CCN(CC1)C 1458a_100000743488_200000210301 [0,1,0,0,1,0|2,0,0]=4 3391 B10R1.13 CC(=O)N1CCC(CC1)C 240690a_100000188429_100015343762 [0,1,0,0,1,0|2,0,0]=4 3392 B10R1.13 CC(=O)N1CCC(CC1)C 527a_100000188429_100103153847 [0,1,0,0,1,0|2,0,0]=4 3393 B10R1.13 CC(=O)N1CCC(CC1)F 11a_100015193889_100015343762 [0,1,0,0,1,0|2,0,0]=4 3394 B10R1.13 CC(=O)N1CCC(CC1)F 1626a_100015193889_100015343762 [0,1,0,0,1,0|2,0,0]=4 3395 B10R1.13 CC(=O)N1CCC(CC1)F 240690a_100015193889_100015343762 [0,1,0,0,1,0|2,0,0]=4 3396 B10R1.13 CC(=O)N1CCC(CC1)F 527a_100015193889_100103153847 [0,1,0,0,1,0|2,0,0]=4 3397 B10R1.13 CC(=O)N1CCC(CC1)O 240690a_100025773856_100015343762 [0,1,0,0,1,0|2,0,0]=4 3398 B10R1.13 CC(=O)N1CCC(CC1)O 527a_100025773856_100103153847 [0,1,0,0,1,0|2,0,0]=4 3399 B10R1.13 CC(=O)[C@H]1CC[C@@H](CC1)C 1458a_100009815934_200000210301 [0,1,0,0,1,0|1,0,0]=3 3400 B10R1.13 CN1CCC(CC1)C(=O)N 2230a_100000210938_200000210301 [0,1,0,0,1,0|2,0,0]=4 3401 B10R1.13 CN1CCC(CC1)C(=O)N 269982a_100000210938_200000210301 [0,1,0,0,1,0|2,0,0]=4 3402 B10R1.13 CN1CCC(CC1)C(=O)N 34a_100000210938_200000210301 [0,1,0,0,1,0|2,0,0]=4 3403 B10R1.13 CN1CCC(CC1)C(=O)O 269956a_100000210459_200000210301 [0,1,0,0,1,0|1,0,0]=3 3404 B10R1.13 CN1CCC(CC1)C(=O)[13CH3] 1458a_100000743488_200025704644 [0,1,0,0,1,0|2,0,0]=4 3405 B10R1.13 C[C@H]1CC[C@@H](CC1)C(=O)[13CH3] 1458a_100009815934_200025704644 [0,1,0,0,1,0|1,0,0]=3 3406 B10R1.13 [13CH3]C(=O)C1CCC(CC1)O 1458a_100000743365_200025704644 [0,1,0,0,1,0|1,0,0]=3 3407 B10R1.13 [13CH3]N1CCC(CC1)C(=O)N 2230a_100000210938_200025704644 [0,1,0,0,1,0|2,0,0]=4 3408 B10R1.13 [13CH3]N1CCC(CC1)C(=O)N 269982a_100000210938_200025704644 [0,1,0,0,1,0|2,0,0]=4 3409 B10R1.13 [13CH3]N1CCC(CC1)C(=O)N 34a_100000210938_200025704644 [0,1,0,0,1,0|2,0,0]=4 3410 B10R1.13 [13CH3]N1CCC(CC1)C(=O)O 269956a_100000210459_200025704644 [0,1,0,0,1,0|1,0,0]=3 3411 B10R1.61 CC(=O)C1CCCCC1=O 1458a_100000070787_100000204591 [0,1,0,0,1,0|1,0,1]=4 3412 B10R1.61 CC(=O)C1CCCCC1C 1458a_100011215568_200000210301 [0,1,0,0,1,0|1,0,0]=3 3413 B10R1.61 CC(=O)C1CCCCC1O 1458a_100011803323_200000210301 [0,1,0,0,1,0|1,0,0]=3 3414 B10R1.61 CC(=O)N1CCCCC1C 11a_100000211376_100015343762 [0,1,0,0,1,0|2,0,0]=4 3415 B10R1.61 CC(=O)N1CCCCC1C 1626a_100000211376_100015343762 [0,1,0,0,1,0|2,0,0]=4 3416 B10R1.61 CC(=O)N1CCCCC1C 240690a_100000211376_100015343762 [0,1,0,0,1,0|2,0,0]=4 3417 B10R1.61 CC(=O)N1CCCCC1C 527a_100000211376_100103153847 [0,1,0,0,1,0|2,0,0]=4 3418 B10R1.61 CC(=O)[C@H]1CCCCN1C 1458a_100000767060_200000210301 [0,1,0,0,1,0|2,0,0]=4 3419 B10R1.61 CC1CCCCC1C(=O)[13CH3] 1458a_100011215568_200025704644 [0,1,0,0,1,0|1,0,0]=3 3420 B10R1.61 CN1CCCCC1C(=O)N 2230a_100000181395_200000210301 [0,1,0,0,1,0|2,0,0]=4 3421 B10R1.61 CN1CCCCC1C(=O)N 269982a_100000181395_200000210301 [0,1,0,0,1,0|2,0,0]=4 3422 B10R1.61 CN1CCCCC1C(=O)N 34a_100000181395_200000210301 [0,1,0,0,1,0|2,0,0]=4 3423 B10R1.61 CN1CCCC[C@@H]1C(=O)O 269956a_100000763471_200000210301 [0,1,0,0,1,0|1,0,0]=3 3424 B10R1.61 CN1CCCC[C@@H]1C(=O)[13CH3] 1458a_100000767060_200025704644 [0,1,0,0,1,0|2,0,0]=4 3425 B10R1.61 CN1CCOC[C@@H]1C(=O)O 269956a_100016993156_200000210301 [0,1,0,0,1,0|2,0,0]=4 3426 B10R1.61 CN1CCSCC1C(=O)O 269956a_100011346106_200000210301 [0,1,0,0,1,0|2,0,0]=4 3427 B10R1.61 CN1CSCCC1C(=O)O 269956a_100015185162_200000210301 [0,1,0,0,1,0|2,0,0]=4 3428 B10R1.61 [13CH3]C(=O)C1CCCCC1O 1458a_100011803323_200025704644 [0,1,0,0,1,0|1,0,0]=3 3429 B10R1.61 [13CH3]N1CCCCC1C(=O)N 2230a_100000181395_200025704644 [0,1,0,0,1,0|2,0,0]=4 3430 B10R1.61 [13CH3]N1CCCCC1C(=O)N 269982a_100000181395_200025704644 [0,1,0,0,1,0|2,0,0]=4 3431 B10R1.61 [13CH3]N1CCCCC1C(=O)N 34a_100000181395_200025704644 [0,1,0,0,1,0|2,0,0]=4 3432 B10R1.61 [13CH3]N1CCCC[C@@H]1C(=O)O 269956a_100000763471_200025704644 [0,1,0,0,1,0|1,0,0]=3 3433 B10R1.61 [13CH3]N1CCOC[C@@H]1C(=O)O 269956a_100016993156_200025704644 [0,1,0,0,1,0|2,0,0]=4 3434 B10R1.61 [13CH3]N1CCSCC1C(=O)O 269956a_100011346106_200025704644 [0,1,0,0,1,0|2,0,0]=4 3435 B10R1.61 [13CH3]N1CSCCC1C(=O)O 269956a_100015185162_200025704644 [0,1,0,0,1,0|2,0,0]=4 3436 B10R1.113 CC(=O)C1CCCC(C1)C 1458a_100011215569_200000210301 [0,1,0,0,1,0|1,0,0]=3 3437 B10R1.113 CC(=O)C1CCCC(C1)O 1458a_100000707227_200000210301 [0,1,0,0,1,0|1,0,0]=3 3438 B10R1.113 CC(=O)C1CCCN(C1)C 1458a_100015257587_200000210301 [0,1,0,0,1,0|2,0,0]=4 3439 B10R1.113 CC(=O)N1CCCC(C1)F 11a_100000697950_100015343762 [0,1,0,0,1,0|2,0,0]=4 3440 B10R1.113 CC(=O)N1CCCC(C1)F 1626a_100000697950_100015343762 [0,1,0,0,1,0|2,0,0]=4 3441 B10R1.113 CC(=O)N1CCCC(C1)F 240690a_100000697950_100015343762 [0,1,0,0,1,0|2,0,0]=4 3442 B10R1.113 CC(=O)N1CCCC(C1)F 527a_100000697950_100103153847 [0,1,0,0,1,0|2,0,0]=4 3443 B10R1.113 CC(=O)N1CCCC(C1)O 240690a_100000211013_100015343762 [0,1,0,0,1,0|2,0,0]=4 3444 B10R1.113 CC(=O)N1CCCC(C1)O 527a_100000211013_100103153847 [0,1,0,0,1,0|2,0,0]=4 3445 B10R1.113 CC(=O)N1CCC[C@@H](C1)C 11a_100000717927_100015343762 [0,1,0,0,1,0|2,0,0]=4 3446 B10R1.113 CC(=O)N1CCC[C@@H](C1)C 240690a_100000717927_100015343762 [0,1,0,0,1,0|2,0,0]=4 3447 B10R1.113 CC(=O)N1CCC[C@@H](C1)C 527a_100000717927_100103153847 [0,1,0,0,1,0|2,0,0]=4 3448 B10R1.113 CC1CCCC(C1)C(=O)[13CH3] 1458a_100011215569_200025704644 [0,1,0,0,1,0|1,0,0]=3 3449 B10R1.113 CN1CCCC(C1)C(=O)N 2230a_100000195536_200000210301 [0,1,0,0,1,0|2,0,0]=4 3450 B10R1.113 CN1CCCC(C1)C(=O)N 269982a_100000195536_200000210301 [0,1,0,0,1,0|2,0,0]=4 3451 B10R1.113 CN1CCCC(C1)C(=O)N 34a_100000195536_200000210301 [0,1,0,0,1,0|2,0,0]=4 3452 B10R1.113 CN1CCCC(C1)C(=O)[13CH3] 1458a_100015257587_200025704644 [0,1,0,0,1,0|2,0,0]=4 3453 B10R1.113 [13CH3]C(=O)C1CCCC(C1)O 1458a_100000707227_200025704644 [0,1,0,0,1,0|1,0,0]=3 3454 B10R1.113 [13CH3]N1CCCC(C1)C(=O)N 2230a_100000195536_200025704644 [0,1,0,0,1,0|2,0,0]=4 3455 B10R1.113 [13CH3]N1CCCC(C1)C(=O)N 269982a_100000195536_200025704644 [0,1,0,0,1,0|2,0,0]=4 3456 B10R1.113 [13CH3]N1CCCC(C1)C(=O)N 34a_100000195536_200025704644 [0,1,0,0,1,0|2,0,0]=4 3457 B10R1.363 CC(=O)C1(CCCCC1)C 1458a_100000762840_200000210301 [0,1,0,0,1,0|1,0,0]=3 3458 B10R1.363 CC(=O)C1(CCCCC1)F 1458a_100000069003_200000210301 [0,1,0,0,1,0|1,0,0]=3 3459 B10R1.363 CC(=O)C1(CCCCC1)O 1458a_100000242742_200000210301 [0,1,0,0,1,0|1,0,0]=3 3460 B10R1.363 CC(=O)C1(CCOCC1)C 1458a_100000749465_200000210301 [0,1,0,0,1,0|2,0,0]=4 3461 B10R1.363 CC(=O)C1(CCOCC1)F 1458a_100009845733_200000210301 [0,1,0,0,1,0|2,0,0]=4 3462 B10R1.363 CC(=O)C1(CCOCC1)O 1458a_100000751969_200000210301 [0,1,0,0,1,0|2,0,0]=4 3463 B10R1.363 CC1(CCCCC1)C(=O)[13CH3] 1458a_100000762840_200025704644 [0,1,0,0,1,0|1,0,0]=3 3464 B10R1.363 CC1(CCOCC1)C(=O)[13CH3] 1458a_100000749465_200025704644 [0,1,0,0,1,0|2,0,0]=4 3465 B10R1.363 [13CH3]C(=O)C1(CCCCC1)F 1458a_100000069003_200025704644 [0,1,0,0,1,0|1,0,0]=3 3466 B10R1.363 [13CH3]C(=O)C1(CCCCC1)O 1458a_100000242742_200025704644 [0,1,0,0,1,0|1,0,0]=3 3467 B10R1.363 [13CH3]C(=O)C1(CCOCC1)F 1458a_100009845733_200025704644 [0,1,0,0,1,0|2,0,0]=4 3468 B10R1.363 [13CH3]C(=O)C1(CCOCC1)O 1458a_100000751969_200025704644 [0,1,0,0,1,0|2,0,0]=4 3469 B10R1.23 CC(=O)C(C)N1CCCC1 1458a_100025750167_200000210301 [0,1,0,0,1,0|2,0,0]=4 3470 B10R1.23 CC(=O)C(C)N1CCCC1 2230a_100000188435_100009814033 [0,1,0,0,1,0|2,0,0]=4 3471 B10R1.23 CC(=O)C(C)N1CCCC1 269982a_100000188435_100009814033 [0,1,0,0,1,0|2,0,0]=4 3472 B10R1.23 CC(=O)N(C)C1CCCC1 11a_100000207505_100015343762 [0,1,0,0,1,0|2,0,0]=4 3473 B10R1.23 CC(=O)N(C)C1CCCC1 1626a_100000207505_100015343762 [0,1,0,0,1,0|2,0,0]=4 3474 B10R1.23 CC(=O)N(C)C1CCCC1 240690a_100000207505_100015343762 [0,1,0,0,1,0|2,0,0]=4 3475 B10R1.23 CC(=O)N(C)C1CCCC1 527a_100000207505_100103153847 [0,1,0,0,1,0|2,0,0]=4 3476 B10R1.23 CC(C(=O)N)N1CCCC1 2230a_100000188435_100000702099 [0,1,0,0,1,0|2,0,0]=4 3477 B10R1.23 CC(C(=O)N)N1CCCC1 269982a_100000188435_100000184083 [0,1,0,0,1,0|2,0,0]=4 3478 B10R1.23 CC(C(=O)[13CH3])N1CCCC1 1458a_100025750167_200025704644 [0,1,0,0,1,0|2,0,0]=4 3479 B10R1.23 NC(=O)C(F)N1CCCC1 2230a_100000188435_100009813875 [0,1,0,0,1,0|2,0,0]=4 3480 B10R1.23 NC(=O)C(F)N1CCCC1 269982a_100000188435_100009813875 [0,1,0,0,1,0|2,0,0]=4 3481 B10R1.27 C#CC(=O)CC1CCCC1 1458a_100000211873_100000740388 [0,1,0,0,1,0|1,0,0]=3 3482 B10R1.27 C#CC(=O)CC1CCCO1 1458a_100000211873_100000203698 [0,1,0,0,1,0|2,0,0]=4 3483 B10R1.27 C#CC(=O)CC1CCOC1 1458a_100000211873_100000702531 [0,1,0,0,1,0|2,0,0]=4 3484 B10R1.27 C=CC(=O)CC1CCCC1 1458a_100000185746_100000740388 [0,1,0,0,1,0|1,0,0]=3 3485 B10R1.27 C=CC(=O)CC1CCCO1 1458a_100000185746_100000203698 [0,1,0,0,1,0|2,0,0]=4 3486 B10R1.27 C=CC(=O)CC1CCOC1 1458a_100000185746_100000702531 [0,1,0,0,1,0|2,0,0]=4 3487 B10R1.27 C=CC(=O)NC1CCCC1 1626a_100000211070_100000185746 [0,1,0,0,1,0|2,0,0]=4 3488 B10R1.27 C=CC(=O)NC1CCCC1 240690a_100000211070_200121576911 [0,1,0,0,1,0|2,0,0]=4 3489 B10R1.27 CCC(=O)CC1CCCC1 1458a_100000210414_100000740388 [0,1,0,0,1,0|1,0,0]=3 3490 B10R1.27 CCC(=O)CC1CCCC1 1458a_100000210891_100000210202 [0,1,0,0,1,0|1,0,0]=3 3491 B10R1.27 CCC(=O)CC1CCCO1 1458a_100000210414_100000203698 [0,1,0,0,1,0|2,0,0]=4 3492 B10R1.27 CCC(=O)CC1CCOC1 1458a_100000210414_100000702531 [0,1,0,0,1,0|2,0,0]=4 3493 B10R1.27 CCC(=O)CC1CCOC1 1458a_100011218419_100000210202 [0,1,0,0,1,0|2,0,0]=4 3494 B10R1.27 CCC(=O)CN1CCCC1 1458a_100000740243_100000210202 [0,1,0,0,1,0|2,0,0]=4 3495 B10R1.27 CCC(=O)CN1CCCC1 269982a_100000188435_100000747405 [0,1,0,0,1,0|2,0,0]=4 3496 B10R1.27 CCC(=O)NC1CCCC1 11a_100000211070_100000210414 [0,1,0,0,1,0|2,0,0]=4 3497 B10R1.27 CCC(=O)NC1CCCC1 1626a_100000211070_100000210414 [0,1,0,0,1,0|2,0,0]=4 3498 B10R1.27 CCC(=O)NC1CCCC1 240690a_100000211070_100000210414 [0,1,0,0,1,0|2,0,0]=4 3499 B10R1.27 CCC(=O)NC1CCCC1 527a_100000211070_100000210414 [0,1,0,0,1,0|2,0,0]=4 3500 B10R1.27 CNC(=O)CC1CCCC1 11a_106832991635_100000210891 [0,1,0,0,1,0|1,0,0]=3 3501 B10R1.27 CNC(=O)CC1CCCC1 1626a_100102657272_100000210891 [0,1,0,0,1,0|1,0,0]=3 3502 B10R1.27 CNC(=O)CC1CCCC1 240690a_100102657272_100000210891 [0,1,0,0,1,0|1,0,0]=3 3503 B10R1.27 CNC(=O)CC1CCCC1 527a_100102657272_100000210891 [0,1,0,0,1,0|1,0,0]=3 3504 B10R1.27 CNC(=O)CC1CCOC1 11a_106832991635_100011218419 [0,1,0,0,1,0|2,0,0]=4 3505 B10R1.27 CNC(=O)CC1CCOC1 1626a_100102657272_100011218419 [0,1,0,0,1,0|2,0,0]=4 3506 B10R1.27 CNC(=O)CC1CCOC1 240690a_100102657272_100011218419 [0,1,0,0,1,0|2,0,0]=4 3507 B10R1.27 CNC(=O)CC1CCOC1 527a_100102657272_100011218419 [0,1,0,0,1,0|2,0,0]=4 3508 B10R1.27 CNC(=O)CN1CCCC1 2230a_100000188435_100000183359 [0,1,0,0,1,0|2,0,0]=4 3509 B10R1.27 CNC(=O)CN1CCCC1 240690a_100102657272_100000740243 [0,1,0,0,1,0|2,0,0]=4 3510 B10R1.27 CNC(=O)CN1CCCC1 269982a_100000188435_100000183359 [0,1,0,0,1,0|2,0,0]=4 3511 B10R1.27 CNC(=O)CN1CCCC1 527a_100102657272_100000740243 [0,1,0,0,1,0|2,0,0]=4 3512 B10R1.27 CNC(=O)NC1CCCC1 2708a_100000211070_106832991635 [0,1,0,0,1,0|2,0,0]=4 3513 B10R1.27 CNC(=O)NC1CCCC1 2708a_100102657272_100000211070 [0,1,0,0,1,0|2,0,0]=4 3514 B10R1.27 CNC(=O)NC1CCCC1 273464a_100000211070_100102657272 [0,1,0,0,1,0|2,0,0]=4 3515 B10R1.27 CNC(=O)NC1CCCC1 273464a_100102657272_100000211070 [0,1,0,0,1,0|2,0,0]=4 3516 B10R1.27 CNC(=O)NC1CCCC1 512a_100000211070_100102657272 [0,1,0,0,1,0|2,0,0]=4 3517 B10R1.27 CNC(=O)NC1CCCC1 512a_106832991638_100000211070 [0,1,0,0,1,0|2,0,0]=4 3518 B10R1.27 COC(=O)CN1CCCC1 2230a_100000188435_100000747449 [0,1,0,0,1,0|1,0,0]=3 3519 B10R1.27 COC(=O)CN1CCCC1 269982a_100000188435_100000747449 [0,1,0,0,1,0|1,0,0]=3 3520 B10R1.27 COC(=O)CN1CCSC1 2230a_100011215254_100000747449 [0,1,0,0,1,0|2,0,0]=4 3521 B10R1.27 COC(=O)CN1CCSC1 269982a_100011215254_100000747449 [0,1,0,0,1,0|2,0,0]=4 3522 B10R1.27 O=C(CF)CC1CCCC1 1458a_100000210891_100015361967 [0,1,0,0,1,0|1,0,0]=3 3523 B10R1.27 O=C(CF)CC1CCOC1 1458a_100011218419_100015361967 [0,1,0,0,1,0|2,0,0]=4 3524 B10R1.27 O=C(CF)CN1CCCC1 1458a_100000740243_100015361967 [0,1,0,0,1,0|2,0,0]=4 3525 B10R1.27 O=C(CO)CC1CCCC1 1458a_100000210174_100000740388 [0,1,0,0,1,0|0,0,0]=2 3526 B10R1.27 O=C(CO)CC1CCCO1 1458a_100000210174_100000203698 [0,1,0,0,1,0|1,0,0]=3 3527 B10R1.27 O=C(CO)CC1CCOC1 1458a_100000210174_100000702531 [0,1,0,0,1,0|1,0,0]=3 3528 B10R1.27 O=C(CO)CC1OCCO1 1458a_100000210174_100000755774 [0,1,0,0,1,0|2,0,0]=4 3529 B10R1.27 O=C(CO)NC1CCCC1 240690a_100000211070_100000210174 [0,1,0,0,1,0|1,0,0]=3 3530 B10R1.27 O=C(CO)NC1CCCC1 527a_100000211070_100000210174 [0,1,0,0,1,0|1,0,0]=3 3531 B10R1.27 O=C(CO)N[C@@H]1CCOC1 240690a_200015188469_100000210174 [0,1,0,0,1,0|2,0,0]=4 3532 B10R1.27 O=C(CO)N[C@@H]1CCOC1 527a_200015188469_100000210174 [0,1,0,0,1,0|2,0,0]=4 3533 B10R1.27 O=C(CO)N[C@H]1CCOC1 240690a_100015188467_100000210174 [0,1,0,0,1,0|2,0,0]=4 3534 B10R1.27 O=C(CO)N[C@H]1CCOC1 527a_100015188467_100000210174 [0,1,0,0,1,0|2,0,0]=4 3535 B10R1.54 CC(=O)CC1CCN(C1)C 1458a_100000070787_200000690779 [0,1,0,0,1,0|2,0,0]=4 3536 B10R1.54 CC(=O)N[C@H]1CC[C@H](C1)O 1626a_100015195300_100015343762 [0,1,0,0,1,0|2,0,0]=4 3537 B10R1.54 CC(=O)N[C@H]1CC[C@H](C1)O 240690a_100015195300_100015343762 [0,1,0,0,1,0|2,0,0]=4 3538 B10R1.54 CN1CCC(C1)CC(=O)O 269956a_100000719201_200000210301 [0,1,0,0,1,0|1,0,0]=3 3539 B10R1.54 C[C@@H]1CCN(C1)CC(=O)N 2230a_100016987628_100000747473 [0,1,0,0,1,0|2,0,0]=4 3540 B10R1.54 C[C@@H]1CCN(C1)CC(=O)N 269982a_100016987628_100000187820 [0,1,0,0,1,0|2,0,0]=4 3541 B10R1.54 C[C@@H]1CCN(C1)CC(=O)N 34a_100016987628_100000187820 [0,1,0,0,1,0|2,0,0]=4 3542 B10R1.54 C[C@@H]1CCN(C1)CC(=O)[O-] 269982a_100016987628_100020667443 [0,1,0,0,1,0|1,0,1]=4 3543 B10R1.54 C[C@@H]1CCN(C1)CC(=O)[O-] 34a_100016987628_100020667443 [0,1,0,0,1,0|1,0,1]=4 3544 B10R1.54 NC(=O)CN1CCC(C1)O 2230a_100011215560_100000747473 [0,1,0,0,1,0|2,0,0]=4 3545 B10R1.54 NC(=O)CN1CCC(C1)O 269982a_100011215560_100000187820 [0,1,0,0,1,0|2,0,0]=4 3546 B10R1.54 NC(=O)CN1CC[C@@H](C1)F 2230a_100015203821_100000747473 [0,1,0,0,1,0|2,0,0]=4 3547 B10R1.54 NC(=O)CN1CC[C@@H](C1)F 269982a_100015203821_100000187820 [0,1,0,0,1,0|2,0,0]=4 3548 B10R1.54 NC(=O)CN1CC[C@@H](C1)F 34a_100015203821_100000187820 [0,1,0,0,1,0|2,0,0]=4 3549 B10R1.54 O=C([O-])CN1CCC(C1)O 269982a_100011215560_100020667443 [0,1,0,0,1,0|1,0,1]=4 3550 B10R1.54 O=C([O-])CN1CC[C@@H](C1)F 269982a_100015203821_100020667443 [0,1,0,0,1,0|1,0,1]=4 3551 B10R1.54 O=C([O-])CN1CC[C@@H](C1)F 34a_100015203821_100020667443 [0,1,0,0,1,0|1,0,1]=4 3552 B10R1.54 [13CH3]N1CCC(C1)CC(=O)O 269956a_100000719201_200025704644 [0,1,0,0,1,0|1,0,0]=3 3553 B10R1.64 CC(=O)N[C@H]1CCC[C@@H]1O 11a_100000748460_100015343762 [0,1,0,0,1,0|2,0,0]=4 3554 B10R1.64 CC(=O)N[C@H]1CCC[C@@H]1O 240690a_100000748460_100015343762 [0,1,0,0,1,0|2,0,0]=4 3555 B10R1.64 C[C@@H]1CCCN1CC(=O)N 2230a_100015189458_100000747473 [0,1,0,0,1,0|2,0,0]=4 3556 B10R1.64 C[C@@H]1CCCN1CC(=O)N 269982a_100015189458_100000187820 [0,1,0,0,1,0|2,0,0]=4 3557 B10R1.64 C[C@@H]1CCCN1CC(=O)N 34a_100015189458_100000187820 [0,1,0,0,1,0|2,0,0]=4 3558 B10R1.64 C[C@@H]1CCCN1CC(=O)[O-] 269982a_100015189458_100020667443 [0,1,0,0,1,0|1,0,1]=4 3559 B10R1.64 C[C@@H]1CCCN1CC(=O)[O-] 34a_100015189458_100020667443 [0,1,0,0,1,0|1,0,1]=4 3560 B10R1.64 C[C@H]1CCCN1CC(=O)N 2230a_100020605311_100000747473 [0,1,0,0,1,0|2,0,0]=4 3561 B10R1.64 C[C@H]1CCCN1CC(=O)N 269982a_100020605311_100000187820 [0,1,0,0,1,0|2,0,0]=4 3562 B10R1.64 C[C@H]1CCCN1CC(=O)[O-] 269982a_100020605311_100020667443 [0,1,0,0,1,0|1,0,1]=4 3563 B12R1.21 C=C(C)CN[C@H]1CC[C@@H](CC1)C 2230a_100020625639_100000748629 [0,1,0,0,0,1|2,0,0]=4 3564 B12R1.21 C=C(C)CN[C@H]1CC[C@@H](CC1)C 34a_100020625639_100000748629 [0,1,0,0,0,1|2,0,0]=4 3565 B12R1.21 C=C(C)COC1CCC(CC1)C 34a_100000210245_200011216234 [0,1,0,0,0,1|2,0,0]=4 3566 B12R1.21 C=C(C)COC1CCC(CC1)C 34a_100000210714_100000748629 [0,1,0,0,0,1|2,0,0]=4 3567 B12R1.21 C=C(C)COC1CCC(CC1)C 7a_100000210714_100000748629 [0,1,0,0,0,1|2,0,0]=4 3568 B12R1.21 C=C(C)CO[C@H]1CC[C@H](CC1)N 34a_100020628982_100000748629 [0,1,0,0,0,1|2,0,0]=4 3569 B12R1.21 C=C(C)CSC1CCC(CC1)C 62a_100000748629_200011216234 [0,1,0,0,0,1|2,0,0]=4 3570 B12R1.21 C=C(F)CN[C@H]1CC[C@@H](CC1)C 2230a_100020625639_100009893438 [0,1,0,0,0,1|2,0,0]=4 3571 B12R1.21 C=C(F)CN[C@H]1CC[C@@H](CC1)C 34a_100020625639_100009893438 [0,1,0,0,0,1|2,0,0]=4 3572 B12R1.21 C=C(F)COC1CCC(CC1)C 34a_100000210714_100009893438 [0,1,0,0,0,1|2,0,0]=4 3573 B12R1.21 C=C(F)COC1CCC(CC1)C 34a_200010262243_200011216234 [0,1,0,0,0,1|2,0,0]=4 3574 B12R1.21 C=C(F)COC1CCC(CC1)C 7a_100000210714_100000042424 [0,1,0,0,0,1|2,0,0]=4 3575 B12R1.21 C=C(F)CO[C@H]1CC[C@H](CC1)N 34a_100020628982_100009893438 [0,1,0,0,0,1|2,0,0]=4 3576 B12R1.21 C=C(F)CSC1CCC(CC1)C 62a_100000042424_200011216234 [0,1,0,0,0,1|2,0,0]=4 3577 B12R1.21 CC(=O)CCN1CCC(CC1)C 1458a_100000740328_200000210301 [0,1,0,0,0,1|2,0,0]=4 3578 B12R1.21 CC(=O)CCN1CCC(CC1)C 269982a_100000188429_100000053229 [0,1,0,0,0,1|2,0,0]=4 3579 B12R1.21 CC(=O)CCN1CCC(CC1)F 269982a_100015193889_100000053229 [0,1,0,0,0,1|2,0,0]=4 3580 B12R1.21 CC(=O)CCN1CCC(CC1)O 269982a_100025773856_100000053229 [0,1,0,0,0,1|2,0,0]=4 3581 B12R1.21 CC(=O)COC1CCC(CC1)C 34a_100000211253_200011216234 [0,1,0,0,0,1|1,0,0]=3 3582 B12R1.21 CC(=O)NCC1CCC(CC1)C 11a_103436935547_100015343762 [0,1,0,0,0,1|1,0,0]=3 3583 B12R1.21 CC(=O)NCC1CCC(CC1)C 1626a_103436935547_100015343762 [0,1,0,0,0,1|1,0,0]=3 3584 B12R1.21 CC(=O)NCC1CCC(CC1)C 240690a_103436935547_100015343762 [0,1,0,0,0,1|1,0,0]=3 3585 B12R1.21 CC(=O)NCC1CCC(CC1)C 527a_103436935547_100103153847 [0,1,0,0,0,1|1,0,0]=3 3586 B12R1.21 CC(=O)NCC1CCN(CC1)C 2230a_100011206997_200000210301 [0,1,0,0,0,1|2,0,0]=4 3587 B12R1.21 CC(=O)NCC1CCN(CC1)C 240690a_100000746316_100015343762 [0,1,0,0,0,1|2,0,0]=4 3588 B12R1.21 CC(=O)NCC1CCN(CC1)C 269982a_100011206997_200000210301 [0,1,0,0,0,1|2,0,0]=4 3589 B12R1.21 CC(=O)NCC1CCN(CC1)C 34a_100011206997_200000210301 [0,1,0,0,0,1|2,0,0]=4 3590 B12R1.21 CC(=O)NCC1CCN(CC1)C 527a_100000746316_100103153847 [0,1,0,0,0,1|2,0,0]=4 3591 B12R1.21 CC(=O)NCC1CCN(CC1)[13CH3] 2230a_100011206997_200025704644 [0,1,0,0,0,1|2,0,0]=4 3592 B12R1.21 CC(=O)NCC1CCN(CC1)[13CH3] 269982a_100011206997_200025704644 [0,1,0,0,0,1|2,0,0]=4 3593 B12R1.21 CC(=O)NCC1CCN(CC1)[13CH3] 34a_100011206997_200025704644 [0,1,0,0,0,1|2,0,0]=4 3594 B12R1.21 CC(=O)OCC1CCN(CC1)C 2230a_100025751628_200000210301 [0,1,0,0,0,1|2,0,0]=4 3595 B12R1.21 CC(=O)OCC1CCN(CC1)C 269982a_100025751628_200000210301 [0,1,0,0,0,1|2,0,0]=4 3596 B12R1.21 CC(=O)OCC1CCN(CC1)[13CH3] 2230a_100025751628_200025704644 [0,1,0,0,0,1|2,0,0]=4 3597 B12R1.21 CC(=O)OCC1CCN(CC1)[13CH3] 269982a_100025751628_200025704644 [0,1,0,0,0,1|2,0,0]=4 3598 B12R1.21 CC(=O)OCN1CCC(CC1)C 269982a_100000188429_100000076356 [0,1,0,0,0,1|2,0,0]=4 3599 B12R1.21 CC(=O)OCN1CCC(CC1)C 34a_100000188429_100009813279 [0,1,0,0,0,1|2,0,0]=4 3600 B12R1.21 CC(=O)OCN1CCC(CC1)F 269982a_100015193889_100000076356 [0,1,0,0,0,1|2,0,0]=4 3601 B12R1.21 CC(=O)OCN1CCC(CC1)F 34a_100015193889_100009813279 [0,1,0,0,0,1|2,0,0]=4 3602 B12R1.21 CC(=O)OCN1CCC(CC1)O 269982a_100025773856_100000076356 [0,1,0,0,0,1|2,0,0]=4 3603 B12R1.21 CC(O)CNC1CCC(CC1)C 270004a_100000210904_100000185489 [0,1,0,0,0,1|1,0,1]=4 3604 B12R1.21 CC(O)CNC1CCC(CC1)C 34a_100000210904_200011216234 [0,1,0,0,0,1|1,0,1]=4 3605 B12R1.21 CC(O)CNC1CCC(CC1)O 270004a_100000210904_100000764474 [0,1,0,0,0,1|1,0,1]=4 3606 B12R1.21 CC(O)CN[C@H]1CC[C@@H](CC1)C 2230a_100020625639_100011218427 [0,1,0,0,0,1|1,0,1]=4 3607 B12R1.21 CC(O)CN[C@H]1CC[C@@H](CC1)C 34a_100020625639_100011218427 [0,1,0,0,0,1|1,0,1]=4 3608 B12R1.21 CC(O)COC1CCC(CC1)C 34a_100000210714_100011218427 [0,1,0,0,0,1|1,0,1]=4 3609 B12R1.21 CC(O)COC1CCC(CC1)C 7a_100000210714_100011218427 [0,1,0,0,0,1|1,0,1]=4 3610 B12R1.21 CC(O)CO[C@H]1CC[C@H](CC1)N 34a_100020628982_100011218427 [0,1,0,0,0,1|1,0,1]=4 3611 B12R1.21 CC(O)CSC1CCC(CC1)C 62a_100011218427_200011216234 [0,1,0,0,0,1|1,0,1]=4 3612 B12R1.21 CC1CCC(CC1)NCC(=O)O 269956a_100016091260_200011216234 [0,1,0,0,0,1|0,0,0]=2 3613 B12R1.21 CC1CCC(CC1)OCC(=O)N 34a_100000210714_100000187820 [0,1,0,0,0,1|1,0,0]=3 3614 B12R1.21 CC1CCC(CC1)OCC(=O)N 7a_100000210714_100000187820 [0,1,0,0,0,1|1,0,0]=3 3615 B12R1.21 CC1CCC(CC1)OCC(=O)[O-] 34a_100000210714_100020667443 [0,1,0,0,0,1|0,0,1]=3 3616 B12R1.21 CC1CCC(CC1)OC[C@@H](C)O 34a_100000210714_100009817552 [0,1,0,0,0,1|1,0,1]=4 3617 B12R1.21 CC1CCC(CC1)OC[C@@H](C)O 7a_100000210714_100009817552 [0,1,0,0,0,1|1,0,1]=4 3618 B12R1.21 CC1CCC(CC1)OC[N+](=O)[O-] 34a_100000210714_100000761209 [0,1,0,0,0,1|1,0,1]=4 3619 B12R1.21 CC1CCC(CC1)SCC(=O)N 62a_100000747473_200011216234 [0,1,0,0,0,1|1,0,0]=3 3620 B12R1.21 CC1CCC(CC1)SCC(=O)[O-] 62a_100020667443_200011216234 [0,1,0,0,0,1|0,0,1]=3 3621 B12R1.21 CC1CCC(CC1)SC[C@@H](C)O 62a_100009817552_200011216234 [0,1,0,0,0,1|1,0,1]=4 3622 B12R1.21 CC1CCN(CC1)CCC(=O)N 2230a_100000188429_100000744528 [0,1,0,0,0,1|2,0,0]=4 3623 B12R1.21 CC1CCN(CC1)CCC(=O)N 269982a_100000188429_100000744528 [0,1,0,0,0,1|2,0,0]=4 3624 B12R1.21 CC1CCN(CC1)CCC(=O)N 34a_100000188429_100000731001 [0,1,0,0,0,1|2,0,0]=4 3625 B12R1.21 CC1CCN(CC1)CCC(=O)[13CH3] 1458a_100000740328_200025704644 [0,1,0,0,0,1|2,0,0]=4 3626 B12R1.21 CN1CCC(CC1)CCC(=O)N 2230a_100015183425_200000210301 [0,1,0,0,0,1|2,0,0]=4 3627 B12R1.21 CN1CCC(CC1)CCC(=O)N 34a_100015183425_200000210301 [0,1,0,0,0,1|2,0,0]=4 3628 B12R1.21 CN1CCC(CC1)NCC(=O)O 269956a_100016091260_100011215917 [0,1,0,0,0,1|1,0,0]=3 3629 B12R1.21 CN1CCC(CC1)OCC(=O)N 2230a_100000765839_200000210301 [0,1,0,0,0,1|2,0,0]=4 3630 B12R1.21 CN1CCC(CC1)OCC(=O)N 269982a_100000765839_200000210301 [0,1,0,0,0,1|2,0,0]=4 3631 B12R1.21 CN1CCC(CC1)OCC(=O)N 34a_100000765839_200000210301 [0,1,0,0,0,1|2,0,0]=4 3632 B12R1.21 CN1CCC(CC1)SCC(=O)N 62a_100000747473_100011215917 [0,1,0,0,0,1|2,0,0]=4 3633 B12R1.21 CN1CCC(CC1)SCC(=O)[O-] 62a_100020667443_100011215917 [0,1,0,0,0,1|1,0,1]=4 3634 B12R1.21 C[C@@H](O)CN[C@H]1CC[C@@H](CC1)C 2230a_100020625639_100009817552 [0,1,0,0,0,1|1,0,1]=4 3635 B12R1.21 C[C@@H](O)CN[C@H]1CC[C@@H](CC1)C 34a_100020625639_100009817552 [0,1,0,0,0,1|1,0,1]=4 3636 B12R1.21 C[C@@H](O)CO[C@H]1CC[C@H](CC1)N 34a_100020628982_100009817552 [0,1,0,0,0,1|1,0,1]=4 3637 B12R1.21 C[C@H]1CC[C@@H](CC1)NCC(=O)N 2230a_100020625639_100000747473 [0,1,0,0,0,1|1,0,0]=3 3638 B12R1.21 C[C@H]1CC[C@@H](CC1)NCC(=O)N 34a_100020625639_100000187820 [0,1,0,0,0,1|1,0,0]=3 3639 B12R1.21 C[C@H]1CC[C@@H](CC1)NCC(=O)[O-] 34a_100020625639_100020667443 [0,1,0,0,0,1|0,0,1]=3 3640 B12R1.21 C[C@H]1CC[C@@H](CC1)NC[N+](=O)[O-] 34a_100020625639_100000761209 [0,1,0,0,0,1|1,0,1]=4 3641 B12R1.21 NC(=O)CCN1CCC(CC1)F 2230a_100015193889_100000744528 [0,1,0,0,0,1|2,0,0]=4 3642 B12R1.21 NC(=O)CCN1CCC(CC1)F 269982a_100015193889_100000744528 [0,1,0,0,0,1|2,0,0]=4 3643 B12R1.21 NC(=O)CCN1CCC(CC1)F 34a_100015193889_100000731001 [0,1,0,0,0,1|2,0,0]=4 3644 B12R1.21 NC(=O)CCN1CCC(CC1)O 2230a_100025773856_100000744528 [0,1,0,0,0,1|2,0,0]=4 3645 B12R1.21 NC(=O)CCN1CCC(CC1)O 269982a_100025773856_100000744528 [0,1,0,0,0,1|2,0,0]=4 3646 B12R1.21 NC(=O)COC1CCC(=O)CC1 34a_100000764474_100000187820 [0,1,0,0,0,1|1,0,1]=4 3647 B12R1.21 NC(=O)COC1CCC(=O)CC1 7a_100000764474_100000187820 [0,1,0,0,0,1|1,0,1]=4 3648 B12R1.21 NC(=O)CO[C@H]1CC[C@H](CC1)N 34a_100020628982_100000187820 [0,1,0,0,0,1|1,0,0]=3 3649 B12R1.21 N[C@H]1CC[C@H](CC1)OCC(=O)[O-] 34a_100020628982_100020667443 [0,1,0,0,0,1|0,0,1]=3 3650 B12R1.21 N[C@H]1CC[C@H](CC1)OC[N+](=O)[O-] 34a_100020628982_100000761209 [0,1,0,0,0,1|1,0,1]=4 3651 B12R1.21 O=C([O-])COC1CCC(=O)CC1 34a_100000764474_100020667443 [0,1,0,0,0,1|0,0,2]=4 3652 B12R1.21 [13CH3]N1CCC(CC1)CCC(=O)N 2230a_100015183425_200025704644 [0,1,0,0,0,1|2,0,0]=4 3653 B12R1.21 [13CH3]N1CCC(CC1)CCC(=O)N 34a_100015183425_200025704644 [0,1,0,0,0,1|2,0,0]=4 3654 B12R1.21 [13CH3]N1CCC(CC1)OCC(=O)N 2230a_100000765839_200025704644 [0,1,0,0,0,1|2,0,0]=4 3655 B12R1.21 [13CH3]N1CCC(CC1)OCC(=O)N 269982a_100000765839_200025704644 [0,1,0,0,0,1|2,0,0]=4 3656 B12R1.21 [13CH3]N1CCC(CC1)OCC(=O)N 34a_100000765839_200025704644 [0,1,0,0,0,1|2,0,0]=4 3657 B12R1.27 C#CC(=O)CCC1CCCCC1 1458a_100000211873_100011273959 [0,1,0,0,0,1|1,0,0]=3 3658 B12R1.27 C#CC(=O)CCC1CCOCC1 1458a_100000211873_100011934994 [0,1,0,0,0,1|2,0,0]=4 3659 B12R1.27 C#CC(=O)CCN1CCCCC1 1458a_100000211873_100000739454 [0,1,0,0,0,1|2,0,0]=4 3660 B12R1.27 C#CC(=O)COC1CCCCC1 1458a_100000211873_100011935260 [0,1,0,0,0,1|1,0,0]=3 3661 B12R1.27 C=C(C#N)CNC1CCCCC1 2230a_100000182618_100000694840 [0,1,0,0,0,1|2,0,0]=4 3662 B12R1.27 C=C(C#N)CNC1CCCCC1 34a_100000182618_100000694840 [0,1,0,0,0,1|2,0,0]=4 3663 B12R1.27 C=C(C#N)COC1CCCCC1 34a_100000210231_100000694840 [0,1,0,0,0,1|2,0,0]=4 3664 B12R1.27 C=C(C#N)CSC1CCCCC1 62a_100000210327_100000694840 [0,1,0,0,0,1|2,0,0]=4 3665 B12R1.27 C=CC(=O)CCC1CCCCC1 1458a_100000185746_100011273959 [0,1,0,0,0,1|1,0,0]=3 3666 B12R1.27 C=CC(=O)CCC1CCOCC1 1458a_100000185746_100011934994 [0,1,0,0,0,1|2,0,0]=4 3667 B12R1.27 C=CC(=O)CCN1CCCCC1 1458a_100000185746_100000739454 [0,1,0,0,0,1|2,0,0]=4 3668 B12R1.27 C=CC(=O)COC1CCCCC1 1458a_100000185746_100011935260 [0,1,0,0,0,1|1,0,0]=3 3669 B12R1.27 C=CC(=O)NCC1CCCCC1 1626a_100000210473_100000185746 [0,1,0,0,0,1|1,0,0]=3 3670 B12R1.27 C=CC(=O)NCC1CCCCC1 240690a_100000210473_200121576911 [0,1,0,0,0,1|1,0,0]=3 3671 B12R1.27 C=CC(=O)NCC1CCCCO1 1626a_100000174945_100000185746 [0,1,0,0,0,1|2,0,0]=4 3672 B12R1.27 C=CC(=O)NCC1CCCCO1 240690a_100000174945_200121576911 [0,1,0,0,0,1|2,0,0]=4 3673 B12R1.27 C=CC(=O)NCC1CCCOC1 1626a_100000720124_100000185746 [0,1,0,0,0,1|2,0,0]=4 3674 B12R1.27 C=CC(=O)NCC1CCCOC1 240690a_100000720124_200121576911 [0,1,0,0,0,1|2,0,0]=4 3675 B12R1.27 C=CC(=O)NCC1CCOCC1 1626a_100000746373_100000185746 [0,1,0,0,0,1|2,0,0]=4 3676 B12R1.27 C=CC(=O)NCC1CCOCC1 240690a_100000746373_200121576911 [0,1,0,0,0,1|2,0,0]=4 3677 B12R1.27 C=CC(=O)NCC1CCSCC1 240690a_100015188806_200121576911 [0,1,0,0,0,1|2,0,0]=4 3678 B12R1.27 C=CC(=O)NNC1CCCCC1 22a_100000709804_100000185746 [0,1,0,0,0,1|2,0,0]=4 3679 B12R1.27 C=CC(O)CNC1CCCCC1 2230a_100000182618_100000730141 [0,1,0,0,0,1|1,0,1]=4 3680 B12R1.27 C=CC(O)CNC1CCCCC1 34a_100000182618_100000730141 [0,1,0,0,0,1|1,0,1]=4 3681 B12R1.27 C=CC(O)COC1CCCCC1 34a_100000210231_100000730141 [0,1,0,0,0,1|1,0,1]=4 3682 B12R1.27 C=CC(O)COC1CCCCC1 7a_100000210231_100000730141 [0,1,0,0,0,1|1,0,1]=4 3683 B12R1.27 C=CC(O)CSC1CCCCC1 62a_100000210327_100000730141 [0,1,0,0,0,1|1,0,1]=4 3684 B12R1.27 C=CC(O)CSC1CCCCC1 62a_100000730141_100000210327 [0,1,0,0,0,1|1,0,1]=4 3685 B12R1.27 CC(=NNC1CCCCC1)CO 4a_100000709804_100000211253 [0,1,0,0,0,1|2,0,0]=4 3686 B12R1.27 CC(CNC1CCCCC1)O[13CH3] 34a_100000202029_200025704644 [0,1,0,0,0,1|1,0,1]=4 3687 B12R1.27 CC(CO)CNC1CCCCC1 34a_100000744482_100000210327 [0,1,0,0,0,1|1,0,1]=4 3688 B12R1.27 CC(CO)NCC1CCCCC1 2230a_100000210473_100012180447 [0,1,0,0,0,1|1,0,1]=4 3689 B12R1.27 CC(CO)NCC1CCCCC1 34a_100000210473_100012180447 [0,1,0,0,0,1|1,0,1]=4 3690 B12R1.27 CC(CO)OCC1CCCCC1 34a_100000212181_100012180447 [0,1,0,0,0,1|1,0,1]=4 3691 B12R1.27 CC(CO)OCC1CCCCC1 7a_100000212181_100012180447 [0,1,0,0,0,1|1,0,1]=4 3692 B12R1.27 CC(CO)SCC1CCCCC1 62a_100012180447_100000211423 [0,1,0,0,0,1|1,0,1]=4 3693 B12R1.27 CCC(=O)C=CC1CCCCC1 1458a_100102566626_100000210202 [0,1,0,0,0,1|1,0,1]=4 3694 B12R1.27 CCC(=O)CCC1CCCCC1 1458a_100000210414_100011273959 [0,1,0,0,0,1|1,0,0]=3 3695 B12R1.27 CCC(=O)CCC1CCCCC1 1458a_100000211375_100000210202 [0,1,0,0,0,1|1,0,0]=3 3696 B12R1.27 CCC(=O)CCC1CCOCC1 1458a_100000210414_100011934994 [0,1,0,0,0,1|2,0,0]=4 3697 B12R1.27 CCC(=O)CCN1CCCCC1 1458a_100000210414_100000739454 [0,1,0,0,0,1|2,0,0]=4 3698 B12R1.27 CCC(=O)CCN1CCCCC1 1458a_100000743487_100000210202 [0,1,0,0,0,1|2,0,0]=4 3699 B12R1.27 CCC(=O)COC1CCCCC1 1458a_100000210414_100011935260 [0,1,0,0,0,1|1,0,0]=3 3700 B12R1.27 CCC(=O)COC1CCCCC1 1458a_100011223303_100000210202 [0,1,0,0,0,1|1,0,0]=3 3701 B12R1.27 CCC(=O)COC1CCCCC1 34a_100000725409_100000210327 [0,1,0,0,0,1|1,0,0]=3 3702 B12R1.27 CCC(=O)COC1CCCCC1 7a_100000210231_100000747405 [0,1,0,0,0,1|1,0,0]=3 3703 B12R1.27 CCC(=O)COC1CCCOC1 34a_100000725409_100000693364 [0,1,0,0,0,1|2,0,0]=4 3704 B12R1.27 CCC(=O)COC1CCCSC1 7a_100015962668_100000747405 [0,1,0,0,0,1|2,0,0]=4 3705 B12R1.27 CCC(=O)COC1CCSCC1 34a_100000725409_100000069128 [0,1,0,0,0,1|2,0,0]=4 3706 B12R1.27 CCC(=O)COC1CCSCC1 7a_100000731022_100000747405 [0,1,0,0,0,1|2,0,0]=4 3707 B12R1.27 CCC(=O)CSC1CCCCC1 62a_100000210327_100000747405 [0,1,0,0,0,1|1,0,0]=3 3708 B12R1.27 CCC(=O)CSC1CCCCC1 62a_100000747405_100000210327 [0,1,0,0,0,1|1,0,0]=3 3709 B12R1.27 CCC(=O)CSC1CCCOC1 62a_100000747405_100000693364 [0,1,0,0,0,1|2,0,0]=4 3710 B12R1.27 CCC(=O)CSC1CCOCC1 62a_100000747405_100011324220 [0,1,0,0,0,1|2,0,0]=4 3711 B12R1.27 CCC(=O)CSC1CCSCC1 62a_100000747405_100000069128 [0,1,0,0,0,1|2,0,0]=4 3712 B12R1.27 CCC(=O)NCC1CCCCC1 11a_100000210473_100000210414 [0,1,0,0,0,1|1,0,0]=3 3713 B12R1.27 CCC(=O)NCC1CCCCC1 1626a_100000210473_100000210414 [0,1,0,0,0,1|1,0,0]=3 3714 B12R1.27 CCC(=O)NCC1CCCCC1 240690a_100000210473_100000210414 [0,1,0,0,0,1|1,0,0]=3 3715 B12R1.27 CCC(=O)NCC1CCCCC1 527a_100000210473_100000210414 [0,1,0,0,0,1|1,0,0]=3 3716 B12R1.27 CCC(=O)NCC1CCCCO1 11a_100000174945_100000210414 [0,1,0,0,0,1|2,0,0]=4 3717 B12R1.27 CCC(=O)NCC1CCCCO1 1626a_100000174945_100000210414 [0,1,0,0,0,1|2,0,0]=4 3718 B12R1.27 CCC(=O)NCC1CCCCO1 240690a_100000174945_100000210414 [0,1,0,0,0,1|2,0,0]=4 3719 B12R1.27 CCC(=O)NCC1CCCCO1 527a_100000174945_100000210414 [0,1,0,0,0,1|2,0,0]=4 3720 B12R1.27 CCC(=O)NCC1CCCOC1 11a_100000720124_100000210414 [0,1,0,0,0,1|2,0,0]=4 3721 B12R1.27 CCC(=O)NCC1CCCOC1 1626a_100000720124_100000210414 [0,1,0,0,0,1|2,0,0]=4 3722 B12R1.27 CCC(=O)NCC1CCCOC1 240690a_100000720124_100000210414 [0,1,0,0,0,1|2,0,0]=4 3723 B12R1.27 CCC(=O)NCC1CCCOC1 527a_100000720124_100000210414 [0,1,0,0,0,1|2,0,0]=4 3724 B12R1.27 CCC(=O)NCC1CCOCC1 11a_100000746373_100000210414 [0,1,0,0,0,1|2,0,0]=4 3725 B12R1.27 CCC(=O)NCC1CCOCC1 1626a_100000746373_100000210414 [0,1,0,0,0,1|2,0,0]=4 3726 B12R1.27 CCC(=O)NCC1CCOCC1 240690a_100000746373_100000210414 [0,1,0,0,0,1|2,0,0]=4 3727 B12R1.27 CCC(=O)NCC1CCOCC1 527a_100000746373_100000210414 [0,1,0,0,0,1|2,0,0]=4 3728 B12R1.27 CCC(=O)NCC1CCSCC1 11a_100015188806_100000210414 [0,1,0,0,0,1|2,0,0]=4 3729 B12R1.27 CCC(=O)NCC1CCSCC1 240690a_100015188806_100000210414 [0,1,0,0,0,1|2,0,0]=4 3730 B12R1.27 CCC(=O)NCC1CCSCC1 527a_100015188806_100000210414 [0,1,0,0,0,1|2,0,0]=4 3731 B12R1.27 CCC(=O)NNC1CCCCC1 22a_100000709804_100000210414 [0,1,0,0,0,1|2,0,0]=4 3732 B12R1.27 CCC(O)CNC1CCCCC1 2230a_100000182618_100011218378 [0,1,0,0,0,1|1,0,1]=4 3733 B12R1.27 CCC(O)CNC1CCCCC1 270004a_100011218483_100000210434 [0,1,0,0,0,1|1,0,1]=4 3734 B12R1.27 CCC(O)CNC1CCCCC1 34a_100000182618_100011218378 [0,1,0,0,0,1|1,0,1]=4 3735 B12R1.27 CCC(O)COC1CCCCC1 34a_100000210231_100011218378 [0,1,0,0,0,1|1,0,1]=4 3736 B12R1.27 CCC(O)COC1CCCCC1 7a_100000210231_100011218378 [0,1,0,0,0,1|1,0,1]=4 3737 B12R1.27 CCC(O)CSC1CCCCC1 62a_100000210327_100011218378 [0,1,0,0,0,1|1,0,1]=4 3738 B12R1.27 CCC(O)CSC1CCCCC1 62a_100011218378_100000210327 [0,1,0,0,0,1|1,0,1]=4 3739 B12R1.27 CNC(=O)C=CC1CCCCC1 11a_106832991635_100102566626 [0,1,0,0,0,1|1,0,1]=4 3740 B12R1.27 CNC(=O)C=CC1CCCCC1 1626a_100102657272_100102566626 [0,1,0,0,0,1|1,0,1]=4 3741 B12R1.27 CNC(=O)C=CC1CCCCC1 240690a_100102657272_100102566626 [0,1,0,0,0,1|1,0,1]=4 3742 B12R1.27 CNC(=O)CCC1CCCCC1 11a_106832991635_100000211375 [0,1,0,0,0,1|1,0,0]=3 3743 B12R1.27 CNC(=O)CCC1CCCCC1 1626a_100102657272_100000211375 [0,1,0,0,0,1|1,0,0]=3 3744 B12R1.27 CNC(=O)CCC1CCCCC1 240690a_100102657272_100000211375 [0,1,0,0,0,1|1,0,0]=3 3745 B12R1.27 CNC(=O)CCC1CCCCC1 527a_100102657272_100000211375 [0,1,0,0,0,1|1,0,0]=3 3746 B12R1.27 CNC(=O)CCN1CCCCC1 240690a_100102657272_100000743487 [0,1,0,0,0,1|2,0,0]=4 3747 B12R1.27 CNC(=O)CNC1CCCCC1 2230a_100000182618_100000183359 [0,1,0,0,0,1|1,0,0]=3 3748 B12R1.27 CNC(=O)CNC1CCCCC1 270004a_100000693194_100000210434 [0,1,0,0,0,1|1,0,0]=3 3749 B12R1.27 CNC(=O)CNC1CCCCC1 34a_100000182618_100000183359 [0,1,0,0,0,1|1,0,0]=3 3750 B12R1.27 CNC(=O)CNC1CCCOC1 2230a_100000719290_100000183359 [0,1,0,0,0,1|2,0,0]=4 3751 B12R1.27 CNC(=O)CNC1CCCOC1 270004a_100000693194_100000753404 [0,1,0,0,0,1|2,0,0]=4 3752 B12R1.27 CNC(=O)CNC1CCCOC1 34a_100000719290_100000183359 [0,1,0,0,0,1|2,0,0]=4 3753 B12R1.27 CNC(=O)CNC1CCCSC1 270004a_100000693194_100000057913 [0,1,0,0,0,1|2,0,0]=4 3754 B12R1.27 CNC(=O)CNC1CCNCC1 270004a_100000693194_100015192401 [0,1,0,0,0,1|2,0,0]=4 3755 B12R1.27 CNC(=O)CNC1CCOCC1 2230a_100000741149_100000183359 [0,1,0,0,0,1|2,0,0]=4 3756 B12R1.27 CNC(=O)CNC1CCOCC1 270004a_100000693194_100011217826 [0,1,0,0,0,1|2,0,0]=4 3757 B12R1.27 CNC(=O)CNC1CCOCC1 34a_100000741149_100000183359 [0,1,0,0,0,1|2,0,0]=4 3758 B12R1.27 CNC(=O)CNC1CCSCC1 2230a_100000748639_100000183359 [0,1,0,0,0,1|2,0,0]=4 3759 B12R1.27 CNC(=O)CNC1CCSCC1 270004a_100000693194_100000203788 [0,1,0,0,0,1|2,0,0]=4 3760 B12R1.27 CNC(=O)CNC1CCSCC1 34a_100000748639_100000183359 [0,1,0,0,0,1|2,0,0]=4 3761 B12R1.27 CNC(=O)COC1CCCCC1 11a_106832991635_100011223303 [0,1,0,0,0,1|1,0,0]=3 3762 B12R1.27 CNC(=O)COC1CCCCC1 1626a_100102657272_100011223303 [0,1,0,0,0,1|1,0,0]=3 3763 B12R1.27 CNC(=O)COC1CCCCC1 240690a_100102657272_100011223303 [0,1,0,0,0,1|1,0,0]=3 3764 B12R1.27 CNC(=O)COC1CCCCC1 34a_100000210231_100000183359 [0,1,0,0,0,1|1,0,0]=3 3765 B12R1.27 CNC(=O)COC1CCCCC1 34a_100000750040_100000210327 [0,1,0,0,0,1|1,0,0]=3 3766 B12R1.27 CNC(=O)COC1CCCCC1 527a_100102657272_100011223303 [0,1,0,0,0,1|1,0,0]=3 3767 B12R1.27 CNC(=O)COC1CCCCC1 7a_100000210231_100000183359 [0,1,0,0,0,1|1,0,0]=3 3768 B12R1.27 CNC(=O)COC1CCCCO1 34a_100000033831_100000183359 [0,1,0,0,0,1|2,0,0]=4 3769 B12R1.27 CNC(=O)COC1CCCOC1 34a_100000750040_100000693364 [0,1,0,0,0,1|2,0,0]=4 3770 B12R1.27 CNC(=O)COC1CCCOC1 34a_100000754041_100000183359 [0,1,0,0,0,1|2,0,0]=4 3771 B12R1.27 CNC(=O)COC1CCCSC1 7a_100015962668_100000183359 [0,1,0,0,0,1|2,0,0]=4 3772 B12R1.27 CNC(=O)COC1CCOCC1 34a_100000744328_100000183359 [0,1,0,0,0,1|2,0,0]=4 3773 B12R1.27 CNC(=O)COC1CCSCC1 34a_100000731022_100000183359 [0,1,0,0,0,1|2,0,0]=4 3774 B12R1.27 CNC(=O)COC1CCSCC1 34a_100000750040_100000069128 [0,1,0,0,0,1|2,0,0]=4 3775 B12R1.27 CNC(=O)COC1CCSCC1 7a_100000731022_100000183359 [0,1,0,0,0,1|2,0,0]=4 3776 B12R1.27 CNC(=O)CSC1CCCCC1 62a_100000183359_100000210327 [0,1,0,0,0,1|1,0,0]=3 3777 B12R1.27 CNC(=O)CSC1CCCCC1 62a_100000210327_100000183359 [0,1,0,0,0,1|1,0,0]=3 3778 B12R1.27 CNC(=O)CSC1CCCOC1 62a_100000183359_100000693364 [0,1,0,0,0,1|2,0,0]=4 3779 B12R1.27 CNC(=O)CSC1CCOCC1 62a_100000183359_100011324220 [0,1,0,0,0,1|2,0,0]=4 3780 B12R1.27 CNC(=O)CSC1CCSCC1 62a_100000183359_100000069128 [0,1,0,0,0,1|2,0,0]=4 3781 B12R1.27 CNC(=O)NCC1CCCCC1 2708a_100000210473_106832991635 [0,1,0,0,0,1|1,0,0]=3 3782 B12R1.27 CNC(=O)NCC1CCCCC1 2708a_100102657272_100000210473 [0,1,0,0,0,1|1,0,0]=3 3783 B12R1.27 CNC(=O)NCC1CCCCC1 273464a_100000210473_100102657272 [0,1,0,0,0,1|1,0,0]=3 3784 B12R1.27 CNC(=O)NCC1CCCCC1 273464a_100102657272_100000210473 [0,1,0,0,0,1|1,0,0]=3 3785 B12R1.27 CNC(=O)NCC1CCCCC1 512a_106832991638_100000210473 [0,1,0,0,0,1|1,0,0]=3 3786 B12R1.27 CNC(=O)NCC1CCCCO1 2708a_100000174945_106832991635 [0,1,0,0,0,1|2,0,0]=4 3787 B12R1.27 CNC(=O)NCC1CCCCO1 2708a_100102657272_100000174945 [0,1,0,0,0,1|2,0,0]=4 3788 B12R1.27 CNC(=O)NCC1CCCCO1 273464a_100000174945_100102657272 [0,1,0,0,0,1|2,0,0]=4 3789 B12R1.27 CNC(=O)NCC1CCCCO1 273464a_100102657272_100000174945 [0,1,0,0,0,1|2,0,0]=4 3790 B12R1.27 CNC(=O)NCC1CCCCO1 512a_100000174945_100102657272 [0,1,0,0,0,1|2,0,0]=4 3791 B12R1.27 CNC(=O)NCC1CCCCO1 512a_106832991638_100000174945 [0,1,0,0,0,1|2,0,0]=4 3792 B12R1.27 CNC(=O)NCC1CCCOC1 2708a_100000720124_106832991635 [0,1,0,0,0,1|2,0,0]=4 3793 B12R1.27 CNC(=O)NCC1CCCOC1 2708a_100102657272_100000720124 [0,1,0,0,0,1|2,0,0]=4 3794 B12R1.27 CNC(=O)NCC1CCCOC1 273464a_100000720124_100102657272 [0,1,0,0,0,1|2,0,0]=4 3795 B12R1.27 CNC(=O)NCC1CCCOC1 273464a_100102657272_100000720124 [0,1,0,0,0,1|2,0,0]=4 3796 B12R1.27 CNC(=O)NCC1CCCOC1 512a_100000720124_100102657272 [0,1,0,0,0,1|2,0,0]=4 3797 B12R1.27 CNC(=O)NCC1CCCOC1 512a_106832991638_100000720124 [0,1,0,0,0,1|2,0,0]=4 3798 B12R1.27 CNC(=O)NCC1CCOCC1 2708a_100000746373_106832991635 [0,1,0,0,0,1|2,0,0]=4 3799 B12R1.27 CNC(=O)NCC1CCOCC1 2708a_100102657272_100000746373 [0,1,0,0,0,1|2,0,0]=4 3800 B12R1.27 CNC(=O)NCC1CCOCC1 273464a_100000746373_100102657272 [0,1,0,0,0,1|2,0,0]=4 3801 B12R1.27 CNC(=O)NCC1CCOCC1 273464a_100102657272_100000746373 [0,1,0,0,0,1|2,0,0]=4 3802 B12R1.27 CNC(=O)NCC1CCOCC1 512a_100000746373_100102657272 [0,1,0,0,0,1|2,0,0]=4 3803 B12R1.27 CNC(=O)NCC1CCOCC1 512a_106832991638_100000746373 [0,1,0,0,0,1|2,0,0]=4 3804 B12R1.27 CNC(=O)NCC1CCSCC1 2708a_100015188806_106832991635 [0,1,0,0,0,1|2,0,0]=4 3805 B12R1.27 CNC(=O)NCC1CCSCC1 2708a_100102657272_100015188806 [0,1,0,0,0,1|2,0,0]=4 3806 B12R1.27 CNC(=O)NCC1CCSCC1 273464a_100015188806_100102657272 [0,1,0,0,0,1|2,0,0]=4 3807 B12R1.27 CNC(=O)NCC1CCSCC1 273464a_100102657272_100015188806 [0,1,0,0,0,1|2,0,0]=4 3808 B12R1.27 CNC(=O)NCC1CCSCC1 512a_100015188806_100102657272 [0,1,0,0,0,1|2,0,0]=4 3809 B12R1.27 CNC(=O)NCC1CCSCC1 512a_106832991638_100015188806 [0,1,0,0,0,1|2,0,0]=4 3810 B12R1.27 CNC(=O)NNC1CCCCC1 273464a_100102657272_100000709804 [0,1,0,0,0,1|2,0,0]=4 3811 B12R1.27 COC(=O)CCN1CCCOC1 2230a_100000131196_100000204255 [0,1,0,0,0,1|2,0,0]=4 3812 B12R1.27 COC(=O)CCN1CCCOC1 269982a_100000131196_100000204255 [0,1,0,0,0,1|2,0,0]=4 3813 B12R1.27 COC(=O)CCN1CCCOC1 34a_100000131196_100000742370 [0,1,0,0,0,1|2,0,0]=4 3814 B12R1.27 COC(=O)CCN1CCOCC1 2230a_100015191051_100000204255 [0,1,0,0,0,1|2,0,0]=4 3815 B12R1.27 COC(=O)CCN1CCOCC1 269982a_100015191051_100000204255 [0,1,0,0,0,1|2,0,0]=4 3816 B12R1.27 COC(=O)CCN1CCOCC1 34a_100015191051_100000742370 [0,1,0,0,0,1|2,0,0]=4 3817 B12R1.27 COC(=O)CCN1CCSCC1 2230a_100000737611_100000204255 [0,1,0,0,0,1|2,0,0]=4 3818 B12R1.27 COC(=O)CCN1CCSCC1 269982a_100000737611_100000204255 [0,1,0,0,0,1|2,0,0]=4 3819 B12R1.27 COC(=O)CNC1CCCCC1 2230a_100000182618_100000747449 [0,1,0,0,0,1|0,0,0]=2 3820 B12R1.27 COC(=O)CNC1CCCCC1 34a_100000182618_100000747449 [0,1,0,0,0,1|0,0,0]=2 3821 B12R1.27 COC(=O)CNC1CCCOC1 2230a_100000719290_100000747449 [0,1,0,0,0,1|1,0,0]=3 3822 B12R1.27 COC(=O)CNC1CCCOC1 34a_100000719290_100000747449 [0,1,0,0,0,1|1,0,0]=3 3823 B12R1.27 COC(=O)CNC1CCOCC1 2230a_100000741149_100000747449 [0,1,0,0,0,1|1,0,0]=3 3824 B12R1.27 COC(=O)CNC1CCOCC1 34a_100000741149_100000747449 [0,1,0,0,0,1|1,0,0]=3 3825 B12R1.27 COC(=O)CNC1CCSCC1 2230a_100000748639_100000747449 [0,1,0,0,0,1|1,0,0]=3 3826 B12R1.27 COC(=O)CNC1CCSCC1 34a_100000748639_100000747449 [0,1,0,0,0,1|1,0,0]=3 3827 B12R1.27 COC(=O)COC1C=CCCC1 34a_100011215024_100000747449 [0,1,0,0,0,1|0,0,2]=4 3828 B12R1.27 COC(=O)COC1CC=CCC1 34a_100000073881_100000747449 [0,1,0,0,0,1|0,0,2]=4 3829 B12R1.27 COC(=O)COC1CCCCC1 34a_100000210231_100000747449 [0,1,0,0,0,1|0,0,0]=2 3830 B12R1.27 COC(=O)COC1CCCCC1 7a_100000210231_100000747449 [0,1,0,0,0,1|0,0,0]=2 3831 B12R1.27 COC(=O)COC1CCCCO1 34a_100000033831_100000747449 [0,1,0,0,0,1|1,0,0]=3 3832 B12R1.27 COC(=O)COC1CCCOC1 34a_100000754041_100000747449 [0,1,0,0,0,1|1,0,0]=3 3833 B12R1.27 COC(=O)COC1CCCSC1 7a_100015962668_100000747449 [0,1,0,0,0,1|1,0,0]=3 3834 B12R1.27 COC(=O)COC1CCOCC1 34a_100000744328_100000747449 [0,1,0,0,0,1|1,0,0]=3 3835 B12R1.27 COC(=O)COC1CCSCC1 34a_100000731022_100000747449 [0,1,0,0,0,1|1,0,0]=3 3836 B12R1.27 COC(=O)COC1CCSCC1 7a_100000731022_100000747449 [0,1,0,0,0,1|1,0,0]=3 3837 B12R1.27 COC(=O)CSC1C=CCCC1 62a_100000747449_100000751183 [0,1,0,0,0,1|0,0,2]=4 3838 B12R1.27 COC(=O)CSC1C=CCCC1 62a_100000751183_100000747449 [0,1,0,0,0,1|0,0,2]=4 3839 B12R1.27 COC(=O)CSC1CCCCC1 62a_100000210327_100000747449 [0,1,0,0,0,1|0,0,0]=2 3840 B12R1.27 COC(=O)CSC1CCCCC1 62a_100000747449_100000210327 [0,1,0,0,0,1|0,0,0]=2 3841 B12R1.27 COC(=O)CSC1CCCOC1 62a_100000747449_100000693364 [0,1,0,0,0,1|1,0,0]=3 3842 B12R1.27 COC(=O)CSC1CCOCC1 62a_100000747449_100011324220 [0,1,0,0,0,1|1,0,0]=3 3843 B12R1.27 COC(=O)CSC1CCSCC1 62a_100000747449_100000069128 [0,1,0,0,0,1|1,0,0]=3 3844 B12R1.27 COC(C)CNC1CCCCC1 34a_100000202029_200000210301 [0,1,0,0,0,1|1,0,1]=4 3845 B12R1.27 COC(C)COC1CCCCC1 34a_100000690652_100000210327 [0,1,0,0,0,1|1,0,1]=4 3846 B12R1.27 COC(C)SCC1CCCCC1 62a_100000211423_100009879195 [0,1,0,0,0,1|1,0,1]=4 3847 B12R1.27 COC(C)SCC1CCCCC1 62a_100009879195_100000211423 [0,1,0,0,0,1|1,0,1]=4 3848 B12R1.27 CO[C@H](C)CNC1CCCCC1 270004a_100020591295_100000210434 [0,1,0,0,0,1|1,0,1]=4 3849 B12R1.27 C[C@@H](CO)CNC1CCCCC1 2230a_100000182618_100000059175 [0,1,0,0,0,1|1,0,1]=4 3850 B12R1.27 C[C@@H](CO)CNC1CCCCC1 34a_100000182618_100000059175 [0,1,0,0,0,1|1,0,1]=4 3851 B12R1.27 C[C@@H](CO)COC1CCCCC1 34a_100000210231_100000059175 [0,1,0,0,0,1|1,0,1]=4 3852 B12R1.27 C[C@@H](CO)COC1CCCCC1 7a_100000210231_100000059175 [0,1,0,0,0,1|1,0,1]=4 3853 B12R1.27 C[C@@H](CO)CSC1CCCCC1 62a_100000059175_100000210327 [0,1,0,0,0,1|1,0,1]=4 3854 B12R1.27 C[C@@H](CO)CSC1CCCCC1 62a_100000210327_100000059175 [0,1,0,0,0,1|1,0,1]=4 3855 B12R1.27 C[C@H](CO)NCC1CCCCC1 2230a_100000737577_100000211423 [0,1,0,0,0,1|1,0,1]=4 3856 B12R1.27 C[C@H](CO)NCC1CCCCC1 269862a_100000737577_100000211278 [0,1,0,0,0,1|1,0,1]=4 3857 B12R1.27 C[C@H](CO)SCC1CCCCC1 62a_100000211423_100016084084 [0,1,0,0,0,1|1,0,1]=4 3858 B12R1.27 C[C@H](CO)SCC1CCCCC1 62a_100016084084_100000211423 [0,1,0,0,0,1|1,0,1]=4 3859 B12R1.27 O=C(C=CC1CCCCC1)CF 1458a_100102566626_100015361967 [0,1,0,0,0,1|1,0,1]=4 3860 B12R1.27 O=C(CF)CCC1CCCCC1 1458a_100000211375_100015361967 [0,1,0,0,0,1|1,0,0]=3 3861 B12R1.27 O=C(CF)CCN1CCCCC1 1458a_100000743487_100015361967 [0,1,0,0,0,1|2,0,0]=4 3862 B12R1.27 O=C(CF)COC1CCCCC1 1458a_100011223303_100015361967 [0,1,0,0,0,1|1,0,0]=3 3863 B12R1.27 O=C(CO)CCC1CCCCC1 1458a_100000210174_100011273959 [0,1,0,0,0,1|0,0,0]=2 3864 B12R1.27 O=C(CO)CCC1CCOCC1 1458a_100000210174_100011934994 [0,1,0,0,0,1|1,0,0]=3 3865 B12R1.27 O=C(CO)CCC1OCCCO1 1458a_100000210174_100000764188 [0,1,0,0,0,1|2,0,0]=4 3866 B12R1.27 O=C(CO)CCN1CCCCC1 1458a_100000210174_100000739454 [0,1,0,0,0,1|1,0,0]=3 3867 B12R1.27 O=C(CO)CCN1CCOCC1 1458a_100000210174_100000753993 [0,1,0,0,0,1|2,0,0]=4 3868 B12R1.27 O=C(CO)COC1CCCCC1 1458a_100000210174_100011935260 [0,1,0,0,0,1|0,0,0]=2 3869 B12R1.27 O=C(CO)NCC1CCCCC1 240690a_100000210473_100000210174 [0,1,0,0,0,1|0,0,0]=2 3870 B12R1.27 O=C(CO)NCC1CCCCC1 527a_100000210473_100000210174 [0,1,0,0,0,1|0,0,0]=2 3871 B12R1.27 O=C(CO)NCC1CCCCO1 240690a_100000174945_100000210174 [0,1,0,0,0,1|1,0,0]=3 3872 B12R1.27 O=C(CO)NCC1CCCCO1 527a_100000174945_100000210174 [0,1,0,0,0,1|1,0,0]=3 3873 B12R1.27 O=C(CO)NCC1CCCOC1 240690a_100000720124_100000210174 [0,1,0,0,0,1|1,0,0]=3 3874 B12R1.27 O=C(CO)NCC1CCCOC1 527a_100000720124_100000210174 [0,1,0,0,0,1|1,0,0]=3 3875 B12R1.27 O=C(CO)NCC1CCOCC1 240690a_100000746373_100000210174 [0,1,0,0,0,1|1,0,0]=3 3876 B12R1.27 O=C(CO)NCC1CCOCC1 527a_100000746373_100000210174 [0,1,0,0,0,1|1,0,0]=3 3877 B12R1.27 O=C(CO)NCC1CCSCC1 240690a_100015188806_100000210174 [0,1,0,0,0,1|1,0,0]=3 3878 B12R1.27 O=C(CO)NCC1CCSCC1 527a_100015188806_100000210174 [0,1,0,0,0,1|1,0,0]=3 3879 B12R1.27 O=C(CO)NC[C@H]1COCCO1 240690a_100010981119_100000210174 [0,1,0,0,0,1|2,0,0]=4 3880 B12R1.27 O=C(CO)NC[C@H]1COCCO1 527a_100010981119_100000210174 [0,1,0,0,0,1|2,0,0]=4 3881 B12R1.27 O=C(CO)NNC1CCCCC1 22a_100000709804_100000210174 [0,1,0,0,0,1|1,0,0]=3 3882 B12R1.27 O=C(CO)NNC1CCOCC1 22a_100000687383_100000210174 [0,1,0,0,0,1|2,0,0]=4 3883 B12R1.27 OCC(O)CNC1CCCCC1 2230a_100000182618_100011219619 [0,1,0,0,0,1|0,0,2]=4 3884 B12R1.27 OCC(O)CNC1CCCCC1 34a_100000182618_100011219619 [0,1,0,0,0,1|0,0,2]=4 3885 B12R1.27 OCC(O)COC1CCCCC1 34a_100000210231_100011219619 [0,1,0,0,0,1|0,0,2]=4 3886 B12R1.27 OCC(O)COC1CCCCC1 7a_100000210231_100011219619 [0,1,0,0,0,1|0,0,2]=4 3887 B12R1.27 OCC(O)CSC1CCCCC1 62a_100000210327_100011219619 [0,1,0,0,0,1|0,0,2]=4 3888 B12R1.27 OCC(O)CSC1CCCCC1 62a_100011219619_100000210327 [0,1,0,0,0,1|0,0,2]=4 3889 B12R1.27 OC[C@H](F)CNC1CCCCC1 270004a_100015665980_100000210434 [0,1,0,0,0,1|1,0,1]=4 3890 B12R1.27 OC[C@H](F)CNC1CCCCC1 34a_100015665980_100000210327 [0,1,0,0,0,1|1,0,1]=4 3891 B12R1.27 OC[C@H](O)CNC1CCCCC1 2230a_100000182618_100009815848 [0,1,0,0,0,1|0,0,2]=4 3892 B12R1.27 OC[C@H](O)CNC1CCCCC1 34a_100000182618_100009815848 [0,1,0,0,0,1|0,0,2]=4 3893 B12R1.27 OC[C@H](O)COC1CCCCC1 34a_100000210231_100009815848 [0,1,0,0,0,1|0,0,2]=4 3894 B12R1.27 OC[C@H](O)COC1CCCCC1 7a_100000210231_100009815848 [0,1,0,0,0,1|0,0,2]=4 3895 B12R1.27 OC[C@H](O)CSC1CCCCC1 62a_100000210327_100009815848 [0,1,0,0,0,1|0,0,2]=4 3896 B12R1.27 OC[C@H](O)CSC1CCCCC1 62a_100009815848_100000210327 [0,1,0,0,0,1|0,0,2]=4 3897 B12R1.27 O[C@@H](CF)CNC1CCCCC1 2230a_100000182618_100015614560 [0,1,0,0,0,1|1,0,1]=4 3898 B12R1.27 O[C@@H](CF)CNC1CCCCC1 34a_100000182618_100015614560 [0,1,0,0,0,1|1,0,1]=4 3899 B12R1.27 O[C@@H](CF)COC1CCCCC1 34a_100000210231_100015614560 [0,1,0,0,0,1|1,0,1]=4 3900 B12R1.27 O[C@@H](CF)COC1CCCCC1 7a_100000210231_100015614560 [0,1,0,0,0,1|1,0,1]=4 3901 B12R1.27 O[C@@H](CF)CSC1CCCCC1 62a_100000210327_100015614560 [0,1,0,0,0,1|1,0,1]=4 3902 B12R1.27 O[C@@H](CF)CSC1CCCCC1 62a_100015614560_100000210327 [0,1,0,0,0,1|1,0,1]=4 3903 B12R1.43 C=C(C)C(=O)CC1CCCCC1 1458a_100000185857_100000211423 [0,1,0,0,0,1|2,0,0]=4 3904 B12R1.43 C=C(C)C(C)NC1CCCCC1 269862a_100000182618_100011216138 [0,1,0,0,0,1|2,0,0]=4 3905 B12R1.43 CC(=O)C(=O)NC1CCCCC1 1458a_200011297149_200000210301 [0,1,0,0,0,1|1,0,1]=4 3906 B12R1.43 CC(=O)C(C)CC1CCCCC1 1458a_200011416370_200000210301 [0,1,0,0,0,1|1,0,0]=3 3907 B12R1.43 CC(=O)C(C)CN1CCCCC1 1458a_100000070787_100009831500 [0,1,0,0,0,1|2,0,0]=4 3908 B12R1.43 CC(=O)C(C)CN1CCCCC1 1458a_100000740234_200000210301 [0,1,0,0,0,1|2,0,0]=4 3909 B12R1.43 CC(=O)C(C)NC1CCCCC1 2230a_100000182618_100009814033 [0,1,0,0,0,1|1,0,0]=3 3910 B12R1.43 CC(=O)C(C)NC1CCCOC1 2230a_100000719290_100009814033 [0,1,0,0,0,1|2,0,0]=4 3911 B12R1.43 CC(=O)C(C)NC1CCOCC1 2230a_100000741149_100009814033 [0,1,0,0,0,1|2,0,0]=4 3912 B12R1.43 CC(=O)C(C)NC1CCSCC1 2230a_100000748639_100009814033 [0,1,0,0,0,1|2,0,0]=4 3913 B12R1.43 CC(=O)C(C)OC1CCCCC1 34a_100000212229_100000210327 [0,1,0,0,0,1|1,0,0]=3 3914 B12R1.43 CC(=O)C(C)OC1CCCCC1 7a_100000210231_100000179758 [0,1,0,0,0,1|1,0,0]=3 3915 B12R1.43 CC(=O)C(C)OC1CCCOC1 34a_100000212229_100000693364 [0,1,0,0,0,1|2,0,0]=4 3916 B12R1.43 CC(=O)C(C)OC1CCCSC1 7a_100015962668_100000179758 [0,1,0,0,0,1|2,0,0]=4 3917 B12R1.43 CC(=O)C(C)OC1CCSCC1 34a_100000212229_100000069128 [0,1,0,0,0,1|2,0,0]=4 3918 B12R1.43 CC(=O)C(C)OC1CCSCC1 7a_100000731022_100000179758 [0,1,0,0,0,1|2,0,0]=4 3919 B12R1.43 CC(=O)C(C)SC1CCCCC1 62a_100000210327_100009814033 [0,1,0,0,0,1|1,0,0]=3 3920 B12R1.43 CC(=O)C(C)SC1CCCCC1 62a_100009814033_100000210327 [0,1,0,0,0,1|1,0,0]=3 3921 B12R1.43 CC(=O)C(C)SC1CCCOC1 62a_100009814033_100000693364 [0,1,0,0,0,1|2,0,0]=4 3922 B12R1.43 CC(=O)C(C)SC1CCOCC1 62a_100009814033_100011324220 [0,1,0,0,0,1|2,0,0]=4 3923 B12R1.43 CC(=O)C(C)SC1CCSCC1 62a_100009814033_100000069128 [0,1,0,0,0,1|2,0,0]=4 3924 B12R1.43 CC(=O)N(C)CC1CCCCC1 11a_100000736448_100015343762 [0,1,0,0,0,1|1,0,0]=3 3925 B12R1.43 CC(=O)N(C)CC1CCCCC1 1626a_100000736448_100015343762 [0,1,0,0,0,1|1,0,0]=3 3926 B12R1.43 CC(=O)N(C)CC1CCCCC1 240690a_100000736448_100015343762 [0,1,0,0,0,1|1,0,0]=3 3927 B12R1.43 CC(=O)N(C)CC1CCCCC1 527a_100000736448_100103153847 [0,1,0,0,0,1|1,0,0]=3 3928 B12R1.43 CC(=O)N(C)CC1CCCCO1 11a_100000225654_100015343762 [0,1,0,0,0,1|2,0,0]=4 3929 B12R1.43 CC(=O)N(C)CC1CCCCO1 1626a_100000225654_100015343762 [0,1,0,0,0,1|2,0,0]=4 3930 B12R1.43 CC(=O)N(C)CC1CCCCO1 240690a_100000225654_100015343762 [0,1,0,0,0,1|2,0,0]=4 3931 B12R1.43 CC(=O)N(C)CC1CCCCO1 527a_100000225654_100103153847 [0,1,0,0,0,1|2,0,0]=4 3932 B12R1.43 CC(=O)N(C)CC1CCOCC1 11a_100025706683_100015343762 [0,1,0,0,0,1|2,0,0]=4 3933 B12R1.43 CC(=O)N(C)CC1CCOCC1 1626a_100025706683_100015343762 [0,1,0,0,0,1|2,0,0]=4 3934 B12R1.43 CC(=O)N(C)CC1CCOCC1 240690a_100025706683_100015343762 [0,1,0,0,0,1|2,0,0]=4 3935 B12R1.43 CC(=O)N(C)CC1CCOCC1 527a_100025706683_100103153847 [0,1,0,0,0,1|2,0,0]=4 3936 B12R1.43 CC(=O)N(C)CC1CCSCC1 11a_100011935259_100015343762 [0,1,0,0,0,1|2,0,0]=4 3937 B12R1.43 CC(=O)N(C)CC1CCSCC1 240690a_100011935259_100015343762 [0,1,0,0,0,1|2,0,0]=4 3938 B12R1.43 CC(=O)N(C)CC1CCSCC1 527a_100011935259_100103153847 [0,1,0,0,0,1|2,0,0]=4 3939 B12R1.43 CC(=O)[C@H](O)CC1CCCCC1 1458a_100016183741_200000210301 [0,1,0,0,0,1|1,0,0]=3 3940 B12R1.43 CC(CC1CCCCC1)C(=O)[13CH3] 1458a_200011416370_200025704644 [0,1,0,0,0,1|1,0,0]=3 3941 B12R1.43 CC(CN1CCCCC1)C(=O)[13CH3] 1458a_100000740234_200025704644 [0,1,0,0,0,1|2,0,0]=4 3942 B12R1.43 CC(NC1CCCCC1)C(=O)N 2230a_100000182618_100000702099 [0,1,0,0,0,1|1,0,0]=3 3943 B12R1.43 CC(NC1CCCCC1)C(=O)N 34a_100000182618_100000702099 [0,1,0,0,0,1|1,0,0]=3 3944 B12R1.43 CC(NC1CCCOC1)C(=O)N 2230a_100000719290_100000702099 [0,1,0,0,0,1|2,0,0]=4 3945 B12R1.43 CC(NC1CCCOC1)C(=O)N 34a_100000719290_100000702099 [0,1,0,0,0,1|2,0,0]=4 3946 B12R1.43 CC(NC1CCOCC1)C(=O)N 2230a_100000741149_100000702099 [0,1,0,0,0,1|2,0,0]=4 3947 B12R1.43 CC(NC1CCOCC1)C(=O)N 34a_100000741149_100000702099 [0,1,0,0,0,1|2,0,0]=4 3948 B12R1.43 CC(NC1CCSCC1)C(=O)N 2230a_100000748639_100000702099 [0,1,0,0,0,1|2,0,0]=4 3949 B12R1.43 CC(NC1CCSCC1)C(=O)N 34a_100000748639_100000702099 [0,1,0,0,0,1|2,0,0]=4 3950 B12R1.43 CC(OC1CCCCC1)C(=O)N 34a_100000210231_100000702099 [0,1,0,0,0,1|1,0,0]=3 3951 B12R1.43 CC(OC1CCCCC1)C(=O)N 7a_100000210231_100000702099 [0,1,0,0,0,1|1,0,0]=3 3952 B12R1.43 CC(OC1CCCCO1)C(=O)N 34a_100000033831_100000702099 [0,1,0,0,0,1|2,0,0]=4 3953 B12R1.43 CC(OC1CCCOC1)C(=O)N 34a_100000754041_100000702099 [0,1,0,0,0,1|2,0,0]=4 3954 B12R1.43 CC(OC1CCCSC1)C(=O)N 7a_100015962668_100000702099 [0,1,0,0,0,1|2,0,0]=4 3955 B12R1.43 CC(OC1CCOCC1)C(=O)N 34a_100000744328_100000702099 [0,1,0,0,0,1|2,0,0]=4 3956 B12R1.43 CC(OC1CCSCC1)C(=O)N 34a_100000731022_100000702099 [0,1,0,0,0,1|2,0,0]=4 3957 B12R1.43 CC(OC1CCSCC1)C(=O)N 7a_100000731022_100000702099 [0,1,0,0,0,1|2,0,0]=4 3958 B12R1.43 CC(SC1CCCCC1)C(=O)N 62a_100000210327_100000702099 [0,1,0,0,0,1|1,0,0]=3 3959 B12R1.43 CC(SC1CCCCC1)C(=O)N 62a_100000702099_100000210327 [0,1,0,0,0,1|1,0,0]=3 3960 B12R1.43 CC(SC1CCCOC1)C(=O)N 62a_100000702099_100000693364 [0,1,0,0,0,1|2,0,0]=4 3961 B12R1.43 CC(SC1CCOCC1)C(=O)N 62a_100000702099_100011324220 [0,1,0,0,0,1|2,0,0]=4 3962 B12R1.43 CC(SC1CCSCC1)C(=O)N 62a_100000702099_100000069128 [0,1,0,0,0,1|2,0,0]=4 3963 B12R1.43 C[C@@H](NC1CCCCC1)C(=O)N 270004a_100000119354_100000210434 [0,1,0,0,0,1|1,0,0]=3 3964 B12R1.43 C[C@@H](NC1CCCCC1)C(=O)N 34a_100000119354_100000210327 [0,1,0,0,0,1|1,0,0]=3 3965 B12R1.43 C[C@@H](NC1CCCOC1)C(=O)N 270004a_100000119354_100000753404 [0,1,0,0,0,1|2,0,0]=4 3966 B12R1.43 C[C@@H](NC1CCCOC1)C(=O)N 34a_100000119354_100000693364 [0,1,0,0,0,1|2,0,0]=4 3967 B12R1.43 C[C@@H](NC1CCCSC1)C(=O)N 270004a_100000119354_100000057913 [0,1,0,0,0,1|2,0,0]=4 3968 B12R1.43 C[C@@H](NC1CCNCC1)C(=O)N 270004a_100000119354_100015192401 [0,1,0,0,0,1|2,0,0]=4 3969 B12R1.43 C[C@@H](NC1CCOCC1)C(=O)N 270004a_100000119354_100011217826 [0,1,0,0,0,1|2,0,0]=4 3970 B12R1.43 C[C@@H](NC1CCSCC1)C(=O)N 270004a_100000119354_100000203788 [0,1,0,0,0,1|2,0,0]=4 3971 B12R1.43 C[C@@H](NC1CCSCC1)C(=O)N 34a_100000119354_100000069128 [0,1,0,0,0,1|2,0,0]=4 3972 B12R1.43 C[C@@H](O)C(=O)CC1CCCCC1 1458a_100000717761_100000211423 [0,1,0,0,0,1|1,0,1]=4 3973 B12R1.43 C[C@@H](OC1CCCCC1)C(=O)N 34a_100000731257_100000210327 [0,1,0,0,0,1|1,0,0]=3 3974 B12R1.43 C[C@@H](OC1CCCCC1)C(=O)N 7a_100000731257_100000210327 [0,1,0,0,0,1|1,0,0]=3 3975 B12R1.43 C[C@@H](OC1CCCOC1)C(=O)N 34a_100000731257_100000693364 [0,1,0,0,0,1|2,0,0]=4 3976 B12R1.43 C[C@@H](OC1CCCOC1)C(=O)N 7a_100000731257_100000693364 [0,1,0,0,0,1|2,0,0]=4 3977 B12R1.43 C[C@@H](OC1CCOCC1)C(=O)N 7a_100000731257_100000686592 [0,1,0,0,0,1|2,0,0]=4 3978 B12R1.43 C[C@@H](OC1CCSCC1)C(=O)N 34a_100000731257_100000069128 [0,1,0,0,0,1|2,0,0]=4 3979 B12R1.43 C[C@@H](OC1CCSCC1)C(=O)N 7a_100000731257_100011500858 [0,1,0,0,0,1|2,0,0]=4 3980 B12R1.43 C[C@H](NC1C=CCCC1)C(=O)O 269956a_100000743915_100000751183 [0,1,0,0,0,1|0,0,2]=4 3981 B12R1.43 C[C@H](NC1CCCCC1)C(=O)O 269956a_100000743915_100000210327 [0,1,0,0,0,1|0,0,0]=2 3982 B12R1.43 C[C@H](NC1CCCOC1)C(=O)O 269956a_100000743915_100000693364 [0,1,0,0,0,1|1,0,0]=3 3983 B12R1.43 C[C@H](NC1CCOCC1)C(=O)O 269956a_100000743915_100011324220 [0,1,0,0,0,1|1,0,0]=3 3984 B12R1.43 C[C@H](NC1CCSCC1)C(=O)O 269956a_100000743915_100000069128 [0,1,0,0,0,1|1,0,0]=3 3985 B12R1.43 C[C@H](O)C(=O)CC1CCCCC1 1458a_217856618621_100000211423 [0,1,0,0,0,1|1,0,1]=4 3986 B12R1.43 C[C@H](OC1CCCCC1)C(=O)[O-] 7a_217856618621_100000210327 [0,1,0,0,0,1|0,0,1]=3 3987 B12R1.43 C[C@H](OC1CCCOC1)C(=O)[O-] 7a_217856618621_100000693364 [0,1,0,0,0,1|1,0,1]=4 3988 B12R1.43 C[C@H](OC1CCOCC1)C(=O)[O-] 7a_217856618621_100000686592 [0,1,0,0,0,1|1,0,1]=4 3989 B12R1.43 C[C@H](OC1CCSCC1)C(=O)[O-] 7a_217856618621_100011500858 [0,1,0,0,0,1|1,0,1]=4 3990 B12R1.43 NC(=O)C(=O)NC1CCCCC1 240690a_100000182618_100011215815 [0,1,0,0,0,1|1,0,1]=4 3991 B12R1.43 NC(=O)C(F)NC1CCCCC1 2230a_100000182618_100009813875 [0,1,0,0,0,1|1,0,0]=3 3992 B12R1.43 NC(=O)C(F)NC1CCCCC1 34a_100000182618_100009813875 [0,1,0,0,0,1|1,0,0]=3 3993 B12R1.43 NC(=O)C(F)NC1CCCOC1 2230a_100000719290_100009813875 [0,1,0,0,0,1|2,0,0]=4 3994 B12R1.43 NC(=O)C(F)NC1CCCOC1 34a_100000719290_100009813875 [0,1,0,0,0,1|2,0,0]=4 3995 B12R1.43 NC(=O)C(F)NC1CCOCC1 2230a_100000741149_100009813875 [0,1,0,0,0,1|2,0,0]=4 3996 B12R1.43 NC(=O)C(F)NC1CCOCC1 34a_100000741149_100009813875 [0,1,0,0,0,1|2,0,0]=4 3997 B12R1.43 NC(=O)C(F)NC1CCSCC1 2230a_100000748639_100009813875 [0,1,0,0,0,1|2,0,0]=4 3998 B12R1.43 NC(=O)C(F)NC1CCSCC1 34a_100000748639_100009813875 [0,1,0,0,0,1|2,0,0]=4 3999 B12R1.43 NC(=O)C(F)OC1CCCCC1 34a_100000210231_100009813875 [0,1,0,0,0,1|1,0,0]=3 4000 B12R1.43 NC(=O)C(F)OC1CCCCC1 7a_100000210231_100009813875 [0,1,0,0,0,1|1,0,0]=3 4001 B12R1.43 NC(=O)C(F)OC1CCCCO1 34a_100000033831_100009813875 [0,1,0,0,0,1|2,0,0]=4 4002 B12R1.43 NC(=O)C(F)OC1CCCOC1 34a_100000754041_100009813875 [0,1,0,0,0,1|2,0,0]=4 4003 B12R1.43 NC(=O)C(F)OC1CCCSC1 7a_100015962668_100009813875 [0,1,0,0,0,1|2,0,0]=4 4004 B12R1.43 NC(=O)C(F)OC1CCOCC1 34a_100000744328_100009813875 [0,1,0,0,0,1|2,0,0]=4 4005 B12R1.43 NC(=O)C(F)OC1CCSCC1 34a_100000731022_100009813875 [0,1,0,0,0,1|2,0,0]=4 4006 B12R1.43 NC(=O)C(F)OC1CCSCC1 7a_100000731022_100009813875 [0,1,0,0,0,1|2,0,0]=4 4007 B12R1.43 NC(=O)C(F)SC1CCCCC1 62a_100000210327_100009813875 [0,1,0,0,0,1|1,0,0]=3 4008 B12R1.43 NC(=O)C(F)SC1CCCCC1 62a_100009813875_100000210327 [0,1,0,0,0,1|1,0,0]=3 4009 B12R1.43 NC(=O)C(F)SC1CCCOC1 62a_100009813875_100000693364 [0,1,0,0,0,1|2,0,0]=4 4010 B12R1.43 NC(=O)C(F)SC1CCOCC1 62a_100009813875_100011324220 [0,1,0,0,0,1|2,0,0]=4 4011 B12R1.43 NC(=O)C(F)SC1CCSCC1 62a_100009813875_100000069128 [0,1,0,0,0,1|2,0,0]=4 4012 B12R1.43 O=C(CC1CCCCC1)C(O)O 1458a_100000233687_100000211423 [0,1,0,0,0,1|0,0,2]=4 4013 B12R1.43 O=C([O-])C(F)NC1CCCCC1 34a_100000182618_100020610796 [0,1,0,0,0,1|0,0,1]=3 4014 B12R1.43 O=C([O-])C(F)NC1CCCOC1 34a_100000719290_100020610796 [0,1,0,0,0,1|1,0,1]=4 4015 B12R1.43 O=C([O-])C(F)NC1CCOCC1 34a_100000741149_100020610796 [0,1,0,0,0,1|1,0,1]=4 4016 B12R1.43 O=C([O-])C(F)NC1CCSCC1 34a_100000748639_100020610796 [0,1,0,0,0,1|1,0,1]=4 4017 B12R1.43 O=C([O-])C(F)OC1CCCCC1 34a_100000210231_100020610796 [0,1,0,0,0,1|0,0,1]=3 4018 B12R1.43 O=C([O-])C(F)OC1CCCCO1 34a_100000033831_100020610796 [0,1,0,0,0,1|1,0,1]=4 4019 B12R1.43 O=C([O-])C(F)OC1CCCOC1 34a_100000754041_100020610796 [0,1,0,0,0,1|1,0,1]=4 4020 B12R1.43 O=C([O-])C(F)OC1CCOCC1 34a_100000744328_100020610796 [0,1,0,0,0,1|1,0,1]=4 4021 B12R1.43 O=C([O-])C(F)OC1CCSCC1 34a_100000731022_100020610796 [0,1,0,0,0,1|1,0,1]=4 4022 B12R1.43 O=C([O-])C(F)SC1CCCCC1 62a_100000210327_100020610796 [0,1,0,0,0,1|0,0,1]=3 4023 B12R1.43 O=C([O-])C(F)SC1CCCCC1 62a_100020610796_100000210327 [0,1,0,0,0,1|0,0,1]=3 4024 B12R1.43 O=C([O-])C(F)SC1CCCOC1 62a_100020610796_100000693364 [0,1,0,0,0,1|1,0,1]=4 4025 B12R1.43 O=C([O-])C(F)SC1CCOCC1 62a_100020610796_100011324220 [0,1,0,0,0,1|1,0,1]=4 4026 B12R1.43 O=C([O-])C(F)SC1CCSCC1 62a_100020610796_100000069128 [0,1,0,0,0,1|1,0,1]=4 4027 B12R1.43 [13CH3]C(=O)C(=O)NC1CCCCC1 1458a_200011297149_200025704644 [0,1,0,0,0,1|1,0,1]=4 4028 B12R1.43 [13CH3]C(=O)[C@H](O)CC1CCCCC1 1458a_100016183741_200025704644 [0,1,0,0,0,1|1,0,0]=3 4029 B12R1.107 C=C(C)CC(=O)C1CCCCC1 1458a_100000210647_100000748629 [0,1,0,0,0,1|2,0,0]=4 4030 B12R1.107 C=C(C)CN(C)C1CCCCC1 2230a_100000207522_100000748629 [0,1,0,0,0,1|2,0,0]=4 4031 B12R1.107 C=C(C)CN(C)C1CCCCC1 269982a_100000207522_100000748629 [0,1,0,0,0,1|2,0,0]=4 4032 B12R1.107 C=C(C)CN(C)C1CCCCC1 269982a_100000225649_100000210327 [0,1,0,0,0,1|2,0,0]=4 4033 B12R1.107 C=C(C)CN(C)C1CCCCC1 270004a_100000225649_100000210434 [0,1,0,0,0,1|2,0,0]=4 4034 B12R1.107 C=C(C)CN(C)C1CCCCC1 34a_100000207522_100000748629 [0,1,0,0,0,1|2,0,0]=4 4035 B12R1.107 C=C(F)CC(=O)C1CCCCC1 1458a_100000210647_100009893438 [0,1,0,0,0,1|2,0,0]=4 4036 B12R1.107 C=C(F)CN(C)C1CCCCC1 2230a_100000207522_100009893438 [0,1,0,0,0,1|2,0,0]=4 4037 B12R1.107 C=C(F)CN(C)C1CCCCC1 269982a_100000207522_100009893438 [0,1,0,0,0,1|2,0,0]=4 4038 B12R1.107 C=C(F)CN(C)C1CCCCC1 34a_100000207522_100009893438 [0,1,0,0,0,1|2,0,0]=4 4039 B12R1.107 CC(=O)CC(=O)C1CCCCC1 1458a_100000070787_100000241979 [0,1,0,0,0,1|1,0,0]=3 4040 B12R1.107 CC(=O)CC(=O)C1CCOCC1 1458a_100000070787_100000689883 [0,1,0,0,0,1|2,0,0]=4 4041 B12R1.107 CC(=O)CC(=O)N1CCCCC1 1458a_100000070787_100000183409 [0,1,0,0,0,1|2,0,0]=4 4042 B12R1.107 CC(=O)CC(C)N1CCCCC1 1458a_100015187720_200000210301 [0,1,0,0,0,1|2,0,0]=4 4043 B12R1.107 CC(=O)N[C@H](C)C1CCCCC1 11a_100025707633_100015343762 [0,1,0,0,0,1|1,0,0]=3 4044 B12R1.107 CC(=O)N[C@H](C)C1CCCCC1 1626a_100025707633_100015343762 [0,1,0,0,0,1|1,0,0]=3 4045 B12R1.107 CC(=O)N[C@H](C)C1CCCCC1 240690a_100025707633_100015343762 [0,1,0,0,0,1|1,0,0]=3 4046 B12R1.107 CC(=O)N[C@H](C)C1CCCCC1 527a_100025707633_100103153847 [0,1,0,0,0,1|1,0,0]=3 4047 B12R1.107 CC(CC(=O)[13CH3])N1CCCCC1 1458a_100015187720_200025704644 [0,1,0,0,0,1|2,0,0]=4 4048 B12R1.107 CC(O)CC(=O)C1CCCCC1 1458a_100000210647_100011218427 [0,1,0,0,0,1|1,0,1]=4 4049 B12R1.107 CC(O)CN(C)C1CCCCC1 2230a_100000202029_200000210301 [0,1,0,0,0,1|1,0,1]=4 4050 B12R1.107 CC(O)CN(C)C1CCCCC1 2230a_100000207522_100011218427 [0,1,0,0,0,1|1,0,1]=4 4051 B12R1.107 CC(O)CN(C)C1CCCCC1 269982a_100000202029_200000210301 [0,1,0,0,0,1|1,0,1]=4 4052 B12R1.107 CC(O)CN(C)C1CCCCC1 269982a_100000207522_100011218427 [0,1,0,0,0,1|1,0,1]=4 4053 B12R1.107 CC(O)CN(C)C1CCCCC1 269982a_100000227577_100000210327 [0,1,0,0,0,1|1,0,1]=4 4054 B12R1.107 CC(O)CN(C)C1CCCCC1 270004a_100000227577_100000210434 [0,1,0,0,0,1|1,0,1]=4 4055 B12R1.107 CC(O)CN(C)C1CCCCC1 34a_100000202029_200000210301 [0,1,0,0,0,1|1,0,1]=4 4056 B12R1.107 CC(O)CN(C)C1CCCCC1 34a_100000207522_100011218427 [0,1,0,0,0,1|1,0,1]=4 4057 B12R1.107 CC(O)CN([13CH3])C1CCCCC1 2230a_100000202029_200025704644 [0,1,0,0,0,1|1,0,1]=4 4058 B12R1.107 CC(O)CN([13CH3])C1CCCCC1 269982a_100000202029_200025704644 [0,1,0,0,0,1|1,0,1]=4 4059 B12R1.107 CC(O)CN([13CH3])C1CCCCC1 34a_100000202029_200025704644 [0,1,0,0,0,1|1,0,1]=4 4060 B12R1.107 CN(CC(=O)N)C1CCCCC1 2230a_100000207522_100000747473 [0,1,0,0,0,1|1,0,0]=3 4061 B12R1.107 CN(CC(=O)N)C1CCCCC1 269982a_100000207522_100000187820 [0,1,0,0,0,1|1,0,0]=3 4062 B12R1.107 CN(CC(=O)N)C1CCCCC1 270004a_100000739694_100000210434 [0,1,0,0,0,1|1,0,0]=3 4063 B12R1.107 CN(CC(=O)N)C1CCCCC1 34a_100000207522_100000187820 [0,1,0,0,0,1|1,0,0]=3 4064 B12R1.107 CN(CC(=O)N)C1CCCOC1 270004a_100000739694_100000753404 [0,1,0,0,0,1|2,0,0]=4 4065 B12R1.107 CN(CC(=O)N)C1CCCSC1 270004a_100000739694_100000057913 [0,1,0,0,0,1|2,0,0]=4 4066 B12R1.107 CN(CC(=O)N)C1CCNCC1 270004a_100000739694_100015192401 [0,1,0,0,0,1|2,0,0]=4 4067 B12R1.107 CN(CC(=O)N)C1CCOCC1 2230a_100020587155_100000747473 [0,1,0,0,0,1|2,0,0]=4 4068 B12R1.107 CN(CC(=O)N)C1CCOCC1 269982a_100020587155_100000187820 [0,1,0,0,0,1|2,0,0]=4 4069 B12R1.107 CN(CC(=O)N)C1CCOCC1 270004a_100000739694_100011217826 [0,1,0,0,0,1|2,0,0]=4 4070 B12R1.107 CN(CC(=O)N)C1CCOCC1 34a_100020587155_100000187820 [0,1,0,0,0,1|2,0,0]=4 4071 B12R1.107 CN(CC(=O)N)C1CCSCC1 2230a_100015184757_100000747473 [0,1,0,0,0,1|2,0,0]=4 4072 B12R1.107 CN(CC(=O)N)C1CCSCC1 269982a_100015184757_100000187820 [0,1,0,0,0,1|2,0,0]=4 4073 B12R1.107 CN(CC(=O)N)C1CCSCC1 270004a_100000739694_100000203788 [0,1,0,0,0,1|2,0,0]=4 4074 B12R1.107 CN(CC(=O)N)C1CCSCC1 34a_100015184757_100000187820 [0,1,0,0,0,1|2,0,0]=4 4075 B12R1.107 CN(CC(=O)O)C1C=CCCC1 269956a_100000746989_100000751183 [0,1,0,0,0,1|0,0,2]=4 4076 B12R1.107 CN(CC(=O)O)C1CCCCC1 269956a_100000746989_100000210327 [0,1,0,0,0,1|0,0,0]=2 4077 B12R1.107 CN(CC(=O)O)C1CCCOC1 269956a_100000746989_100000693364 [0,1,0,0,0,1|1,0,0]=3 4078 B12R1.107 CN(CC(=O)O)C1CCOCC1 269956a_100000746989_100011324220 [0,1,0,0,0,1|1,0,0]=3 4079 B12R1.107 CN(CC(=O)O)C1CCSCC1 269956a_100000746989_100000069128 [0,1,0,0,0,1|1,0,0]=3 4080 B12R1.107 CN(CC(=O)[O-])C1CCCCC1 269982a_100000207522_100020667443 [0,1,0,0,0,1|0,0,1]=3 4081 B12R1.107 CN(CC(=O)[O-])C1CCCCC1 34a_100000207522_100020667443 [0,1,0,0,0,1|0,0,1]=3 4082 B12R1.107 CN(CC(=O)[O-])C1CCOCC1 269982a_100020587155_100020667443 [0,1,0,0,0,1|1,0,1]=4 4083 B12R1.107 CN(CC(=O)[O-])C1CCOCC1 34a_100020587155_100020667443 [0,1,0,0,0,1|1,0,1]=4 4084 B12R1.107 CN(CC(=O)[O-])C1CCSCC1 269982a_100015184757_100020667443 [0,1,0,0,0,1|1,0,1]=4 4085 B12R1.107 CN(CC(=O)[O-])C1CCSCC1 34a_100015184757_100020667443 [0,1,0,0,0,1|1,0,1]=4 4086 B12R1.107 CN(C[N+](=O)[O-])C1CCCCC1 269982a_100000207522_100000761209 [0,1,0,0,0,1|1,0,1]=4 4087 B12R1.107 CN(C[N+](=O)[O-])C1CCCCC1 34a_100000207522_100000761209 [0,1,0,0,0,1|1,0,1]=4 4088 B12R1.107 C[C@@H](O)CC(=O)C1CCCCC1 1458a_100011933948_100000210327 [0,1,0,0,0,1|1,0,1]=4 4089 B12R1.107 C[C@@H](O)CN(C)C1CCCCC1 2230a_100000207522_100009817552 [0,1,0,0,0,1|1,0,1]=4 4090 B12R1.107 C[C@@H](O)CN(C)C1CCCCC1 269982a_100000207522_100009817552 [0,1,0,0,0,1|1,0,1]=4 4091 B12R1.107 C[C@@H](O)CN(C)C1CCCCC1 34a_100000207522_100009817552 [0,1,0,0,0,1|1,0,1]=4 4092 B12R1.107 NC(=O)CC(=O)C1CCCCC1 1458a_100000210647_100000187820 [0,1,0,0,0,1|1,0,0]=3 4093 B12R1.107 NC(=O)CC(=O)C1CCCCC1 1458a_100134613110_100000210327 [0,1,0,0,0,1|1,0,0]=3 4094 B12R1.107 NC(=O)CC(=O)C1CCCCO1 1458a_100000748299_100000187820 [0,1,0,0,0,1|2,0,0]=4 4095 B12R1.107 NC(=O)CC(=O)C1CCCOC1 1458a_100000741522_100000187820 [0,1,0,0,0,1|2,0,0]=4 4096 B12R1.107 NC(=O)CC(=O)C1CCCOC1 1458a_100134613110_100000693364 [0,1,0,0,0,1|2,0,0]=4 4097 B12R1.107 NC(=O)CC(=O)C1CCOCC1 1458a_100000195482_100000187820 [0,1,0,0,0,1|2,0,0]=4 4098 B12R1.107 NC(=O)CC(=O)C1CCOCC1 1458a_100134613110_100011324220 [0,1,0,0,0,1|2,0,0]=4 4099 B12R1.107 NC(=O)CC(=O)C1CCSCC1 1458a_100000755232_100000187820 [0,1,0,0,0,1|2,0,0]=4 4100 B12R1.107 O=C(C[N+](=O)[O-])C1CCCCC1 1458a_100000210647_100000761209 [0,1,0,0,0,1|1,0,1]=4 4101 B12R1.107 O=C([O-])CC(=O)C1CCCCC1 1458a_100000210647_100020667443 [0,1,0,0,0,1|0,0,1]=3 4102 B12R1.107 O=C([O-])CC(=O)C1CCCCO1 1458a_100000748299_100020667443 [0,1,0,0,0,1|1,0,1]=4 4103 B12R1.107 O=C([O-])CC(=O)C1CCCOC1 1458a_100000741522_100020667443 [0,1,0,0,0,1|1,0,1]=4 4104 B12R1.107 O=C([O-])CC(=O)C1CCOCC1 1458a_100000195482_100020667443 [0,1,0,0,0,1|1,0,1]=4 4105 B12R1.107 O=C([O-])CC(=O)C1CCSCC1 1458a_100000755232_100020667443 [0,1,0,0,0,1|1,0,1]=4 4106 B12R1.125 C=C(C)CNC1CCCCC1C 2230a_100000211402_100000748629 [0,1,0,0,0,1|2,0,0]=4 4107 B12R1.125 C=C(C)CNC1CCCCC1C 34a_100000211402_100000748629 [0,1,0,0,0,1|2,0,0]=4 4108 B12R1.125 C=C(C)CN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000748629 [0,1,0,0,0,1|2,0,0]=4 4109 B12R1.125 C=C(C)CN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000748629 [0,1,0,0,0,1|2,0,0]=4 4110 B12R1.125 C=C(C)COC1CCCCC1C 34a_100000211207_100000748629 [0,1,0,0,0,1|2,0,0]=4 4111 B12R1.125 C=C(C)COC1CCCCC1C 7a_100000211207_100000748629 [0,1,0,0,0,1|2,0,0]=4 4112 B12R1.125 C=C(C)COC1CCCCC1Cl 34a_100000038908_100000748629 [0,1,0,0,0,1|2,0,0]=4 4113 B12R1.125 C=C(C)COC1CCCCC1Cl 7a_100000038908_100000748629 [0,1,0,0,0,1|2,0,0]=4 4114 B12R1.125 C=C(C)COC1CCCCC1F 34a_100000210245_100015423560 [0,1,0,0,0,1|2,0,0]=4 4115 B12R1.125 C=C(C)COC1CCCCC1O 34a_100000210245_100000038908 [0,1,0,0,0,1|2,0,0]=4 4116 B12R1.125 C=C(C)CO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000748629 [0,1,0,0,0,1|2,0,0]=4 4117 B12R1.125 C=C(C)CO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000748629 [0,1,0,0,0,1|2,0,0]=4 4118 B12R1.125 C=C(C)CO[C@H]1CCCC[C@H]1N 34a_100015191688_100000748629 [0,1,0,0,0,1|2,0,0]=4 4119 B12R1.125 C=C(C)CSC1CCCCC1F 62a_100000748629_100015423560 [0,1,0,0,0,1|2,0,0]=4 4120 B12R1.125 C=C(C)CSC1CCCCC1F 62a_100015423560_100000211660 [0,1,0,0,0,1|2,0,0]=4 4121 B12R1.125 C=C(C)CSC1CCCCC1O 62a_100000038908_100000211660 [0,1,0,0,0,1|2,0,0]=4 4122 B12R1.125 C=C(C)CSC1CCCCC1O 62a_100000748629_100000038908 [0,1,0,0,0,1|2,0,0]=4 4123 B12R1.125 C=C(F)CNC1CCCCC1C 2230a_100000211402_100009893438 [0,1,0,0,0,1|2,0,0]=4 4124 B12R1.125 C=C(F)CNC1CCCCC1C 34a_100000211402_100009893438 [0,1,0,0,0,1|2,0,0]=4 4125 B12R1.125 C=C(F)CN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100009893438 [0,1,0,0,0,1|2,0,0]=4 4126 B12R1.125 C=C(F)CN[C@@H]1CCCC[C@H]1F 34a_100015195156_100009893438 [0,1,0,0,0,1|2,0,0]=4 4127 B12R1.125 C=C(F)COC1CCCCC1C 34a_100000211207_100009893438 [0,1,0,0,0,1|2,0,0]=4 4128 B12R1.125 C=C(F)COC1CCCCC1C 7a_100000211207_100000042424 [0,1,0,0,0,1|2,0,0]=4 4129 B12R1.125 C=C(F)COC1CCCCC1Cl 34a_100000038908_100009893438 [0,1,0,0,0,1|2,0,0]=4 4130 B12R1.125 C=C(F)COC1CCCCC1Cl 7a_100000038908_100000042424 [0,1,0,0,0,1|2,0,0]=4 4131 B12R1.125 C=C(F)COC1CCCCC1F 34a_200010262243_100015423560 [0,1,0,0,0,1|2,0,0]=4 4132 B12R1.125 C=C(F)COC1CCCCC1O 34a_200010262243_100000038908 [0,1,0,0,0,1|2,0,0]=4 4133 B12R1.125 C=C(F)CO[C@@H]1CCCC[C@H]1F 34a_100009816020_100009893438 [0,1,0,0,0,1|2,0,0]=4 4134 B12R1.125 C=C(F)CO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000042424 [0,1,0,0,0,1|2,0,0]=4 4135 B12R1.125 C=C(F)CO[C@H]1CCCC[C@H]1N 34a_100015191688_100009893438 [0,1,0,0,0,1|2,0,0]=4 4136 B12R1.125 C=C(F)CSC1CCCCC1F 62a_100000042424_100015423560 [0,1,0,0,0,1|2,0,0]=4 4137 B12R1.125 C=C(F)CSC1CCCCC1F 62a_100015423560_100000042424 [0,1,0,0,0,1|2,0,0]=4 4138 B12R1.125 C=C(F)CSC1CCCCC1O 62a_100000038908_100000042424 [0,1,0,0,0,1|2,0,0]=4 4139 B12R1.125 C=C(F)CSC1CCCCC1O 62a_100000042424_100000038908 [0,1,0,0,0,1|2,0,0]=4 4140 B12R1.125 CC(=O)CCC1CCCCN1C 1458a_100000070787_100000211948 [0,1,0,0,0,1|2,0,0]=4 4141 B12R1.125 CC(=O)CCC1CCCCN1C 1458a_100000718493_200000210301 [0,1,0,0,0,1|2,0,0]=4 4142 B12R1.125 CC(=O)CCN1CCCCC1C 269982a_100000211376_100000053229 [0,1,0,0,0,1|2,0,0]=4 4143 B12R1.125 CC(=O)COC1CCCCC1=O 34a_100000211253_100000754470 [0,1,0,0,0,1|1,0,1]=4 4144 B12R1.125 CC(=O)COC1CCCCC1C 1458a_100011223357_200000210301 [0,1,0,0,0,1|1,0,0]=3 4145 B12R1.125 CC(=O)COC1CCCCC1F 34a_100000211253_100015423560 [0,1,0,0,0,1|1,0,0]=3 4146 B12R1.125 CC(=O)COC1CCCCC1O 34a_100000211253_100000038908 [0,1,0,0,0,1|1,0,0]=3 4147 B12R1.125 CC(=O)NCC1CCCCC1O 240690a_100011216029_100015343762 [0,1,0,0,0,1|1,0,0]=3 4148 B12R1.125 CC(=O)NCC1CCCCC1O 527a_100011216029_100103153847 [0,1,0,0,0,1|1,0,0]=3 4149 B12R1.125 CC(=O)NCC1CCCCN1C 240690a_100011228421_100015343762 [0,1,0,0,0,1|2,0,0]=4 4150 B12R1.125 CC(=O)NCC1CCCCN1C 527a_100011228421_100103153847 [0,1,0,0,0,1|2,0,0]=4 4151 B12R1.125 CC(=O)OCN1CCCCC1C 269982a_100000211376_100000076356 [0,1,0,0,0,1|2,0,0]=4 4152 B12R1.125 CC(=O)OCN1CCCCC1C 34a_100000211376_100009813279 [0,1,0,0,0,1|2,0,0]=4 4153 B12R1.125 CC(O)CNC1CCCCC1C 2230a_100000211402_100011218427 [0,1,0,0,0,1|1,0,1]=4 4154 B12R1.125 CC(O)CNC1CCCCC1C 269862a_100000210904_100000210921 [0,1,0,0,0,1|1,0,1]=4 4155 B12R1.125 CC(O)CNC1CCCCC1C 270004a_100000210904_100000210921 [0,1,0,0,0,1|1,0,1]=4 4156 B12R1.125 CC(O)CNC1CCCCC1C 34a_100000211402_100011218427 [0,1,0,0,0,1|1,0,1]=4 4157 B12R1.125 CC(O)CNC1CCCCC1F 34a_100000210904_100015423560 [0,1,0,0,0,1|1,0,1]=4 4158 B12R1.125 CC(O)CNC1CCCCC1O 34a_100000210904_100000038908 [0,1,0,0,0,1|1,0,1]=4 4159 B12R1.125 CC(O)CN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100011218427 [0,1,0,0,0,1|1,0,1]=4 4160 B12R1.125 CC(O)CN[C@@H]1CCCC[C@H]1F 34a_100015195156_100011218427 [0,1,0,0,0,1|1,0,1]=4 4161 B12R1.125 CC(O)COC1CCCCC1C 34a_100000211207_100011218427 [0,1,0,0,0,1|1,0,1]=4 4162 B12R1.125 CC(O)COC1CCCCC1C 7a_100000211207_100011218427 [0,1,0,0,0,1|1,0,1]=4 4163 B12R1.125 CC(O)COC1CCCCC1Cl 34a_100000038908_100011218427 [0,1,0,0,0,1|1,0,1]=4 4164 B12R1.125 CC(O)COC1CCCCC1Cl 7a_100000038908_100011218427 [0,1,0,0,0,1|1,0,1]=4 4165 B12R1.125 CC(O)CO[C@@H]1CCCC[C@H]1F 34a_100009816020_100011218427 [0,1,0,0,0,1|1,0,1]=4 4166 B12R1.125 CC(O)CO[C@@H]1CCCC[C@H]1F 7a_100009816020_100011218427 [0,1,0,0,0,1|1,0,1]=4 4167 B12R1.125 CC(O)CO[C@H]1CCCC[C@H]1N 34a_100015191688_100011218427 [0,1,0,0,0,1|1,0,1]=4 4168 B12R1.125 CC(O)CSC1CCCCC1F 62a_100011218427_100015423560 [0,1,0,0,0,1|1,0,1]=4 4169 B12R1.125 CC(O)CSC1CCCCC1F 62a_100015423560_100011218427 [0,1,0,0,0,1|1,0,1]=4 4170 B12R1.125 CC(O)CSC1CCCCC1O 62a_100000038908_100011218427 [0,1,0,0,0,1|1,0,1]=4 4171 B12R1.125 CC(O)CSC1CCCCC1O 62a_100011218427_100000038908 [0,1,0,0,0,1|1,0,1]=4 4172 B12R1.125 CC1CCCCC1NCC(=O)N 2230a_100000211402_100000747473 [0,1,0,0,0,1|1,0,0]=3 4173 B12R1.125 CC1CCCCC1NCC(=O)N 34a_100000211402_100000187820 [0,1,0,0,0,1|1,0,0]=3 4174 B12R1.125 CC1CCCCC1NCC(=O)[O-] 34a_100000211402_100020667443 [0,1,0,0,0,1|0,0,1]=3 4175 B12R1.125 CC1CCCCC1NC[C@@H](C)O 2230a_100000211402_100009817552 [0,1,0,0,0,1|1,0,1]=4 4176 B12R1.125 CC1CCCCC1NC[C@@H](C)O 34a_100000211402_100009817552 [0,1,0,0,0,1|1,0,1]=4 4177 B12R1.125 CC1CCCCC1NC[N+](=O)[O-] 34a_100000211402_100000761209 [0,1,0,0,0,1|1,0,1]=4 4178 B12R1.125 CC1CCCCC1OCC(=O)N 34a_100000211207_100000187820 [0,1,0,0,0,1|1,0,0]=3 4179 B12R1.125 CC1CCCCC1OCC(=O)N 7a_100000211207_100000187820 [0,1,0,0,0,1|1,0,0]=3 4180 B12R1.125 CC1CCCCC1OCC(=O)[13CH3] 1458a_100011223357_200025704644 [0,1,0,0,0,1|1,0,0]=3 4181 B12R1.125 CC1CCCCC1OCC(=O)[O-] 34a_100000211207_100020667443 [0,1,0,0,0,1|0,0,1]=3 4182 B12R1.125 CC1CCCCC1OC[C@@H](C)O 34a_100000211207_100009817552 [0,1,0,0,0,1|1,0,1]=4 4183 B12R1.125 CC1CCCCC1OC[C@@H](C)O 7a_100000211207_100009817552 [0,1,0,0,0,1|1,0,1]=4 4184 B12R1.125 CC1CCCCC1OC[N+](=O)[O-] 34a_100000211207_100000761209 [0,1,0,0,0,1|1,0,1]=4 4185 B12R1.125 CC1CCCCN1CCC(=O)N 2230a_100000211376_100000744528 [0,1,0,0,0,1|2,0,0]=4 4186 B12R1.125 CC1CCCCN1CCC(=O)N 269982a_100000211376_100000744528 [0,1,0,0,0,1|2,0,0]=4 4187 B12R1.125 CC1CCCCN1CCC(=O)N 34a_100000211376_100000731001 [0,1,0,0,0,1|2,0,0]=4 4188 B12R1.125 CC1CCNCC1OCC(=O)N 34a_100000696640_100000187820 [0,1,0,0,0,1|2,0,0]=4 4189 B12R1.125 CC1CCNCC1OCC(=O)[O-] 34a_100000696640_100020667443 [0,1,0,0,0,1|1,0,1]=4 4190 B12R1.125 CC1CNCCC1OCC(=O)N 34a_100011998114_100000187820 [0,1,0,0,0,1|2,0,0]=4 4191 B12R1.125 CC1CNCCC1OCC(=O)[O-] 34a_100011998114_100020667443 [0,1,0,0,0,1|1,0,1]=4 4192 B12R1.125 CN1CCCCC1CCC(=O)O 269956a_100000694054_200000210301 [0,1,0,0,0,1|1,0,0]=3 4193 B12R1.125 CN1CCCCC1CCC(=O)[13CH3] 1458a_100000718493_200025704644 [0,1,0,0,0,1|2,0,0]=4 4194 B12R1.125 C[C@@H](O)CN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100009817552 [0,1,0,0,0,1|1,0,1]=4 4195 B12R1.125 C[C@@H](O)CN[C@@H]1CCCC[C@H]1F 34a_100015195156_100009817552 [0,1,0,0,0,1|1,0,1]=4 4196 B12R1.125 C[C@@H](O)COC1CCCCC1Cl 34a_100000038908_100009817552 [0,1,0,0,0,1|1,0,1]=4 4197 B12R1.125 C[C@@H](O)COC1CCCCC1Cl 7a_100000038908_100009817552 [0,1,0,0,0,1|1,0,1]=4 4198 B12R1.125 C[C@@H](O)CO[C@@H]1CCCC[C@H]1F 34a_100009816020_100009817552 [0,1,0,0,0,1|1,0,1]=4 4199 B12R1.125 C[C@@H](O)CO[C@@H]1CCCC[C@H]1F 7a_100009816020_100009817552 [0,1,0,0,0,1|1,0,1]=4 4200 B12R1.125 C[C@@H](O)CO[C@H]1CCCC[C@H]1N 34a_100015191688_100009817552 [0,1,0,0,0,1|1,0,1]=4 4201 B12R1.125 C[C@@H](O)CSC1CCCCC1F 62a_100009817552_100015423560 [0,1,0,0,0,1|1,0,1]=4 4202 B12R1.125 C[C@@H](O)CSC1CCCCC1F 62a_100015423560_100009817552 [0,1,0,0,0,1|1,0,1]=4 4203 B12R1.125 C[C@@H](O)CSC1CCCCC1O 62a_100000038908_100009817552 [0,1,0,0,0,1|1,0,1]=4 4204 B12R1.125 C[C@@H](O)CSC1CCCCC1O 62a_100009817552_100000038908 [0,1,0,0,0,1|1,0,1]=4 4205 B12R1.125 NC(=O)CN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000747473 [0,1,0,0,0,1|1,0,0]=3 4206 B12R1.125 NC(=O)CN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000187820 [0,1,0,0,0,1|1,0,0]=3 4207 B12R1.125 NC(=O)CN[C@@H]1CCOC[C@@H]1O 2230a_100016994285_100000747473 [0,1,0,0,0,1|2,0,0]=4 4208 B12R1.125 NC(=O)CN[C@H]1CCOC[C@@H]1F 2230a_100016994078_100000747473 [0,1,0,0,0,1|2,0,0]=4 4209 B12R1.125 NC(=O)CN[C@H]1CCOC[C@@H]1F 34a_100016994078_100000187820 [0,1,0,0,0,1|2,0,0]=4 4210 B12R1.125 NC(=O)CN[C@H]1COCC[C@@H]1O 2230a_100015739063_100000747473 [0,1,0,0,0,1|2,0,0]=4 4211 B12R1.125 NC(=O)COC1CCCCC1=O 34a_100011214950_100000187820 [0,1,0,0,0,1|1,0,1]=4 4212 B12R1.125 NC(=O)COC1CCCCC1Cl 34a_100000038908_100000187820 [0,1,0,0,0,1|1,0,0]=3 4213 B12R1.125 NC(=O)COC1CCCCC1Cl 7a_100000038908_100000187820 [0,1,0,0,0,1|1,0,0]=3 4214 B12R1.125 NC(=O)CO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000187820 [0,1,0,0,0,1|1,0,0]=3 4215 B12R1.125 NC(=O)CO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000187820 [0,1,0,0,0,1|1,0,0]=3 4216 B12R1.125 NC(=O)CO[C@@H]1CCNC[C@@H]1F 34a_200016994291_100000187820 [0,1,0,0,0,1|2,0,0]=4 4217 B12R1.125 NC(=O)CO[C@H]1CCCC[C@H]1N 34a_100015191688_100000187820 [0,1,0,0,0,1|1,0,0]=3 4218 B12R1.125 NC(=O)CO[C@H]1CCOC[C@@H]1N 34a_100015739063_100000187820 [0,1,0,0,0,1|2,0,0]=4 4219 B12R1.125 NC(=O)CO[C@H]1COCC[C@H]1N 34a_100016994285_100000187820 [0,1,0,0,0,1|2,0,0]=4 4220 B12R1.125 NC(=O)CSC1CCCCC1=O 62a_100000204591_100000747473 [0,1,0,0,0,1|1,0,1]=4 4221 B12R1.125 NC(=O)CSC1CCCCC1=O 62a_100000747473_100000204591 [0,1,0,0,0,1|1,0,1]=4 4222 B12R1.125 NC(=O)CSC1CCCCC1F 62a_100000747473_100015423560 [0,1,0,0,0,1|1,0,0]=3 4223 B12R1.125 NC(=O)CSC1CCCCC1F 62a_100015423560_100000747473 [0,1,0,0,0,1|1,0,0]=3 4224 B12R1.125 NC(=O)CSC1CCCCC1O 62a_100000038908_100000747473 [0,1,0,0,0,1|1,0,0]=3 4225 B12R1.125 NC(=O)CSC1CCCCC1O 62a_100000747473_100000038908 [0,1,0,0,0,1|1,0,0]=3 4226 B12R1.125 N[C@@H]1CCCC[C@@H]1OCC(=O)[O-] 34a_100015191688_100020667443 [0,1,0,0,0,1|0,0,1]=3 4227 B12R1.125 N[C@@H]1CCCC[C@@H]1OC[N+](=O)[O-] 34a_100015191688_100000761209 [0,1,0,0,0,1|1,0,1]=4 4228 B12R1.125 N[C@@H]1CCOC[C@@H]1OCC(=O)[O-] 34a_100016994285_100020667443 [0,1,0,0,0,1|1,0,1]=4 4229 B12R1.125 N[C@H]1COCC[C@@H]1OCC(=O)[O-] 34a_100015739063_100020667443 [0,1,0,0,0,1|1,0,1]=4 4230 B12R1.125 O=C(O)CNC1CCCCC1=O 269956a_100016091260_100000204591 [0,1,0,0,0,1|0,0,1]=3 4231 B12R1.125 O=C(O)CNC1CCCCC1F 269956a_100016091260_100015423560 [0,1,0,0,0,1|0,0,0]=2 4232 B12R1.125 O=C(O)CNC1CCCCC1O 269956a_100016091260_100000038908 [0,1,0,0,0,1|0,0,0]=2 4233 B12R1.125 O=C(O)CNC1CCCNC1=O 269956a_100016091260_100000687798 [0,1,0,0,0,1|1,0,1]=4 4234 B12R1.125 O=C(O)CNC1COCCC1=O 269956a_100016091260_100012180262 [0,1,0,0,0,1|1,0,1]=4 4235 B12R1.125 O=C([O-])CN[C@@H]1CCCC[C@H]1F 34a_100015195156_100020667443 [0,1,0,0,0,1|0,0,1]=3 4236 B12R1.125 O=C([O-])CN[C@H]1CCOC[C@@H]1F 34a_100016994078_100020667443 [0,1,0,0,0,1|1,0,1]=4 4237 B12R1.125 O=C([O-])COC1CCCCC1=O 34a_100011214950_100020667443 [0,1,0,0,0,1|0,0,2]=4 4238 B12R1.125 O=C([O-])COC1CCCCC1Cl 34a_100000038908_100020667443 [0,1,0,0,0,1|0,0,1]=3 4239 B12R1.125 O=C([O-])CO[C@@H]1CCCC[C@H]1F 34a_100009816020_100020667443 [0,1,0,0,0,1|0,0,1]=3 4240 B12R1.125 O=C([O-])CO[C@@H]1CCNC[C@@H]1F 34a_200016994291_100020667443 [0,1,0,0,0,1|1,0,1]=4 4241 B12R1.125 O=C([O-])CSC1CCCCC1=O 62a_100000204591_100020667443 [0,1,0,0,0,1|0,0,2]=4 4242 B12R1.125 O=C([O-])CSC1CCCCC1=O 62a_100020667443_100000204591 [0,1,0,0,0,1|0,0,2]=4 4243 B12R1.125 O=C([O-])CSC1CCCCC1F 62a_100015423560_100020667443 [0,1,0,0,0,1|0,0,1]=3 4244 B12R1.125 O=C([O-])CSC1CCCCC1F 62a_100020667443_100015423560 [0,1,0,0,0,1|0,0,1]=3 4245 B12R1.125 O=C([O-])CSC1CCCCC1O 62a_100000038908_100020667443 [0,1,0,0,0,1|0,0,1]=3 4246 B12R1.125 O=C([O-])CSC1CCCCC1O 62a_100020667443_100000038908 [0,1,0,0,0,1|0,0,1]=3 4247 B12R1.125 O=[N+]([O-])CN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000761209 [0,1,0,0,0,1|1,0,1]=4 4248 B12R1.125 O=[N+]([O-])COC1CCCCC1Cl 34a_100000038908_100000761209 [0,1,0,0,0,1|1,0,1]=4 4249 B12R1.125 O=[N+]([O-])CO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000761209 [0,1,0,0,0,1|1,0,1]=4 4250 B12R1.125 O=[N+]([O-])CSC1CCCCC1F 62a_100015423560_100000761209 [0,1,0,0,0,1|1,0,1]=4 4251 B12R1.125 O=[N+]([O-])CSC1CCCCC1O 62a_100000038908_100000761209 [0,1,0,0,0,1|1,0,1]=4 4252 B12R1.125 [13CH3]N1CCCCC1CCC(=O)O 269956a_100000694054_200025704644 [0,1,0,0,0,1|1,0,0]=3 4253 B12R1.226 C=C(C)CNC1CCCC(C1)C 2230a_100011194320_100000748629 [0,1,0,0,0,1|2,0,0]=4 4254 B12R1.226 C=C(C)CNC1CCCC(C1)C 34a_100011194320_100000748629 [0,1,0,0,0,1|2,0,0]=4 4255 B12R1.226 C=C(C)CNC1CCCC(C1)O 2230a_100015190357_100000748629 [0,1,0,0,0,1|2,0,0]=4 4256 B12R1.226 C=C(C)COC1CCCC(C1)C 34a_100000211399_100000748629 [0,1,0,0,0,1|2,0,0]=4 4257 B12R1.226 C=C(F)CNC1CCCC(C1)C 2230a_100011194320_100009893438 [0,1,0,0,0,1|2,0,0]=4 4258 B12R1.226 C=C(F)CNC1CCCC(C1)C 34a_100011194320_100009893438 [0,1,0,0,0,1|2,0,0]=4 4259 B12R1.226 C=C(F)CNC1CCCC(C1)O 2230a_100015190357_100009893438 [0,1,0,0,0,1|2,0,0]=4 4260 B12R1.226 C=C(F)COC1CCCC(C1)C 34a_100000211399_100009893438 [0,1,0,0,0,1|2,0,0]=4 4261 B12R1.226 CC(=O)CCC1CCCN(C1)C 1458a_100015186358_200000210301 [0,1,0,0,0,1|2,0,0]=4 4262 B12R1.226 CC(=O)CCN1CCCC(C1)C 1458a_100000070787_100000766211 [0,1,0,0,0,1|2,0,0]=4 4263 B12R1.226 CC(=O)CCN1CCCC(C1)C 1458a_200000177587_200000210301 [0,1,0,0,0,1|2,0,0]=4 4264 B12R1.226 CC(=O)CCN1CCCC(C1)F 269982a_100000697950_100000053229 [0,1,0,0,0,1|2,0,0]=4 4265 B12R1.226 CC(=O)CCN1CCCC(C1)O 269982a_100000211013_100000053229 [0,1,0,0,0,1|2,0,0]=4 4266 B12R1.226 CC(=O)CCN1CCC[C@@H](C1)C 269982a_100000717927_100000053229 [0,1,0,0,0,1|2,0,0]=4 4267 B12R1.226 CC(=O)NCC1CCCC(C1)O 1626a_100011254705_100015343762 [0,1,0,0,0,1|1,0,0]=3 4268 B12R1.226 CC(=O)NCC1CCCC(C1)O 240690a_100011254705_100015343762 [0,1,0,0,0,1|1,0,0]=3 4269 B12R1.226 CC(=O)NCC1CCCC(C1)O 527a_100011254705_100103153847 [0,1,0,0,0,1|1,0,0]=3 4270 B12R1.226 CC(=O)NCC1CCCN(C1)C 2230a_100011207013_200000210301 [0,1,0,0,0,1|2,0,0]=4 4271 B12R1.226 CC(=O)NCC1CCCN(C1)C 269982a_100011207013_200000210301 [0,1,0,0,0,1|2,0,0]=4 4272 B12R1.226 CC(=O)NCC1CCCN(C1)C 34a_100011207013_200000210301 [0,1,0,0,0,1|2,0,0]=4 4273 B12R1.226 CC(=O)NCC1CCCN(C1)[13CH3] 2230a_100011207013_200025704644 [0,1,0,0,0,1|2,0,0]=4 4274 B12R1.226 CC(=O)NCC1CCCN(C1)[13CH3] 269982a_100011207013_200025704644 [0,1,0,0,0,1|2,0,0]=4 4275 B12R1.226 CC(=O)NCC1CCCN(C1)[13CH3] 34a_100011207013_200025704644 [0,1,0,0,0,1|2,0,0]=4 4276 B12R1.226 CC(=O)NC[C@@H]1CCCN(C1)C 240690a_100016993746_100015343762 [0,1,0,0,0,1|2,0,0]=4 4277 B12R1.226 CC(=O)NC[C@@H]1CCCN(C1)C 527a_100016993746_100103153847 [0,1,0,0,0,1|2,0,0]=4 4278 B12R1.226 CC(=O)OCC1CCCN(C1)C 2230a_100025751563_200000210301 [0,1,0,0,0,1|2,0,0]=4 4279 B12R1.226 CC(=O)OCC1CCCN(C1)C 269982a_100025751563_200000210301 [0,1,0,0,0,1|2,0,0]=4 4280 B12R1.226 CC(=O)OCC1CCCN(C1)[13CH3] 2230a_100025751563_200025704644 [0,1,0,0,0,1|2,0,0]=4 4281 B12R1.226 CC(=O)OCC1CCCN(C1)[13CH3] 269982a_100025751563_200025704644 [0,1,0,0,0,1|2,0,0]=4 4282 B12R1.226 CC(=O)OCN1CCCC(C1)F 269982a_100000697950_100000076356 [0,1,0,0,0,1|2,0,0]=4 4283 B12R1.226 CC(=O)OCN1CCCC(C1)F 34a_100000697950_100009813279 [0,1,0,0,0,1|2,0,0]=4 4284 B12R1.226 CC(=O)OCN1CCCC(C1)O 269982a_100000211013_100000076356 [0,1,0,0,0,1|2,0,0]=4 4285 B12R1.226 CC(=O)OCN1CCC[C@@H](C1)C 269982a_100000717927_100000076356 [0,1,0,0,0,1|2,0,0]=4 4286 B12R1.226 CC(=O)OCN1CCC[C@@H](C1)C 34a_100000717927_100009813279 [0,1,0,0,0,1|2,0,0]=4 4287 B12R1.226 CC(O)CNC1CCCC(C1)C 2230a_100011194320_100011218427 [0,1,0,0,0,1|1,0,1]=4 4288 B12R1.226 CC(O)CNC1CCCC(C1)C 270004a_100000210904_100000183594 [0,1,0,0,0,1|1,0,1]=4 4289 B12R1.226 CC(O)CNC1CCCC(C1)C 34a_100011194320_100011218427 [0,1,0,0,0,1|1,0,1]=4 4290 B12R1.226 CC(O)CNC1CCCC(C1)O 2230a_100015190357_100011218427 [0,1,0,0,0,1|1,0,1]=4 4291 B12R1.226 CC(O)CNC1CCCC(C1)O 270004a_100000210904_100012613340 [0,1,0,0,0,1|1,0,1]=4 4292 B12R1.226 CC(O)COC1CCCC(C1)C 34a_100000211399_100011218427 [0,1,0,0,0,1|1,0,1]=4 4293 B12R1.226 CC1CC(CCO1)OCC(=O)N 34a_100011986385_100000187820 [0,1,0,0,0,1|2,0,0]=4 4294 B12R1.226 CC1CC(CCO1)OCC(=O)N 7a_100011986385_100000187820 [0,1,0,0,0,1|2,0,0]=4 4295 B12R1.226 CC1CC(CCO1)OCC(=O)[O-] 34a_100011986385_100020667443 [0,1,0,0,0,1|1,0,1]=4 4296 B12R1.226 CC1CCCC(C1)NCC(=O)N 2230a_100011194320_100000747473 [0,1,0,0,0,1|1,0,0]=3 4297 B12R1.226 CC1CCCC(C1)NCC(=O)N 34a_100011194320_100000187820 [0,1,0,0,0,1|1,0,0]=3 4298 B12R1.226 CC1CCCC(C1)NCC(=O)[O-] 34a_100011194320_100020667443 [0,1,0,0,0,1|0,0,1]=3 4299 B12R1.226 CC1CCCC(C1)NC[C@@H](C)O 2230a_100011194320_100009817552 [0,1,0,0,0,1|1,0,1]=4 4300 B12R1.226 CC1CCCC(C1)NC[C@@H](C)O 34a_100011194320_100009817552 [0,1,0,0,0,1|1,0,1]=4 4301 B12R1.226 CC1CCCC(C1)NC[N+](=O)[O-] 34a_100011194320_100000761209 [0,1,0,0,0,1|1,0,1]=4 4302 B12R1.226 CC1CCCC(C1)OCC(=O)N 34a_100000211399_100000187820 [0,1,0,0,0,1|1,0,0]=3 4303 B12R1.226 CC1CCCC(C1)OCC(=O)[O-] 34a_100000211399_100020667443 [0,1,0,0,0,1|0,0,1]=3 4304 B12R1.226 CC1CCCC(C1)OC[C@@H](C)O 34a_100000211399_100009817552 [0,1,0,0,0,1|1,0,1]=4 4305 B12R1.226 CC1CCCC(C1)OC[N+](=O)[O-] 34a_100000211399_100000761209 [0,1,0,0,0,1|1,0,1]=4 4306 B12R1.226 CC1CCCN(C1)CCC(=O)[13CH3] 1458a_200000177587_200025704644 [0,1,0,0,0,1|2,0,0]=4 4307 B12R1.226 CN1CCCC(C1)CCC(=O)N 2230a_100011533967_200000210301 [0,1,0,0,0,1|2,0,0]=4 4308 B12R1.226 CN1CCCC(C1)CCC(=O)N 269982a_100011533967_200000210301 [0,1,0,0,0,1|2,0,0]=4 4309 B12R1.226 CN1CCCC(C1)CCC(=O)N 34a_100011533967_200000210301 [0,1,0,0,0,1|2,0,0]=4 4310 B12R1.226 CN1CCCC(C1)CCC(=O)[13CH3] 1458a_100015186358_200025704644 [0,1,0,0,0,1|2,0,0]=4 4311 B12R1.226 C[C@@H](O)CNC1CCCC(C1)O 2230a_100015190357_100009817552 [0,1,0,0,0,1|1,0,1]=4 4312 B12R1.226 C[C@H]1CCCN(C1)CCC(=O)N 2230a_100000717927_100000744528 [0,1,0,0,0,1|2,0,0]=4 4313 B12R1.226 C[C@H]1CCCN(C1)CCC(=O)N 269982a_100000717927_100000744528 [0,1,0,0,0,1|2,0,0]=4 4314 B12R1.226 C[C@H]1CCCN(C1)CCC(=O)N 34a_100000717927_100000731001 [0,1,0,0,0,1|2,0,0]=4 4315 B12R1.226 NC(=O)CCN1CCCC(C1)F 2230a_100000697950_100000744528 [0,1,0,0,0,1|2,0,0]=4 4316 B12R1.226 NC(=O)CCN1CCCC(C1)F 269982a_100000697950_100000744528 [0,1,0,0,0,1|2,0,0]=4 4317 B12R1.226 NC(=O)CCN1CCCC(C1)F 34a_100000697950_100000731001 [0,1,0,0,0,1|2,0,0]=4 4318 B12R1.226 NC(=O)CCN1CCCC(C1)O 2230a_100000211013_100000744528 [0,1,0,0,0,1|2,0,0]=4 4319 B12R1.226 NC(=O)CCN1CCCC(C1)O 269982a_100000211013_100000744528 [0,1,0,0,0,1|2,0,0]=4 4320 B12R1.226 NC(=O)CNC1CCCC(C1)O 2230a_100015190357_100000747473 [0,1,0,0,0,1|1,0,0]=3 4321 B12R1.226 NC(=O)COC1CCCC(=O)C1 34a_100012613340_100000187820 [0,1,0,0,0,1|1,0,1]=4 4322 B12R1.226 O=C([O-])COC1CCCC(=O)C1 34a_100012613340_100020667443 [0,1,0,0,0,1|0,0,2]=4 4323 B12R1.226 [13CH3]N1CCCC(C1)CCC(=O)N 2230a_100011533967_200025704644 [0,1,0,0,0,1|2,0,0]=4 4324 B12R1.226 [13CH3]N1CCCC(C1)CCC(=O)N 269982a_100011533967_200025704644 [0,1,0,0,0,1|2,0,0]=4 4325 B12R1.226 [13CH3]N1CCCC(C1)CCC(=O)N 34a_100011533967_200025704644 [0,1,0,0,0,1|2,0,0]=4 4326 B12R1.891 CC(C)(O)CNC1CCCCC1 270004a_100000751335_100000210434 [0,1,0,0,0,1|1,0,1]=4 4327 B12R1.891 CC(C)(O)CNC1CCCCC1 34a_100000182618_100000764493 [0,1,0,0,0,1|1,0,1]=4 4328 B12R1.891 CC(C)(O)COC1CCCCC1 34a_100000210231_100000764493 [0,1,0,0,0,1|1,0,1]=4 4329 B12R1.891 CC(C)(O)COC1CCCCC1 7a_100000210231_100000764493 [0,1,0,0,0,1|1,0,1]=4 4330 B12R1.891 CC(C)(O)CSC1CCCCC1 62a_100000210327_100000764493 [0,1,0,0,0,1|1,0,1]=4 4331 B12R1.891 CC(C)(O)CSC1CCCCC1 62a_100000764493_100000210327 [0,1,0,0,0,1|1,0,1]=4 4332 B12R1.891 CS(=O)(=O)NCC1CCCCC1 40a_100000210473_100000738038 [0,1,0,0,0,1|1,0,1]=4 4333 B12R1.891 NS(=O)(=O)CSC1CCCCC1 62a_100000210327_100000741382 [0,1,0,0,0,1|1,0,1]=4 4334 B12R1.891 NS(=O)(=O)CSC1CCCCC1 62a_100000741382_100000210327 [0,1,0,0,0,1|1,0,1]=4 4335 B12R1.891 O=S(=O)([O-])CNC1CCCCC1 34a_100000182618_100009817235 [0,1,0,0,0,1|1,0,1]=4 4336 B12R1.891 O=S(=O)([O-])COC1CCCCC1 34a_100000210231_100009817235 [0,1,0,0,0,1|1,0,1]=4 4337 B12R1.891 O=S(=O)([O-])CSC1CCCCC1 62a_100000210327_100009817235 [0,1,0,0,0,1|1,0,1]=4 4338 B12R1.891 O=S(=O)([O-])CSC1CCCCC1 62a_100009817235_100000210327 [0,1,0,0,0,1|1,0,1]=4 4339 B12R1.3110 C=C(C)CNC1(CCCCC1)C 2230a_100000741114_100000748629 [0,1,0,0,0,1|2,0,0]=4 4340 B12R1.3110 C=C(C)CNC1(CCCCC1)C 34a_100000741114_100000748629 [0,1,0,0,0,1|2,0,0]=4 4341 B12R1.3110 C=C(C)COC1(CCCCC1)C 34a_100011215885_100000748629 [0,1,0,0,0,1|2,0,0]=4 4342 B12R1.3110 C=C(C)COC1(CCCCC1)C 7a_100011215885_100000748629 [0,1,0,0,0,1|2,0,0]=4 4343 B12R1.3110 C=C(F)CNC1(CCCCC1)C 2230a_100000741114_100009893438 [0,1,0,0,0,1|2,0,0]=4 4344 B12R1.3110 C=C(F)CNC1(CCCCC1)C 34a_100000741114_100009893438 [0,1,0,0,0,1|2,0,0]=4 4345 B12R1.3110 C=C(F)COC1(CCCCC1)C 34a_100011215885_100009893438 [0,1,0,0,0,1|2,0,0]=4 4346 B12R1.3110 C=C(F)COC1(CCCCC1)C 7a_100011215885_100000042424 [0,1,0,0,0,1|2,0,0]=4 4347 B12R1.3110 CC(=O)NCC1(CCCCC1)C 11a_100000706052_100015343762 [0,1,0,0,0,1|1,0,0]=3 4348 B12R1.3110 CC(=O)NCC1(CCCCC1)C 1626a_100000706052_100015343762 [0,1,0,0,0,1|1,0,0]=3 4349 B12R1.3110 CC(=O)NCC1(CCCCC1)C 240690a_100000706052_100015343762 [0,1,0,0,0,1|1,0,0]=3 4350 B12R1.3110 CC(=O)NCC1(CCCCC1)C 527a_100000706052_100103153847 [0,1,0,0,0,1|1,0,0]=3 4351 B12R1.3110 CC(=O)NCC1(CCCCC1)O 11a_100000748649_100015343762 [0,1,0,0,0,1|1,0,0]=3 4352 B12R1.3110 CC(=O)NCC1(CCCCC1)O 1626a_100000748649_100015343762 [0,1,0,0,0,1|1,0,0]=3 4353 B12R1.3110 CC(=O)NCC1(CCCCC1)O 240690a_100000748649_100015343762 [0,1,0,0,0,1|1,0,0]=3 4354 B12R1.3110 CC(=O)NCC1(CCCCC1)O 527a_100000748649_100103153847 [0,1,0,0,0,1|1,0,0]=3 4355 B12R1.3110 CC(=O)NCC1(CCOCC1)C 11a_100000695556_100015343762 [0,1,0,0,0,1|2,0,0]=4 4356 B12R1.3110 CC(=O)NCC1(CCOCC1)C 1626a_100000695556_100015343762 [0,1,0,0,0,1|2,0,0]=4 4357 B12R1.3110 CC(=O)NCC1(CCOCC1)C 240690a_100000695556_100015343762 [0,1,0,0,0,1|2,0,0]=4 4358 B12R1.3110 CC(=O)NCC1(CCOCC1)C 527a_100000695556_100103153847 [0,1,0,0,0,1|2,0,0]=4 4359 B12R1.3110 CC(=O)NCC1(CCOCC1)F 11a_100016991512_100015343762 [0,1,0,0,0,1|2,0,0]=4 4360 B12R1.3110 CC(=O)NCC1(CCOCC1)F 1626a_100016991512_100015343762 [0,1,0,0,0,1|2,0,0]=4 4361 B12R1.3110 CC(=O)NCC1(CCOCC1)F 240690a_100016991512_100015343762 [0,1,0,0,0,1|2,0,0]=4 4362 B12R1.3110 CC(=O)NCC1(CCOCC1)F 527a_100016991512_100103153847 [0,1,0,0,0,1|2,0,0]=4 4363 B12R1.3110 CC(=O)NCC1(CCOCC1)O 11a_100000704115_100015343762 [0,1,0,0,0,1|2,0,0]=4 4364 B12R1.3110 CC(=O)NCC1(CCOCC1)O 240690a_100000704115_100015343762 [0,1,0,0,0,1|2,0,0]=4 4365 B12R1.3110 CC(=O)NCC1(CCOCC1)O 527a_100000704115_100103153847 [0,1,0,0,0,1|2,0,0]=4 4366 B12R1.3110 CC(=O)NCC1(CCSCC1)O 11a_100000758141_100015343762 [0,1,0,0,0,1|2,0,0]=4 4367 B12R1.3110 CC(=O)NCC1(CCSCC1)O 240690a_100000758141_100015343762 [0,1,0,0,0,1|2,0,0]=4 4368 B12R1.3110 CC(=O)NCC1(CCSCC1)O 527a_100000758141_100103153847 [0,1,0,0,0,1|2,0,0]=4 4369 B12R1.3110 CC(O)CNC1(CCCCC1)C 2230a_100000741114_100011218427 [0,1,0,0,0,1|1,0,1]=4 4370 B12R1.3110 CC(O)CNC1(CCCCC1)C 34a_100000741114_100011218427 [0,1,0,0,0,1|1,0,1]=4 4371 B12R1.3110 CC(O)COC1(CCCCC1)C 34a_100011215885_100011218427 [0,1,0,0,0,1|1,0,1]=4 4372 B12R1.3110 CC(O)COC1(CCCCC1)C 7a_100011215885_100011218427 [0,1,0,0,0,1|1,0,1]=4 4373 B12R1.3110 CC1(CCCCC1)NCC(=O)N 2230a_100000741114_100000747473 [0,1,0,0,0,1|1,0,0]=3 4374 B12R1.3110 CC1(CCCCC1)NCC(=O)N 34a_100000741114_100000187820 [0,1,0,0,0,1|1,0,0]=3 4375 B12R1.3110 CC1(CCCCC1)NCC(=O)[O-] 34a_100000741114_100020667443 [0,1,0,0,0,1|0,0,1]=3 4376 B12R1.3110 CC1(CCCCC1)NC[N+](=O)[O-] 34a_100000741114_100000761209 [0,1,0,0,0,1|1,0,1]=4 4377 B12R1.3110 CC1(CCCCC1)OCC(=O)N 34a_100011215885_100000187820 [0,1,0,0,0,1|1,0,0]=3 4378 B12R1.3110 CC1(CCCCC1)OCC(=O)N 7a_100011215885_100000187820 [0,1,0,0,0,1|1,0,0]=3 4379 B12R1.3110 CC1(CCCCC1)OCC(=O)[O-] 34a_100011215885_100020667443 [0,1,0,0,0,1|0,0,1]=3 4380 B12R1.3110 CC1(CCCCC1)OC[N+](=O)[O-] 34a_100011215885_100000761209 [0,1,0,0,0,1|1,0,1]=4 4381 B12R1.3110 CC1(CCOCC1)NCC(=O)N 2230a_100000692449_100000747473 [0,1,0,0,0,1|2,0,0]=4 4382 B12R1.3110 CC1(CCOCC1)NCC(=O)N 34a_100000692449_100000187820 [0,1,0,0,0,1|2,0,0]=4 4383 B12R1.3110 CC1(CCOCC1)NCC(=O)[O-] 34a_100000692449_100020667443 [0,1,0,0,0,1|1,0,1]=4 4384 B12R1.3110 CC1(CCOCC1)OCC(=O)N 34a_100011827762_100000187820 [0,1,0,0,0,1|2,0,0]=4 4385 B12R1.3110 CC1(CCOCC1)OCC(=O)N 7a_100011827762_100000187820 [0,1,0,0,0,1|2,0,0]=4 4386 B12R1.3110 CC1(CCOCC1)OCC(=O)[O-] 34a_100011827762_100020667443 [0,1,0,0,0,1|1,0,1]=4 4387 B12R1.3110 CC1(CCSCC1)OCC(=O)N 34a_200011004327_100000187820 [0,1,0,0,0,1|2,0,0]=4 4388 B12R1.3110 CC1(CCSCC1)OCC(=O)N 7a_200011004327_100000187820 [0,1,0,0,0,1|2,0,0]=4 4389 B12R1.3110 CC1(CCSCC1)OCC(=O)[O-] 34a_200011004327_100020667443 [0,1,0,0,0,1|1,0,1]=4 4390 B12R1.3110 C[C@@H](O)CNC1(CCCCC1)C 2230a_100000741114_100009817552 [0,1,0,0,0,1|1,0,1]=4 4391 B12R1.3110 C[C@@H](O)CNC1(CCCCC1)C 34a_100000741114_100009817552 [0,1,0,0,0,1|1,0,1]=4 4392 B12R1.3110 C[C@@H](O)COC1(CCCCC1)C 34a_100011215885_100009817552 [0,1,0,0,0,1|1,0,1]=4 4393 B12R1.3110 C[C@@H](O)COC1(CCCCC1)C 7a_100011215885_100009817552 [0,1,0,0,0,1|1,0,1]=4 4394 B12R1.210 CC(=O)CN1CCCCCC1=O 1458a_100000181294_200000210301 [0,1,0,0,0,1|2,0,0]=4 4395 B12R1.210 [13CH3]C(=O)CN1CCCCCC1=O 1458a_100000181294_200025704644 [0,1,0,0,0,1|2,0,0]=4 4396 B12R1.874 NC(=O)CN1CCCCC(C1)O 2230a_100025706797_100000747473 [0,1,0,0,0,1|2,0,0]=4 4397 B12R1.874 NC(=O)CN1CCCCC(C1)O 269982a_100025706797_100000187820 [0,1,0,0,0,1|2,0,0]=4 4398 B12R1.874 NC(=O)CN1CCOC[C@@H](C1)O 2230a_100016073750_100000747473 [0,1,0,0,0,1|2,0,0]=4 4399 B12R1.874 NC(=O)CN1CCOC[C@@H](C1)O 269982a_100016073750_100000187820 [0,1,0,0,0,1|2,0,0]=4 4400 B12R1.874 O=C([O-])CN1CCCCC(C1)O 269982a_100025706797_100020667443 [0,1,0,0,0,1|1,0,1]=4 4401 B12R1.874 O=C([O-])CN1CCOC[C@@H](C1)O 269982a_100016073750_100020667443 [0,1,0,0,0,1|1,0,1]=4 4402 B12R1.1020 CC1CCCN(CC1)CC(=O)N 2230a_100025706717_100000747473 [0,1,0,0,0,1|2,0,0]=4 4403 B12R1.1020 CC1CCCN(CC1)CC(=O)N 269982a_100025706717_100000187820 [0,1,0,0,0,1|2,0,0]=4 4404 B12R1.1020 CC1CCCN(CC1)CC(=O)N 34a_100025706717_100000187820 [0,1,0,0,0,1|2,0,0]=4 4405 B12R1.1020 CC1CCCN(CC1)CC(=O)[O-] 269982a_100025706717_100020667443 [0,1,0,0,0,1|1,0,1]=4 4406 B12R1.1020 CC1CCCN(CC1)CC(=O)[O-] 34a_100025706717_100020667443 [0,1,0,0,0,1|1,0,1]=4 4407 B12R1.1020 CN1CCCN(CC1)CC(=O)N 2230a_100000211313_100000747473 [0,1,0,0,0,1|2,0,0]=4 4408 B12R1.1020 CN1CCCN(CC1)CC(=O)N 269982a_100000211313_100000187820 [0,1,0,0,0,1|2,0,0]=4 4409 B12R1.1020 CN1CCCN(CC1)CC(=O)[O-] 269982a_100000211313_100020667443 [0,1,0,0,0,1|1,0,1]=4 4410 B12R1.1020 NC(=O)CN1CCCC(CC1)O 2230a_100015186869_100000747473 [0,1,0,0,0,1|2,0,0]=4 4411 B12R1.1020 NC(=O)CN1CCCC(CC1)O 269982a_100015186869_100000187820 [0,1,0,0,0,1|2,0,0]=4 4412 B12R1.1020 O=C([O-])CN1CCCC(CC1)O 269982a_100015186869_100020667443 [0,1,0,0,0,1|1,0,1]=4 4413 B12R1.1748 C#CC(=O)CC1CCCCCC1 1458a_100000211873_200000696569 [0,1,0,0,0,1|1,0,0]=3 4414 B12R1.1748 C=CC(=O)CC1CCCCCC1 1458a_100000185746_200000696569 [0,1,0,0,0,1|1,0,0]=3 4415 B12R1.1748 C=CC(=O)NC1CCCCCC1 1626a_100000210984_100000185746 [0,1,0,0,0,1|2,0,0]=4 4416 B12R1.1748 C=CC(=O)NC1CCCCCC1 240690a_100000210984_200121576911 [0,1,0,0,0,1|2,0,0]=4 4417 B12R1.1748 CCC(=O)CC1CCCCCC1 1458a_100000210414_200000696569 [0,1,0,0,0,1|1,0,0]=3 4418 B12R1.1748 CCC(=O)CC1CCCCCC1 1458a_100000685095_100000210202 [0,1,0,0,0,1|1,0,0]=3 4419 B12R1.1748 CCC(=O)CN1CCCCCC1 1458a_100000740298_100000210202 [0,1,0,0,0,1|2,0,0]=4 4420 B12R1.1748 CCC(=O)CN1CCCCCC1 269982a_100000185865_100000747405 [0,1,0,0,0,1|2,0,0]=4 4421 B12R1.1748 CCC(=O)CN1CCCOCC1 269982a_100000685342_100000747405 [0,1,0,0,0,1|2,0,0]=4 4422 B12R1.1748 CCC(=O)NC1CCCCCC1 11a_100000210984_100000210414 [0,1,0,0,0,1|2,0,0]=4 4423 B12R1.1748 CCC(=O)NC1CCCCCC1 1626a_100000210984_100000210414 [0,1,0,0,0,1|2,0,0]=4 4424 B12R1.1748 CCC(=O)NC1CCCCCC1 240690a_100000210984_100000210414 [0,1,0,0,0,1|2,0,0]=4 4425 B12R1.1748 CCC(=O)NC1CCCCCC1 527a_100000210984_100000210414 [0,1,0,0,0,1|2,0,0]=4 4426 B12R1.1748 CNC(=O)CC1CCCCCC1 11a_106832991635_100000685095 [0,1,0,0,0,1|1,0,0]=3 4427 B12R1.1748 CNC(=O)CC1CCCCCC1 1626a_100102657272_100000685095 [0,1,0,0,0,1|1,0,0]=3 4428 B12R1.1748 CNC(=O)CC1CCCCCC1 240690a_100102657272_100000685095 [0,1,0,0,0,1|1,0,0]=3 4429 B12R1.1748 CNC(=O)CC1CCCCCC1 527a_100102657272_100000685095 [0,1,0,0,0,1|1,0,0]=3 4430 B12R1.1748 CNC(=O)CN1CCCCCC1 11a_106832991635_100000740298 [0,1,0,0,0,1|2,0,0]=4 4431 B12R1.1748 CNC(=O)CN1CCCCCC1 2230a_100000185865_100000183359 [0,1,0,0,0,1|2,0,0]=4 4432 B12R1.1748 CNC(=O)CN1CCCCCC1 240690a_100102657272_100000740298 [0,1,0,0,0,1|2,0,0]=4 4433 B12R1.1748 CNC(=O)CN1CCCCCC1 269982a_100000185865_100000183359 [0,1,0,0,0,1|2,0,0]=4 4434 B12R1.1748 CNC(=O)CN1CCCCCC1 34a_100000185865_100000183359 [0,1,0,0,0,1|2,0,0]=4 4435 B12R1.1748 CNC(=O)CN1CCCCCC1 527a_100102657272_100000740298 [0,1,0,0,0,1|2,0,0]=4 4436 B12R1.1748 CNC(=O)CN1CCCOCC1 2230a_100000685342_100000183359 [0,1,0,0,0,1|2,0,0]=4 4437 B12R1.1748 CNC(=O)CN1CCCOCC1 269982a_100000685342_100000183359 [0,1,0,0,0,1|2,0,0]=4 4438 B12R1.1748 CNC(=O)CN1CCCOCC1 34a_100000685342_100000183359 [0,1,0,0,0,1|2,0,0]=4 4439 B12R1.1748 CNC(=O)NC1CCCCCC1 2708a_100000210984_106832991635 [0,1,0,0,0,1|2,0,0]=4 4440 B12R1.1748 CNC(=O)NC1CCCCCC1 2708a_100102657272_100000210984 [0,1,0,0,0,1|2,0,0]=4 4441 B12R1.1748 CNC(=O)NC1CCCCCC1 273464a_100000210984_100102657272 [0,1,0,0,0,1|2,0,0]=4 4442 B12R1.1748 CNC(=O)NC1CCCCCC1 273464a_100102657272_100000210984 [0,1,0,0,0,1|2,0,0]=4 4443 B12R1.1748 CNC(=O)NC1CCCCCC1 512a_106832991638_100000210984 [0,1,0,0,0,1|2,0,0]=4 4444 B12R1.1748 COC(=O)CN1CCCCCC1 2230a_100000185865_100000747449 [0,1,0,0,0,1|1,0,0]=3 4445 B12R1.1748 COC(=O)CN1CCCCCC1 269982a_100000185865_100000747449 [0,1,0,0,0,1|1,0,0]=3 4446 B12R1.1748 COC(=O)CN1CCCCCC1 34a_100000185865_100000747449 [0,1,0,0,0,1|1,0,0]=3 4447 B12R1.1748 COC(=O)CN1CCCOCC1 2230a_100000685342_100000747449 [0,1,0,0,0,1|1,0,0]=3 4448 B12R1.1748 COC(=O)CN1CCCOCC1 269982a_100000685342_100000747449 [0,1,0,0,0,1|1,0,0]=3 4449 B12R1.1748 COC(=O)CN1CCCOCC1 34a_100000685342_100000747449 [0,1,0,0,0,1|1,0,0]=3 4450 B12R1.1748 O=C(CF)CC1CCCCCC1 1458a_100000685095_100015361967 [0,1,0,0,0,1|1,0,0]=3 4451 B12R1.1748 O=C(CF)CN1CCCCCC1 1458a_100000740298_100015361967 [0,1,0,0,0,1|2,0,0]=4 4452 B12R1.1748 O=C(CO)CC1CCCCCC1 1458a_100000210174_200000696569 [0,1,0,0,0,1|0,0,0]=2 4453 B12R1.1748 O=C(CO)NC1CCCCCC1 240690a_100000210984_100000210174 [0,1,0,0,0,1|1,0,0]=3 4454 B12R1.1748 O=C(CO)NC1CCCCCC1 527a_100000210984_100000210174 [0,1,0,0,0,1|1,0,0]=3 4455 B12R1.1829 CC(=O)NC1(CCCCCC1)C 11a_100000704638_100015343762 [0,1,0,0,0,1|2,0,0]=4 4456 B12R1.1829 CC(=O)NC1(CCCCCC1)C 1626a_100000704638_100015343762 [0,1,0,0,0,1|2,0,0]=4 4457 B12R1.1829 CC(=O)NC1(CCCCCC1)C 240690a_100000704638_100015343762 [0,1,0,0,0,1|2,0,0]=4 4458 B12R1.1829 CC(=O)NC1(CCCCCC1)C 527a_100000704638_100103153847 [0,1,0,0,0,1|2,0,0]=4 4459 B12R1.2197 CC(=O)C(C)N1CCCCCC1 1458a_100000755792_200000210301 [0,1,0,0,0,1|2,0,0]=4 4460 B12R1.2197 CC(=O)C(C)N1CCCCCC1 2230a_100000185865_100009814033 [0,1,0,0,0,1|2,0,0]=4 4461 B12R1.2197 CC(=O)C(C)N1CCCCCC1 269982a_100000185865_100009814033 [0,1,0,0,0,1|2,0,0]=4 4462 B12R1.2197 CC(=O)C(C)N1CCCOCC1 2230a_100000685342_100009814033 [0,1,0,0,0,1|2,0,0]=4 4463 B12R1.2197 CC(=O)C(C)N1CCCOCC1 269982a_100000685342_100009814033 [0,1,0,0,0,1|2,0,0]=4 4464 B12R1.2197 CC(=O)N(C)C1CCCCCC1 11a_100015185097_100015343762 [0,1,0,0,0,1|2,0,0]=4 4465 B12R1.2197 CC(=O)N(C)C1CCCCCC1 1626a_100015185097_100015343762 [0,1,0,0,0,1|2,0,0]=4 4466 B12R1.2197 CC(=O)N(C)C1CCCCCC1 240690a_100015185097_100015343762 [0,1,0,0,0,1|2,0,0]=4 4467 B12R1.2197 CC(=O)N(C)C1CCCCCC1 527a_100015185097_100103153847 [0,1,0,0,0,1|2,0,0]=4 4468 B12R1.2197 CC(C(=O)N)N1CCCCCC1 2230a_100000185865_100000702099 [0,1,0,0,0,1|2,0,0]=4 4469 B12R1.2197 CC(C(=O)N)N1CCCCCC1 269982a_100000185865_100000184083 [0,1,0,0,0,1|2,0,0]=4 4470 B12R1.2197 CC(C(=O)N)N1CCCCCC1 34a_100000185865_100000702099 [0,1,0,0,0,1|2,0,0]=4 4471 B12R1.2197 CC(C(=O)N)N1CCCOCC1 2230a_100000685342_100000702099 [0,1,0,0,0,1|2,0,0]=4 4472 B12R1.2197 CC(C(=O)N)N1CCCOCC1 269982a_100000685342_100000184083 [0,1,0,0,0,1|2,0,0]=4 4473 B12R1.2197 CC(C(=O)N)N1CCCOCC1 34a_100000685342_100000702099 [0,1,0,0,0,1|2,0,0]=4 4474 B12R1.2197 CC(C(=O)[13CH3])N1CCCCCC1 1458a_100000755792_200025704644 [0,1,0,0,0,1|2,0,0]=4 4475 B12R1.2197 NC(=O)C(F)N1CCCCCC1 2230a_100000185865_100009813875 [0,1,0,0,0,1|2,0,0]=4 4476 B12R1.2197 NC(=O)C(F)N1CCCCCC1 269982a_100000185865_100009813875 [0,1,0,0,0,1|2,0,0]=4 4477 B12R1.2197 NC(=O)C(F)N1CCCCCC1 34a_100000185865_100009813875 [0,1,0,0,0,1|2,0,0]=4 4478 B12R1.2197 NC(=O)C(F)N1CCCOCC1 2230a_100000685342_100009813875 [0,1,0,0,0,1|2,0,0]=4 4479 B12R1.2197 NC(=O)C(F)N1CCCOCC1 269982a_100000685342_100009813875 [0,1,0,0,0,1|2,0,0]=4 4480 B12R1.2197 NC(=O)C(F)N1CCCOCC1 34a_100000685342_100009813875 [0,1,0,0,0,1|2,0,0]=4 4481 B12R1.2197 O=C([O-])C(F)N1CCCCCC1 34a_100000185865_100020610796 [0,1,0,0,0,1|1,0,1]=4 4482 B12R1.2197 O=C([O-])C(F)N1CCCOCC1 34a_100000685342_100020610796 [0,1,0,0,0,1|1,0,1]=4 4483 B12R1.4 C#CC1CCN(CC1)CC(=O)N 2230a_100016991398_100000747473 [0,2,0,0,0,0|2,0,0]=4 4484 B12R1.4 C#CC1CCN(CC1)CC(=O)N 269982a_100016991398_100000187820 [0,2,0,0,0,0|2,0,0]=4 4485 B12R1.4 C#CC1CCN(CC1)CC(=O)N 34a_100016991398_100000187820 [0,2,0,0,0,0|2,0,0]=4 4486 B12R1.4 C#CC1CCN(CC1)CC(=O)[O-] 269982a_100016991398_100020667443 [0,2,0,0,0,0|1,0,1]=4 4487 B12R1.4 C#CC1CCN(CC1)CC(=O)[O-] 34a_100016991398_100020667443 [0,2,0,0,0,0|1,0,1]=4 4488 B12R1.4 CC(=O)NC1CCC(CC1)C#N 11a_100102422146_100015343762 [0,2,0,0,0,0|2,0,0]=4 4489 B12R1.4 CC(=O)NC1CCC(CC1)C#N 1626a_100102422146_100015343762 [0,2,0,0,0,0|2,0,0]=4 4490 B12R1.4 CC(=O)NC1CCC(CC1)C#N 240690a_100102422146_100015343762 [0,2,0,0,0,0|2,0,0]=4 4491 B12R1.4 CC(=O)NC1CCC(CC1)C#N 527a_100102422146_100103153847 [0,2,0,0,0,0|2,0,0]=4 4492 B12R1.4 CC(=O)NC1CCC(CC1)O[13CH3] 34a_100000161027_200025704644 [0,2,0,0,0,0|2,0,0]=4 4493 B12R1.4 CC(=O)NC1CCC(CC1)O[13CH3] 7a_100000161027_200025704644 [0,2,0,0,0,0|2,0,0]=4 4494 B12R1.4 CC(=O)N[C@H]1CC[C@@H](CC1)CO 240690a_100009821084_100015343762 [0,2,0,0,0,0|2,0,0]=4 4495 B12R1.4 CC(=O)N[C@H]1CC[C@@H](CC1)CO 527a_100009821084_100103153847 [0,2,0,0,0,0|2,0,0]=4 4496 B12R1.4 CCC1CCC(CC1)NC(=O)C 11a_100011194317_100015343762 [0,2,0,0,0,0|2,0,0]=4 4497 B12R1.4 CCC1CCC(CC1)NC(=O)C 1626a_100011194317_100015343762 [0,2,0,0,0,0|2,0,0]=4 4498 B12R1.4 CCC1CCC(CC1)NC(=O)C 240690a_100011194317_100015343762 [0,2,0,0,0,0|2,0,0]=4 4499 B12R1.4 CCC1CCC(CC1)NC(=O)C 527a_100011194317_100103153847 [0,2,0,0,0,0|2,0,0]=4 4500 B12R1.4 CCC1CCN(CC1)CC(=O)N 2230a_100000754474_100000747473 [0,2,0,0,0,0|2,0,0]=4 4501 B12R1.4 CCC1CCN(CC1)CC(=O)N 269982a_100000754474_100000187820 [0,2,0,0,0,0|2,0,0]=4 4502 B12R1.4 CCC1CCN(CC1)CC(=O)N 34a_100000754474_100000187820 [0,2,0,0,0,0|2,0,0]=4 4503 B12R1.4 CCC1CCN(CC1)CC(=O)[O-] 269982a_100000754474_100020667443 [0,2,0,0,0,0|1,0,1]=4 4504 B12R1.4 CCC1CCN(CC1)CC(=O)[O-] 34a_100000754474_100020667443 [0,2,0,0,0,0|1,0,1]=4 4505 B12R1.4 CCN1CCC(CC1)CC(=O)C 1458a_200015183082_200000210301 [0,2,0,0,0,0|2,0,0]=4 4506 B12R1.4 CCN1CCC(CC1)CC(=O)N 2230a_100011221598_100000210202 [0,2,0,0,0,0|2,0,0]=4 4507 B12R1.4 CCN1CCC(CC1)CC(=O)N 34a_100011221598_100000210202 [0,2,0,0,0,0|2,0,0]=4 4508 B12R1.4 CCN1CCC(CC1)CC(=O)[13CH3] 1458a_200015183082_200025704644 [0,2,0,0,0,0|2,0,0]=4 4509 B12R1.4 CNC1CCC(CC1)NC(=O)C 270004a_106832991635_100000735651 [0,2,0,0,0,0|2,0,0]=4 4510 B12R1.4 CNC1CCC(CC1)OC(=O)C 270004a_106832991635_200000086378 [0,2,0,0,0,0|2,0,0]=4 4511 B12R1.4 CNC1CCN(CC1)CC(=O)O 269956a_100160573092_200000210301 [0,2,0,0,0,0|1,0,0]=3 4512 B12R1.4 COC1CCC(CC1)CC(=O)C 1458a_100000070787_100013032858 [0,2,0,0,0,0|1,0,0]=3 4513 B12R1.4 COC1CCC(CC1)NC(=O)C 11a_100015205214_100015343762 [0,2,0,0,0,0|2,0,0]=4 4514 B12R1.4 COC1CCC(CC1)NC(=O)C 1626a_100015205214_100015343762 [0,2,0,0,0,0|2,0,0]=4 4515 B12R1.4 COC1CCC(CC1)NC(=O)C 240690a_100015205214_100015343762 [0,2,0,0,0,0|2,0,0]=4 4516 B12R1.4 COC1CCC(CC1)NC(=O)C 34a_100000161027_200000210301 [0,2,0,0,0,0|2,0,0]=4 4517 B12R1.4 COC1CCC(CC1)NC(=O)C 527a_100015205214_100103153847 [0,2,0,0,0,0|2,0,0]=4 4518 B12R1.4 COC1CCC(CC1)NC(=O)C 7a_100000161027_200000210301 [0,2,0,0,0,0|2,0,0]=4 4519 B12R1.4 COC1CCN(CC1)CC(=O)N 2230a_100000234800_100000747473 [0,2,0,0,0,0|2,0,0]=4 4520 B12R1.4 COC1CCN(CC1)CC(=O)N 269982a_100000234800_100000187820 [0,2,0,0,0,0|2,0,0]=4 4521 B12R1.4 COC1CCN(CC1)CC(=O)N 34a_100000234800_100000187820 [0,2,0,0,0,0|2,0,0]=4 4522 B12R1.4 COC1CCN(CC1)CC(=O)[O-] 269982a_100000234800_100020667443 [0,2,0,0,0,0|1,0,1]=4 4523 B12R1.4 COC1CCN(CC1)CC(=O)[O-] 34a_100000234800_100020667443 [0,2,0,0,0,0|1,0,1]=4 4524 B12R1.4 CSC1CCN(CC1)CC(=O)N 2230a_100015202541_100000747473 [0,2,0,0,0,0|2,0,0]=4 4525 B12R1.4 CSC1CCN(CC1)CC(=O)N 269982a_100015202541_100000187820 [0,2,0,0,0,0|2,0,0]=4 4526 B12R1.4 CSC1CCN(CC1)CC(=O)N 34a_100015202541_100000187820 [0,2,0,0,0,0|2,0,0]=4 4527 B12R1.4 CSC1CCN(CC1)CC(=O)[O-] 269982a_100015202541_100020667443 [0,2,0,0,0,0|1,0,1]=4 4528 B12R1.4 CSC1CCN(CC1)CC(=O)[O-] 34a_100015202541_100020667443 [0,2,0,0,0,0|1,0,1]=4 4529 B12R1.4 N#CC1CCN(CC1)CC(=O)N 2230a_100000747632_100000747473 [0,2,0,0,0,0|2,0,0]=4 4530 B12R1.4 NC(=O)CC1CCN(CC1)CF 34a_100011221598_100015361967 [0,2,0,0,0,0|2,0,0]=4 4531 B12R1.4 NC(=O)CN1CCC(CC1)CF 2230a_100015203933_100000747473 [0,2,0,0,0,0|2,0,0]=4 4532 B12R1.4 NC(=O)CN1CCC(CC1)CF 269982a_100015203933_100000187820 [0,2,0,0,0,0|2,0,0]=4 4533 B12R1.4 NC(=O)CN1CCC(CC1)CF 34a_100015203933_100000187820 [0,2,0,0,0,0|2,0,0]=4 4534 B12R1.4 NC(=O)CN1CCC(CC1)CO 2230a_100000738675_100000747473 [0,2,0,0,0,0|2,0,0]=4 4535 B12R1.4 NC(=O)CN1CCC(CC1)CO 269982a_100000738675_100000187820 [0,2,0,0,0,0|2,0,0]=4 4536 B12R1.4 NC(=O)CN1CCC(CC1)CO 34a_100000738675_100000187820 [0,2,0,0,0,0|2,0,0]=4 4537 B12R1.4 O=C([O-])CN1CCC(CC1)CF 269982a_100015203933_100020667443 [0,2,0,0,0,0|1,0,1]=4 4538 B12R1.4 O=C([O-])CN1CCC(CC1)CF 34a_100015203933_100020667443 [0,2,0,0,0,0|1,0,1]=4 4539 B12R1.4 O=C([O-])CN1CCC(CC1)CO 269982a_100000738675_100020667443 [0,2,0,0,0,0|1,0,1]=4 4540 B12R1.4 O=C([O-])CN1CCC(CC1)CO 34a_100000738675_100020667443 [0,2,0,0,0,0|1,0,1]=4 4541 B12R1.4 [13CH3]NC1CCN(CC1)CC(=O)O 269956a_100160573092_200025704644 [0,2,0,0,0,0|1,0,0]=3 4542 B12R1.19 CC1CCN(CC1O)CC(=O)N 2230a_100000696640_100000747473 [0,2,0,0,0,0|2,0,0]=4 4543 B12R1.19 CC1CCN(CC1O)CC(=O)N 269982a_100000696640_100000187820 [0,2,0,0,0,0|2,0,0]=4 4544 B12R1.19 CC1CCN(CC1O)CC(=O)[O-] 269982a_100000696640_100020667443 [0,2,0,0,0,0|1,0,1]=4 4545 B12R1.19 CC1CN(CCC1O)CC(=O)N 2230a_100011998114_100000747473 [0,2,0,0,0,0|2,0,0]=4 4546 B12R1.19 CC1CN(CCC1O)CC(=O)N 269982a_100011998114_100000187820 [0,2,0,0,0,0|2,0,0]=4 4547 B12R1.19 CC1CN(CCC1O)CC(=O)[O-] 269982a_100011998114_100020667443 [0,2,0,0,0,0|1,0,1]=4 4548 B12R1.19 NC(=O)CN1CC[C@H]([C@H](C1)F)O 2230a_200016994291_100000747473 [0,2,0,0,0,0|2,0,0]=4 4549 B12R1.19 NC(=O)CN1CC[C@H]([C@H](C1)F)O 269982a_200016994291_100000187820 [0,2,0,0,0,0|2,0,0]=4 4550 B12R1.19 NC(=O)CN1CC[C@H]([C@H](C1)O)O 2230a_100000690696_100000747473 [0,2,0,0,0,0|2,0,0]=4 4551 B12R1.19 NC(=O)CN1CC[C@H]([C@H](C1)O)O 269982a_100000690696_100000187820 [0,2,0,0,0,0|2,0,0]=4 4552 B12R1.19 O=C([O-])CN1CC[C@H]([C@H](C1)F)O 269982a_200016994291_100020667443 [0,2,0,0,0,0|1,0,1]=4 4553 B12R1.19 O=C([O-])CN1CC[C@H]([C@H](C1)O)O 269982a_100000690696_100020667443 [0,2,0,0,0,0|1,0,1]=4 4554 B12R1.20 CC(=O)C(C)N1CCC(CC1)C 1458a_100073797049_200000210301 [0,2,0,0,0,0|2,0,0]=4 4555 B12R1.20 CC(=O)C(C)N1CCC(CC1)C 2230a_100000188429_100009814033 [0,2,0,0,0,0|2,0,0]=4 4556 B12R1.20 CC(=O)C(C)N1CCC(CC1)C 269982a_100000188429_100009814033 [0,2,0,0,0,0|2,0,0]=4 4557 B12R1.20 CC(=O)C(C)N1CCC(CC1)F 2230a_100015193889_100009814033 [0,2,0,0,0,0|2,0,0]=4 4558 B12R1.20 CC(=O)C(C)N1CCC(CC1)F 269982a_100015193889_100009814033 [0,2,0,0,0,0|2,0,0]=4 4559 B12R1.20 CC(=O)C(C)N1CCC(CC1)O 2230a_100025773856_100009814033 [0,2,0,0,0,0|2,0,0]=4 4560 B12R1.20 CC(=O)C(C)N1CCC(CC1)O 269982a_100025773856_100009814033 [0,2,0,0,0,0|2,0,0]=4 4561 B12R1.20 CC(=O)N(C)[C@H]1CC[C@H](CC1)O 11a_100020636401_100015343762 [0,2,0,0,0,0|2,0,0]=4 4562 B12R1.20 CC(=O)N(C)[C@H]1CC[C@H](CC1)O 1626a_100020636401_100015343762 [0,2,0,0,0,0|2,0,0]=4 4563 B12R1.20 CC(=O)N(C)[C@H]1CC[C@H](CC1)O 240690a_100020636401_100015343762 [0,2,0,0,0,0|2,0,0]=4 4564 B12R1.20 CC(=O)N(C)[C@H]1CC[C@H](CC1)O 527a_100020636401_100103153847 [0,2,0,0,0,0|2,0,0]=4 4565 B12R1.20 CC(C(=O)N)N1CCC(CC1)F 2230a_100015193889_100000702099 [0,2,0,0,0,0|2,0,0]=4 4566 B12R1.20 CC(C(=O)N)N1CCC(CC1)F 269982a_100015193889_100000184083 [0,2,0,0,0,0|2,0,0]=4 4567 B12R1.20 CC(C(=O)N)N1CCC(CC1)F 34a_100015193889_100000702099 [0,2,0,0,0,0|2,0,0]=4 4568 B12R1.20 CC(C(=O)N)N1CCC(CC1)O 2230a_100025773856_100000702099 [0,2,0,0,0,0|2,0,0]=4 4569 B12R1.20 CC(C(=O)N)N1CCC(CC1)O 269982a_100025773856_100000184083 [0,2,0,0,0,0|2,0,0]=4 4570 B12R1.20 CC1CCN(CC1)C(C)C(=O)N 2230a_100000188429_100000702099 [0,2,0,0,0,0|2,0,0]=4 4571 B12R1.20 CC1CCN(CC1)C(C)C(=O)N 269982a_100000188429_100000184083 [0,2,0,0,0,0|2,0,0]=4 4572 B12R1.20 CC1CCN(CC1)C(C)C(=O)N 34a_100000188429_100000702099 [0,2,0,0,0,0|2,0,0]=4 4573 B12R1.20 CC1CCN(CC1)C(C)C(=O)[13CH3] 1458a_100073797049_200025704644 [0,2,0,0,0,0|2,0,0]=4 4574 B12R1.20 CC1CCN(CC1)C(F)C(=O)N 2230a_100000188429_100009813875 [0,2,0,0,0,0|2,0,0]=4 4575 B12R1.20 CC1CCN(CC1)C(F)C(=O)N 269982a_100000188429_100009813875 [0,2,0,0,0,0|2,0,0]=4 4576 B12R1.20 CC1CCN(CC1)C(F)C(=O)N 34a_100000188429_100009813875 [0,2,0,0,0,0|2,0,0]=4 4577 B12R1.20 CC1CCN(CC1)C(F)C(=O)[O-] 34a_100000188429_100020610796 [0,2,0,0,0,0|1,0,1]=4 4578 B12R1.20 NC(=O)C(F)N1CCC(CC1)F 2230a_100015193889_100009813875 [0,2,0,0,0,0|2,0,0]=4 4579 B12R1.20 NC(=O)C(F)N1CCC(CC1)F 269982a_100015193889_100009813875 [0,2,0,0,0,0|2,0,0]=4 4580 B12R1.20 NC(=O)C(F)N1CCC(CC1)F 34a_100015193889_100009813875 [0,2,0,0,0,0|2,0,0]=4 4581 B12R1.20 NC(=O)C(F)N1CCC(CC1)O 2230a_100025773856_100009813875 [0,2,0,0,0,0|2,0,0]=4 4582 B12R1.20 NC(=O)C(F)N1CCC(CC1)O 269982a_100025773856_100009813875 [0,2,0,0,0,0|2,0,0]=4 4583 B12R1.20 O=C([O-])C(F)N1CCC(CC1)F 34a_100015193889_100020610796 [0,2,0,0,0,0|1,0,1]=4 4584 B12R1.49 C=C1CCN(CC1)CC(=O)OC 2230a_100000752442_100000747449 [0,2,0,0,0,0|1,0,1]=4 4585 B12R1.49 C=C1CCN(CC1)CC(=O)OC 269982a_100000752442_100000747449 [0,2,0,0,0,0|1,0,1]=4 4586 B12R1.49 C=C1CCN(CC1)CC(=O)OC 34a_100000752442_100000747449 [0,2,0,0,0,0|1,0,1]=4 4587 B12R1.49 C=CC(=O)N[C@H]1CC[C@@H](CC1)C 1626a_100020625639_100000185746 [0,2,0,0,0,0|2,0,0]=4 4588 B12R1.49 C=CC(=O)N[C@H]1CC[C@@H](CC1)C 240690a_100020625639_200121576911 [0,2,0,0,0,0|2,0,0]=4 4589 B12R1.49 C=CC(=O)N[C@H]1CC[C@H](CC1)O 1626a_100020628982_100000185746 [0,2,0,0,0,0|2,0,0]=4 4590 B12R1.49 C=CC(=O)N[C@H]1CC[C@H](CC1)O 240690a_100020628982_200121576911 [0,2,0,0,0,0|2,0,0]=4 4591 B12R1.49 CC1CCC(CC1)CC(=O)CF 1458a_100011215564_100015361967 [0,2,0,0,0,0|1,0,0]=3 4592 B12R1.49 CC1CCN(CC1)CC(=O)CF 1458a_100000238061_100015361967 [0,2,0,0,0,0|2,0,0]=4 4593 B12R1.49 CCC(=O)CC1CCC(CC1)C 1458a_100011215564_100000210202 [0,2,0,0,0,0|1,0,0]=3 4594 B12R1.49 CCC(=O)CC1CCC(CC1)O 1458a_100012184027_100000210202 [0,2,0,0,0,0|1,0,0]=3 4595 B12R1.49 CCC(=O)CC1CCN(CC1)C 1458a_100000700355_100000210202 [0,2,0,0,0,0|2,0,0]=4 4596 B12R1.49 CCC(=O)CN1CCC(CC1)C 1458a_100000238061_100000210202 [0,2,0,0,0,0|2,0,0]=4 4597 B12R1.49 CCC(=O)CN1CCC(CC1)C 269982a_100000188429_100000747405 [0,2,0,0,0,0|2,0,0]=4 4598 B12R1.49 CCC(=O)CN1CCC(CC1)F 269982a_100015193889_100000747405 [0,2,0,0,0,0|2,0,0]=4 4599 B12R1.49 CCC(=O)CN1CCC(CC1)O 269982a_100025773856_100000747405 [0,2,0,0,0,0|2,0,0]=4 4600 B12R1.49 CCC(=O)N[C@H]1CC[C@@H](CC1)C 1626a_100020625639_100000210414 [0,2,0,0,0,0|2,0,0]=4 4601 B12R1.49 CCC(=O)N[C@H]1CC[C@@H](CC1)C 240690a_100020625639_100000210414 [0,2,0,0,0,0|2,0,0]=4 4602 B12R1.49 CCC(=O)N[C@H]1CC[C@@H](CC1)C 527a_100020625639_100000210414 [0,2,0,0,0,0|2,0,0]=4 4603 B12R1.49 CCC(=O)N[C@H]1CC[C@H](CC1)O 1626a_100020628982_100000210414 [0,2,0,0,0,0|2,0,0]=4 4604 B12R1.49 CCC(=O)N[C@H]1CC[C@H](CC1)O 240690a_100020628982_100000210414 [0,2,0,0,0,0|2,0,0]=4 4605 B12R1.49 CN1CCC(CC1)CC(=O)CF 1458a_100000700355_100015361967 [0,2,0,0,0,0|2,0,0]=4 4606 B12R1.49 CN1CCC(CC1)NC(=O)CO 240690a_100000198570_100000210174 [0,2,0,0,0,0|2,0,0]=4 4607 B12R1.49 CN1CCC(CC1)NC(=O)CO 527a_100000198570_100000210174 [0,2,0,0,0,0|2,0,0]=4 4608 B12R1.49 CNC(=O)CC1CCC(CC1)C 11a_106832991635_100011215564 [0,2,0,0,0,0|1,0,0]=3 4609 B12R1.49 CNC(=O)CC1CCC(CC1)C 1626a_100102657272_100011215564 [0,2,0,0,0,0|1,0,0]=3 4610 B12R1.49 CNC(=O)CC1CCC(CC1)C 240690a_100102657272_100011215564 [0,2,0,0,0,0|1,0,0]=3 4611 B12R1.49 CNC(=O)CC1CCC(CC1)C 527a_100102657272_100011215564 [0,2,0,0,0,0|1,0,0]=3 4612 B12R1.49 CNC(=O)CC1CCC(CC1)O 1626a_100102657272_100012184027 [0,2,0,0,0,0|1,0,0]=3 4613 B12R1.49 CNC(=O)CC1CCC(CC1)O 240690a_100102657272_100012184027 [0,2,0,0,0,0|1,0,0]=3 4614 B12R1.49 CNC(=O)CC1CCC(CC1)O 527a_100102657272_100012184027 [0,2,0,0,0,0|1,0,0]=3 4615 B12R1.49 CNC(=O)CC1CCN(CC1)C 11a_106832991635_100000700355 [0,2,0,0,0,0|2,0,0]=4 4616 B12R1.49 CNC(=O)CC1CCN(CC1)C 1626a_100102657272_100000700355 [0,2,0,0,0,0|2,0,0]=4 4617 B12R1.49 CNC(=O)CC1CCN(CC1)C 2230a_100000765844_200000210301 [0,2,0,0,0,0|2,0,0]=4 4618 B12R1.49 CNC(=O)CC1CCN(CC1)C 240690a_100102657272_100000700355 [0,2,0,0,0,0|2,0,0]=4 4619 B12R1.49 CNC(=O)CC1CCN(CC1)C 269982a_100000765844_200000210301 [0,2,0,0,0,0|2,0,0]=4 4620 B12R1.49 CNC(=O)CC1CCN(CC1)C 34a_100000765844_200000210301 [0,2,0,0,0,0|2,0,0]=4 4621 B12R1.49 CNC(=O)CC1CCN(CC1)[13CH3] 2230a_100000765844_200025704644 [0,2,0,0,0,0|2,0,0]=4 4622 B12R1.49 CNC(=O)CC1CCN(CC1)[13CH3] 269982a_100000765844_200025704644 [0,2,0,0,0,0|2,0,0]=4 4623 B12R1.49 CNC(=O)CC1CCN(CC1)[13CH3] 34a_100000765844_200025704644 [0,2,0,0,0,0|2,0,0]=4 4624 B12R1.49 CNC(=O)CN1CCC(CC1)C 11a_106832991635_100000238061 [0,2,0,0,0,0|2,0,0]=4 4625 B12R1.49 CNC(=O)CN1CCC(CC1)C 1626a_100102657272_100000238061 [0,2,0,0,0,0|2,0,0]=4 4626 B12R1.49 CNC(=O)CN1CCC(CC1)C 2230a_100000188429_100000183359 [0,2,0,0,0,0|2,0,0]=4 4627 B12R1.49 CNC(=O)CN1CCC(CC1)C 240690a_100102657272_100000238061 [0,2,0,0,0,0|2,0,0]=4 4628 B12R1.49 CNC(=O)CN1CCC(CC1)C 269982a_100000188429_100000183359 [0,2,0,0,0,0|2,0,0]=4 4629 B12R1.49 CNC(=O)CN1CCC(CC1)C 34a_100000188429_100000183359 [0,2,0,0,0,0|2,0,0]=4 4630 B12R1.49 CNC(=O)CN1CCC(CC1)C 527a_100102657272_100000238061 [0,2,0,0,0,0|2,0,0]=4 4631 B12R1.49 CNC(=O)CN1CCC(CC1)F 2230a_100015193889_100000183359 [0,2,0,0,0,0|2,0,0]=4 4632 B12R1.49 CNC(=O)CN1CCC(CC1)F 269982a_100015193889_100000183359 [0,2,0,0,0,0|2,0,0]=4 4633 B12R1.49 CNC(=O)CN1CCC(CC1)F 34a_100015193889_100000183359 [0,2,0,0,0,0|2,0,0]=4 4634 B12R1.49 CNC(=O)CN1CCC(CC1)O 2230a_100025773856_100000183359 [0,2,0,0,0,0|2,0,0]=4 4635 B12R1.49 CNC(=O)CN1CCC(CC1)O 269982a_100025773856_100000183359 [0,2,0,0,0,0|2,0,0]=4 4636 B12R1.49 CNC(=O)N[C@H]1CC[C@@H](CC1)C 2708a_100020625639_106832991635 [0,2,0,0,0,0|2,0,0]=4 4637 B12R1.49 CNC(=O)N[C@H]1CC[C@@H](CC1)C 2708a_100102657272_100020625639 [0,2,0,0,0,0|2,0,0]=4 4638 B12R1.49 CNC(=O)N[C@H]1CC[C@@H](CC1)C 273464a_100020625639_100102657272 [0,2,0,0,0,0|2,0,0]=4 4639 B12R1.49 CNC(=O)N[C@H]1CC[C@@H](CC1)C 273464a_100102657272_100020625639 [0,2,0,0,0,0|2,0,0]=4 4640 B12R1.49 CNC(=O)N[C@H]1CC[C@H](CC1)O 2708a_100020628982_106832991635 [0,2,0,0,0,0|2,0,0]=4 4641 B12R1.49 CNC(=O)N[C@H]1CC[C@H](CC1)O 2708a_100102657272_100020628982 [0,2,0,0,0,0|2,0,0]=4 4642 B12R1.49 CNC(=O)N[C@H]1CC[C@H](CC1)O 273464a_100020628982_100102657272 [0,2,0,0,0,0|2,0,0]=4 4643 B12R1.49 CNC(=O)N[C@H]1CC[C@H](CC1)O 273464a_100102657272_100020628982 [0,2,0,0,0,0|2,0,0]=4 4644 B12R1.49 CNC(=O)N[C@H]1CC[C@H](CC1)O 512a_106832991638_100020628982 [0,2,0,0,0,0|2,0,0]=4 4645 B12R1.49 COC(=O)CC1CCN(CC1)C 2230a_100015189564_200000210301 [0,2,0,0,0,0|1,0,0]=3 4646 B12R1.49 COC(=O)CC1CCN(CC1)C 269982a_100015189564_200000210301 [0,2,0,0,0,0|1,0,0]=3 4647 B12R1.49 COC(=O)CC1CCN(CC1)[13CH3] 2230a_100015189564_200025704644 [0,2,0,0,0,0|1,0,0]=3 4648 B12R1.49 COC(=O)CC1CCN(CC1)[13CH3] 269982a_100015189564_200025704644 [0,2,0,0,0,0|1,0,0]=3 4649 B12R1.49 COC(=O)CN1CCC(CC1)C 2230a_100000188429_100000747449 [0,2,0,0,0,0|1,0,0]=3 4650 B12R1.49 COC(=O)CN1CCC(CC1)C 269982a_100000188429_100000747449 [0,2,0,0,0,0|1,0,0]=3 4651 B12R1.49 COC(=O)CN1CCC(CC1)C 34a_100000188429_100000747449 [0,2,0,0,0,0|1,0,0]=3 4652 B12R1.49 COC(=O)CN1CCC(CC1)F 2230a_100015193889_100000747449 [0,2,0,0,0,0|1,0,0]=3 4653 B12R1.49 COC(=O)CN1CCC(CC1)F 269982a_100015193889_100000747449 [0,2,0,0,0,0|1,0,0]=3 4654 B12R1.49 COC(=O)CN1CCC(CC1)F 34a_100015193889_100000747449 [0,2,0,0,0,0|1,0,0]=3 4655 B12R1.49 COC(=O)CN1CCC(CC1)O 2230a_100025773856_100000747449 [0,2,0,0,0,0|1,0,0]=3 4656 B12R1.49 COC(=O)CN1CCC(CC1)O 269982a_100025773856_100000747449 [0,2,0,0,0,0|1,0,0]=3 4657 B12R1.49 COC(=O)CN1CCN(CC1)C 2230a_100000188432_100000747449 [0,2,0,0,0,0|2,0,0]=4 4658 B12R1.49 COC(=O)CN1CCN(CC1)C 2230a_100020603342_200000210301 [0,2,0,0,0,0|2,0,0]=4 4659 B12R1.49 COC(=O)CN1CCN(CC1)C 269982a_100000188432_100000747449 [0,2,0,0,0,0|2,0,0]=4 4660 B12R1.49 COC(=O)CN1CCN(CC1)C 269982a_100020603342_200000210301 [0,2,0,0,0,0|2,0,0]=4 4661 B12R1.49 COC(=O)CN1CCN(CC1)[13CH3] 2230a_100020603342_200025704644 [0,2,0,0,0,0|2,0,0]=4 4662 B12R1.49 COC(=O)CN1CCN(CC1)[13CH3] 269982a_100020603342_200025704644 [0,2,0,0,0,0|2,0,0]=4 4663 B12R1.49 COC(=O)CN1CCS(=O)CC1 2230a_100000752083_100000747449 [0,2,0,0,0,0|2,0,0]=4 4664 B12R1.49 COC(=O)CN1CCS(=O)CC1 269982a_100000752083_100000747449 [0,2,0,0,0,0|2,0,0]=4 4665 B12R1.49 COC(=O)NC1CCN(CC1)C 2230a_100025775168_200000210301 [0,2,0,0,0,0|2,0,0]=4 4666 B12R1.49 COC(=O)NC1CCN(CC1)C 269982a_100025775168_200000210301 [0,2,0,0,0,0|2,0,0]=4 4667 B12R1.49 COC(=O)NC1CCN(CC1)C 34a_100025775168_200000210301 [0,2,0,0,0,0|2,0,0]=4 4668 B12R1.49 COC(=O)NC1CCN(CC1)[13CH3] 2230a_100025775168_200025704644 [0,2,0,0,0,0|2,0,0]=4 4669 B12R1.49 COC(=O)NC1CCN(CC1)[13CH3] 269982a_100025775168_200025704644 [0,2,0,0,0,0|2,0,0]=4 4670 B12R1.49 COC(=O)NC1CCN(CC1)[13CH3] 34a_100025775168_200025704644 [0,2,0,0,0,0|2,0,0]=4 4671 B12R1.49 C[C@H]1CC[C@@H](CC1)NC(=O)CO 240690a_100020625639_100000210174 [0,2,0,0,0,0|1,0,0]=3 4672 B12R1.49 C[C@H]1CC[C@@H](CC1)NC(=O)CO 527a_100020625639_100000210174 [0,2,0,0,0,0|1,0,0]=3 4673 B12R1.49 O=C(CF)CC1CCC(CC1)O 1458a_100012184027_100015361967 [0,2,0,0,0,0|1,0,0]=3 4674 B12R1.49 O=C(CO)N[C@H]1CC[C@H](CC1)O 240690a_100020628982_100000210174 [0,2,0,0,0,0|1,0,0]=3 4675 B12R1.1819 CC(=O)CC1CCC(CC1)(F)F 1458a_100000070787_100012361406 [0,2,0,0,0,0|1,0,0]=3 4676 B12R1.1819 CC(=O)CC1CCC(CC1)(F)F 1458a_100000101020_200000210301 [0,2,0,0,0,0|1,0,0]=3 4677 B12R1.1819 CC(=O)NC1CCC(CC1)(C)C 11a_100000757809_100015343762 [0,2,0,0,0,0|2,0,0]=4 4678 B12R1.1819 CC(=O)NC1CCC(CC1)(C)C 1626a_100000757809_100015343762 [0,2,0,0,0,0|2,0,0]=4 4679 B12R1.1819 CC(=O)NC1CCC(CC1)(C)C 240690a_100000757809_100015343762 [0,2,0,0,0,0|2,0,0]=4 4680 B12R1.1819 CC(=O)NC1CCC(CC1)(C)C 527a_100000757809_100103153847 [0,2,0,0,0,0|2,0,0]=4 4681 B12R1.1819 CC(=O)NC1CCC(CC1)(F)F 11a_100000694335_100015343762 [0,2,0,0,0,0|2,0,0]=4 4682 B12R1.1819 CC(=O)NC1CCC(CC1)(F)F 1626a_100000694335_100015343762 [0,2,0,0,0,0|2,0,0]=4 4683 B12R1.1819 CC(=O)NC1CCC(CC1)(F)F 240690a_100000694335_100015343762 [0,2,0,0,0,0|2,0,0]=4 4684 B12R1.1819 CC(=O)NC1CCC(CC1)(F)F 527a_100000694335_100103153847 [0,2,0,0,0,0|2,0,0]=4 4685 B12R1.1819 CC(=O)N[C@H]1CC[C@](CC1)(C)O 11a_202125554758_100015343762 [0,2,0,0,0,0|2,0,0]=4 4686 B12R1.1819 CC(=O)N[C@H]1CC[C@](CC1)(C)O 1626a_202125554758_100015343762 [0,2,0,0,0,0|2,0,0]=4 4687 B12R1.1819 CC(=O)N[C@H]1CC[C@](CC1)(C)O 240690a_202125554758_100015343762 [0,2,0,0,0,0|2,0,0]=4 4688 B12R1.1819 CC(=O)N[C@H]1CC[C@](CC1)(C)O 527a_202125554758_100103153847 [0,2,0,0,0,0|2,0,0]=4 4689 B12R1.1819 CC1(CCN(CC1)CC(=O)N)C 2230a_100000750138_100000747473 [0,2,0,0,0,0|2,0,0]=4 4690 B12R1.1819 CC1(CCN(CC1)CC(=O)N)C 269982a_100000750138_100000187820 [0,2,0,0,0,0|2,0,0]=4 4691 B12R1.1819 CC1(CCN(CC1)CC(=O)N)O 2230a_100000690209_100000747473 [0,2,0,0,0,0|2,0,0]=4 4692 B12R1.1819 CC1(CCN(CC1)CC(=O)N)O 269982a_100000690209_100000187820 [0,2,0,0,0,0|2,0,0]=4 4693 B12R1.1819 CC1(CCN(CC1)CC(=O)[O-])C 269982a_100000750138_100020667443 [0,2,0,0,0,0|1,0,1]=4 4694 B12R1.1819 CC1(CCN(CC1)CC(=O)[O-])O 269982a_100000690209_100020667443 [0,2,0,0,0,0|1,0,1]=4 4695 B12R1.1819 NC(=O)CN1CCC(CC1)(F)F 2230a_100000724815_100000747473 [0,2,0,0,0,0|2,0,0]=4 4696 B12R1.1819 NC(=O)CN1CCC(CC1)(F)F 269982a_100000724815_100000187820 [0,2,0,0,0,0|2,0,0]=4 4697 B12R1.1819 NC(=O)CN1CCC(CC1)(F)F 34a_100000724815_100000187820 [0,2,0,0,0,0|2,0,0]=4 4698 B12R1.1819 NC(=O)CN1CCC(CC1)(O)O 269982a_100016987284_100000187820 [0,2,0,0,0,0|2,0,0]=4 4699 B12R1.1819 O=C([O-])CN1CCC(CC1)(F)F 269982a_100000724815_100020667443 [0,2,0,0,0,0|1,0,1]=4 4700 B12R1.1819 O=C([O-])CN1CCC(CC1)(F)F 34a_100000724815_100020667443 [0,2,0,0,0,0|1,0,1]=4 4701 B12R1.1819 O=C([O-])CN1CCC(CC1)(O)O 269982a_100016987284_100020667443 [0,2,0,0,0,0|1,0,1]=4 4702 B12R1.1819 [13CH3]C(=O)CC1CCC(CC1)(F)F 1458a_100000101020_200025704644 [0,2,0,0,0,0|1,0,0]=3 4703 B12R1.34 C=CC(=O)N(C)C1CCCCC1 1626a_100000207522_100000185746 [0,2,0,0,0,0|2,0,0]=4 4704 B12R1.34 C=CC(=O)N(C)C1CCCCC1 240690a_100000207522_200121576911 [0,2,0,0,0,0|2,0,0]=4 4705 B12R1.34 CC(C(=O)CF)C1CCCCC1 1458a_100011435303_100015361967 [0,2,0,0,0,0|1,0,0]=3 4706 B12R1.34 CCC(=O)C(C)C1CCCCC1 1458a_100011435303_100000210202 [0,2,0,0,0,0|1,0,0]=3 4707 B12R1.34 CCC(=O)C(O)C1CCCCC1 1458a_100000242593_100000210202 [0,2,0,0,0,0|1,0,0]=3 4708 B12R1.34 CCC(=O)N(C)C1CCCCC1 11a_100000207522_100000210414 [0,2,0,0,0,0|2,0,0]=4 4709 B12R1.34 CCC(=O)N(C)C1CCCCC1 1626a_100000207522_100000210414 [0,2,0,0,0,0|2,0,0]=4 4710 B12R1.34 CCC(=O)N(C)C1CCCCC1 240690a_100000207522_100000210414 [0,2,0,0,0,0|2,0,0]=4 4711 B12R1.34 CCC(=O)N(C)C1CCCCC1 527a_100000207522_100000210414 [0,2,0,0,0,0|2,0,0]=4 4712 B12R1.34 CN(C(=O)CO)C1CCCCC1 240690a_100000207522_100000210174 [0,2,0,0,0,0|1,0,0]=3 4713 B12R1.34 CN(C(=O)CO)C1CCCCC1 527a_100000207522_100000210174 [0,2,0,0,0,0|1,0,0]=3 4714 B12R1.34 CN(C(=O)CO)C1CCOCC1 240690a_100020587155_100000210174 [0,2,0,0,0,0|2,0,0]=4 4715 B12R1.34 CN(C(=O)CO)C1CCOCC1 527a_100020587155_100000210174 [0,2,0,0,0,0|2,0,0]=4 4716 B12R1.34 CN(C(=O)CO)C1CCSCC1 240690a_100015184757_100000210174 [0,2,0,0,0,0|2,0,0]=4 4717 B12R1.34 CN(C(=O)CO)C1CCSCC1 527a_100015184757_100000210174 [0,2,0,0,0,0|2,0,0]=4 4718 B12R1.34 CNC(=O)C(=O)C1CCCCC1 1458a_100011218921_100000210327 [0,2,0,0,0,0|1,0,1]=4 4719 B12R1.34 CNC(=O)C(C)C1CCCCC1 11a_106832991635_100011435303 [0,2,0,0,0,0|1,0,0]=3 4720 B12R1.34 CNC(=O)C(C)C1CCCCC1 1626a_100102657272_100011435303 [0,2,0,0,0,0|1,0,0]=3 4721 B12R1.34 CNC(=O)C(C)C1CCCCC1 240690a_100102657272_100011435303 [0,2,0,0,0,0|1,0,0]=3 4722 B12R1.34 CNC(=O)C(C)C1CCCCC1 527a_100102657272_100011435303 [0,2,0,0,0,0|1,0,0]=3 4723 B12R1.34 CNC(=O)C(O)C1CCCCC1 240690a_100102657272_100000242593 [0,2,0,0,0,0|1,0,0]=3 4724 B12R1.34 CNC(=O)N(C)C1CCCCC1 2708a_100102657272_100000207522 [0,2,0,0,0,0|2,0,0]=4 4725 B12R1.34 CNC(=O)N(C)C1CCCCC1 273464a_100102657272_100000207522 [0,2,0,0,0,0|2,0,0]=4 4726 B12R1.34 COC(=O)C(C)N1CCCOC1 2230a_100000131196_100000211248 [0,2,0,0,0,0|2,0,0]=4 4727 B12R1.34 COC(=O)C(C)N1CCCOC1 269982a_100000131196_100000211248 [0,2,0,0,0,0|2,0,0]=4 4728 B12R1.34 COC(=O)C(C)N1CCCOC1 34a_100000131196_100000211248 [0,2,0,0,0,0|2,0,0]=4 4729 B12R1.34 COC(=O)C(C)N1CCOCC1 2230a_100015191051_100000211248 [0,2,0,0,0,0|2,0,0]=4 4730 B12R1.34 COC(=O)C(C)N1CCOCC1 269982a_100015191051_100000211248 [0,2,0,0,0,0|2,0,0]=4 4731 B12R1.34 COC(=O)C(C)N1CCOCC1 34a_100015191051_100000211248 [0,2,0,0,0,0|2,0,0]=4 4732 B12R1.34 COC(=O)C(C)N1CCSCC1 2230a_100000737611_100000211248 [0,2,0,0,0,0|2,0,0]=4 4733 B12R1.34 COC(=O)C(C)N1CCSCC1 269982a_100000737611_100000211248 [0,2,0,0,0,0|2,0,0]=4 4734 B12R1.34 O=C(CF)C(O)C1CCCCC1 1458a_100000242593_100015361967 [0,2,0,0,0,0|1,0,0]=3 4735 B12R1.124 CC(=O)C(C)N1CCCCC1C 2230a_100000211376_100009814033 [0,2,0,0,0,0|2,0,0]=4 4736 B12R1.124 CC(=O)C(C)N1CCCCC1C 269982a_100000211376_100009814033 [0,2,0,0,0,0|2,0,0]=4 4737 B12R1.124 CC(=O)N(C)[C@@H]1CCCC[C@H]1O 240690a_100000708425_100015343762 [0,2,0,0,0,0|2,0,0]=4 4738 B12R1.124 CC1CCCCN1C(C)C(=O)N 2230a_100000211376_100000702099 [0,2,0,0,0,0|2,0,0]=4 4739 B12R1.124 CC1CCCCN1C(C)C(=O)N 269982a_100000211376_100000184083 [0,2,0,0,0,0|2,0,0]=4 4740 B12R1.124 CC1CCCCN1C(C)C(=O)N 34a_100000211376_100000702099 [0,2,0,0,0,0|2,0,0]=4 4741 B12R1.124 CC1CCCCN1C(F)C(=O)N 2230a_100000211376_100009813875 [0,2,0,0,0,0|2,0,0]=4 4742 B12R1.124 CC1CCCCN1C(F)C(=O)N 269982a_100000211376_100009813875 [0,2,0,0,0,0|2,0,0]=4 4743 B12R1.124 CC1CCCCN1C(F)C(=O)N 34a_100000211376_100009813875 [0,2,0,0,0,0|2,0,0]=4 4744 B12R1.124 CC1CCCCN1C(F)C(=O)[O-] 34a_100000211376_100020610796 [0,2,0,0,0,0|1,0,1]=4 4745 B12R1.225 CC(=O)C(C)N1CCCC(C1)C 1458a_200000238025_200000210301 [0,2,0,0,0,0|2,0,0]=4 4746 B12R1.225 CC(=O)C(C)N1CCCC(C1)F 2230a_100000697950_100009814033 [0,2,0,0,0,0|2,0,0]=4 4747 B12R1.225 CC(=O)C(C)N1CCCC(C1)F 269982a_100000697950_100009814033 [0,2,0,0,0,0|2,0,0]=4 4748 B12R1.225 CC(=O)C(C)N1CCCC(C1)O 2230a_100000211013_100009814033 [0,2,0,0,0,0|2,0,0]=4 4749 B12R1.225 CC(=O)C(C)N1CCCC(C1)O 269982a_100000211013_100009814033 [0,2,0,0,0,0|2,0,0]=4 4750 B12R1.225 CC(=O)C(C)N1CCC[C@@H](C1)C 2230a_100000717927_100009814033 [0,2,0,0,0,0|2,0,0]=4 4751 B12R1.225 CC(=O)C(C)N1CCC[C@@H](C1)C 269982a_100000717927_100009814033 [0,2,0,0,0,0|2,0,0]=4 4752 B12R1.225 CC(C(=O)N)N1CCCC(C1)F 2230a_100000697950_100000702099 [0,2,0,0,0,0|2,0,0]=4 4753 B12R1.225 CC(C(=O)N)N1CCCC(C1)F 269982a_100000697950_100000184083 [0,2,0,0,0,0|2,0,0]=4 4754 B12R1.225 CC(C(=O)N)N1CCCC(C1)F 34a_100000697950_100000702099 [0,2,0,0,0,0|2,0,0]=4 4755 B12R1.225 CC(C(=O)N)N1CCCC(C1)O 2230a_100000211013_100000702099 [0,2,0,0,0,0|2,0,0]=4 4756 B12R1.225 CC(C(=O)N)N1CCCC(C1)O 269982a_100000211013_100000184083 [0,2,0,0,0,0|2,0,0]=4 4757 B12R1.225 CC(C(=O)N)N1CCC[C@@H](C1)C 2230a_100000717927_100000702099 [0,2,0,0,0,0|2,0,0]=4 4758 B12R1.225 CC(C(=O)N)N1CCC[C@@H](C1)C 269982a_100000717927_100000184083 [0,2,0,0,0,0|2,0,0]=4 4759 B12R1.225 CC(C(=O)N)N1CCC[C@@H](C1)C 34a_100000717927_100000702099 [0,2,0,0,0,0|2,0,0]=4 4760 B12R1.225 CC1CCCN(C1)C(C)C(=O)[13CH3] 1458a_200000238025_200025704644 [0,2,0,0,0,0|2,0,0]=4 4761 B12R1.225 C[C@H]1CCCN(C1)C(F)C(=O)N 2230a_100000717927_100009813875 [0,2,0,0,0,0|2,0,0]=4 4762 B12R1.225 C[C@H]1CCCN(C1)C(F)C(=O)N 269982a_100000717927_100009813875 [0,2,0,0,0,0|2,0,0]=4 4763 B12R1.225 C[C@H]1CCCN(C1)C(F)C(=O)N 34a_100000717927_100009813875 [0,2,0,0,0,0|2,0,0]=4 4764 B12R1.225 C[C@H]1CCCN(C1)C(F)C(=O)[O-] 34a_100000717927_100020610796 [0,2,0,0,0,0|1,0,1]=4 4765 B12R1.225 NC(=O)C(F)N1CCCC(C1)F 2230a_100000697950_100009813875 [0,2,0,0,0,0|2,0,0]=4 4766 B12R1.225 NC(=O)C(F)N1CCCC(C1)F 269982a_100000697950_100009813875 [0,2,0,0,0,0|2,0,0]=4 4767 B12R1.225 NC(=O)C(F)N1CCCC(C1)F 34a_100000697950_100009813875 [0,2,0,0,0,0|2,0,0]=4 4768 B12R1.225 NC(=O)C(F)N1CCCC(C1)O 2230a_100000211013_100009813875 [0,2,0,0,0,0|2,0,0]=4 4769 B12R1.225 NC(=O)C(F)N1CCCC(C1)O 269982a_100000211013_100009813875 [0,2,0,0,0,0|2,0,0]=4 4770 B12R1.225 O=C([O-])C(F)N1CCCC(C1)F 34a_100000697950_100020610796 [0,2,0,0,0,0|1,0,1]=4 4771 B12R1.253 CC(=O)C(C)(C)N1CCCCC1 1458a_100025777015_200000210301 [0,2,0,0,0,0|2,0,0]=4 4772 B12R1.253 CC(C)(C(=O)[13CH3])N1CCCCC1 1458a_100025777015_200025704644 [0,2,0,0,0,0|2,0,0]=4 4773 B12R1.478 CCN(C(=O)C)C1CCCCC1 11a_100000201195_100015343762 [0,2,0,0,0,0|2,0,0]=4 4774 B12R1.478 CCN(C(=O)C)C1CCCCC1 1626a_100000201195_100015343762 [0,2,0,0,0,0|2,0,0]=4 4775 B12R1.478 CCN(C(=O)C)C1CCCCC1 240690a_100000201195_100015343762 [0,2,0,0,0,0|2,0,0]=4 4776 B12R1.478 CCN(C(=O)C)C1CCCCC1 527a_100000201195_100103153847 [0,2,0,0,0,0|2,0,0]=4 4777 B12R1.478 CNC(C(=O)O)C1CCCCC1 269956a_100000742913_200000210301 [0,2,0,0,0,0|0,0,0]=2 4778 B12R1.478 CNC(C(=O)O)C1CCOCC1 269956a_100016988913_200000210301 [0,2,0,0,0,0|1,0,0]=3 4779 B12R1.478 [13CH3]NC(C(=O)O)C1CCCCC1 269956a_100000742913_200025704644 [0,2,0,0,0,0|0,0,0]=2 4780 B12R1.478 [13CH3]NC(C(=O)O)C1CCOCC1 269956a_100016988913_200025704644 [0,2,0,0,0,0|1,0,0]=3 4781 B12R1.32 C#CCC(=O)CC1CCCCC1 1458a_100000211666_100000184674 [0,2,0,0,0,0|1,0,0]=3 4782 B12R1.32 C#CCC(=O)CC1CCCCC1 1458a_100011220946_100000211423 [0,2,0,0,0,0|1,0,0]=3 4783 B12R1.32 C#CCC(=O)CC1CCCCO1 1458a_100000238585_100000184674 [0,2,0,0,0,0|2,0,0]=4 4784 B12R1.32 C#CCC(=O)CC1CCCCO1 1458a_100011220946_100000211543 [0,2,0,0,0,0|2,0,0]=4 4785 B12R1.32 C#CCC(=O)CC1CCCOC1 1458a_100000741523_100000184674 [0,2,0,0,0,0|2,0,0]=4 4786 B12R1.32 C#CCC(=O)CC1CCCOC1 1458a_100011220946_100000741521 [0,2,0,0,0,0|2,0,0]=4 4787 B12R1.32 C#CCC(=O)CC1CCOCC1 1458a_100000757261_100000184674 [0,2,0,0,0,0|2,0,0]=4 4788 B12R1.32 C#CCC(=O)CC1CCOCC1 1458a_100011220946_100000754603 [0,2,0,0,0,0|2,0,0]=4 4789 B12R1.32 C#CCC(=O)CN1CCCCC1 1458a_100000740322_100000184674 [0,2,0,0,0,0|2,0,0]=4 4790 B12R1.32 C#CCC(=O)NC1CCCCC1 1626a_100000182618_100011220946 [0,2,0,0,0,0|2,0,0]=4 4791 B12R1.32 C#CCC(=O)NC1CCCCC1 527a_100000182618_100011220946 [0,2,0,0,0,0|2,0,0]=4 4792 B12R1.32 C=CCC(=O)CC1CCCCC1 1458a_100000210193_100000211423 [0,2,0,0,0,0|1,0,0]=3 4793 B12R1.32 C=CCC(=O)CC1CCCCC1 1458a_100000211666_100000210623 [0,2,0,0,0,0|1,0,0]=3 4794 B12R1.32 C=CCC(=O)CC1CCCCO1 1458a_100000210193_100000211543 [0,2,0,0,0,0|2,0,0]=4 4795 B12R1.32 C=CCC(=O)CC1CCCCO1 1458a_100000238585_100000210623 [0,2,0,0,0,0|2,0,0]=4 4796 B12R1.32 C=CCC(=O)CC1CCCOC1 1458a_100000210193_100000741521 [0,2,0,0,0,0|2,0,0]=4 4797 B12R1.32 C=CCC(=O)CC1CCCOC1 1458a_100000741523_100000210623 [0,2,0,0,0,0|2,0,0]=4 4798 B12R1.32 C=CCC(=O)CC1CCOCC1 1458a_100000210193_100000754603 [0,2,0,0,0,0|2,0,0]=4 4799 B12R1.32 C=CCC(=O)CC1CCOCC1 1458a_100000757261_100000210623 [0,2,0,0,0,0|2,0,0]=4 4800 B12R1.32 C=CCC(=O)CN1CCCCC1 1458a_100000740322_100000210623 [0,2,0,0,0,0|2,0,0]=4 4801 B12R1.32 C=CCC(=O)NC1CCCCC1 11a_100000182618_100000210193 [0,2,0,0,0,0|2,0,0]=4 4802 B12R1.32 C=CCC(=O)NC1CCCCC1 1626a_100000182618_100000210193 [0,2,0,0,0,0|2,0,0]=4 4803 B12R1.32 C=CCC(=O)NC1CCCCC1 240690a_100000182618_100000210193 [0,2,0,0,0,0|2,0,0]=4 4804 B12R1.32 C=CCC(=O)NC1CCCCC1 527a_100000182618_100000210193 [0,2,0,0,0,0|2,0,0]=4 4805 B12R1.32 C=COC(=O)CN1CCCOC1 2230a_100000131196_100000036128 [0,2,0,0,0,0|2,0,0]=4 4806 B12R1.32 C=COC(=O)CN1CCCOC1 269982a_100000131196_100000036128 [0,2,0,0,0,0|2,0,0]=4 4807 B12R1.32 C=COC(=O)CN1CCCOC1 34a_100000131196_100000036128 [0,2,0,0,0,0|2,0,0]=4 4808 B12R1.32 C=COC(=O)CN1CCOCC1 2230a_100015191051_100000036128 [0,2,0,0,0,0|2,0,0]=4 4809 B12R1.32 C=COC(=O)CN1CCOCC1 269982a_100015191051_100000036128 [0,2,0,0,0,0|2,0,0]=4 4810 B12R1.32 C=COC(=O)CN1CCOCC1 34a_100015191051_100000036128 [0,2,0,0,0,0|2,0,0]=4 4811 B12R1.32 C=COC(=O)CN1CCSCC1 2230a_100000737611_100000036128 [0,2,0,0,0,0|2,0,0]=4 4812 B12R1.32 C=COC(=O)CN1CCSCC1 269982a_100000737611_100000036128 [0,2,0,0,0,0|2,0,0]=4 4813 B12R1.32 CC#CC(=O)CC1CCCCC1 1458a_100000763181_100000211423 [0,2,0,0,0,0|1,0,0]=3 4814 B12R1.32 CC#CC(=O)CC1CCCCO1 1458a_100000763181_100000211543 [0,2,0,0,0,0|2,0,0]=4 4815 B12R1.32 CC#CC(=O)CC1CCCOC1 1458a_100000763181_100000741521 [0,2,0,0,0,0|2,0,0]=4 4816 B12R1.32 CC#CC(=O)CC1CCOCC1 1458a_100000763181_100000754603 [0,2,0,0,0,0|2,0,0]=4 4817 B12R1.32 CC=CC(=O)CC1CCCCC1 1458a_100000210699_100000211423 [0,2,0,0,0,0|1,0,0]=3 4818 B12R1.32 CC=CC(=O)CC1CCCCO1 1458a_100000210699_100000211543 [0,2,0,0,0,0|2,0,0]=4 4819 B12R1.32 CC=CC(=O)CC1CCCOC1 1458a_100000210699_100000741521 [0,2,0,0,0,0|2,0,0]=4 4820 B12R1.32 CC=CC(=O)CC1CCOCC1 1458a_100000210699_100000754603 [0,2,0,0,0,0|2,0,0]=4 4821 B12R1.32 CC=CC(=O)NC1CCCCC1 11a_100000182618_100000210699 [0,2,0,0,0,0|2,0,0]=4 4822 B12R1.32 CC=CC(=O)NC1CCCCC1 1626a_100000182618_100000210699 [0,2,0,0,0,0|2,0,0]=4 4823 B12R1.32 CC=CC(=O)NC1CCCCC1 240690a_100000182618_100000210699 [0,2,0,0,0,0|2,0,0]=4 4824 B12R1.32 CCCC(=O)CC1CCCCC1 1458a_100000211666_100000210303 [0,2,0,0,0,0|1,0,0]=3 4825 B12R1.32 CCCC(=O)CC1CCCCC1 1458a_100000211992_100000211423 [0,2,0,0,0,0|1,0,0]=3 4826 B12R1.32 CCCC(=O)CC1CCCCO1 1458a_100000211992_100000211543 [0,2,0,0,0,0|2,0,0]=4 4827 B12R1.32 CCCC(=O)CC1CCCCO1 1458a_100000238585_100000210303 [0,2,0,0,0,0|2,0,0]=4 4828 B12R1.32 CCCC(=O)CC1CCCOC1 1458a_100000211992_100000741521 [0,2,0,0,0,0|2,0,0]=4 4829 B12R1.32 CCCC(=O)CC1CCCOC1 1458a_100000741523_100000210303 [0,2,0,0,0,0|2,0,0]=4 4830 B12R1.32 CCCC(=O)CC1CCOCC1 1458a_100000211992_100000754603 [0,2,0,0,0,0|2,0,0]=4 4831 B12R1.32 CCCC(=O)CC1CCOCC1 1458a_100000757261_100000210303 [0,2,0,0,0,0|2,0,0]=4 4832 B12R1.32 CCCC(=O)CN1CCCCC1 1458a_100000740322_100000210303 [0,2,0,0,0,0|2,0,0]=4 4833 B12R1.32 CCCC(=O)NC1CCCCC1 11a_100000182618_100000211992 [0,2,0,0,0,0|2,0,0]=4 4834 B12R1.32 CCCC(=O)NC1CCCCC1 1626a_100000182618_100000211992 [0,2,0,0,0,0|2,0,0]=4 4835 B12R1.32 CCCC(=O)NC1CCCCC1 240690a_100000182618_100000211992 [0,2,0,0,0,0|2,0,0]=4 4836 B12R1.32 CCCC(=O)NC1CCCCC1 527a_100000182618_100000211992 [0,2,0,0,0,0|2,0,0]=4 4837 B12R1.32 CCNC(=O)CC1CCCCC1 11a_100015525214_100000211666 [0,2,0,0,0,0|1,0,0]=3 4838 B12R1.32 CCNC(=O)CC1CCCCC1 240690a_100015525214_100000211666 [0,2,0,0,0,0|1,0,0]=3 4839 B12R1.32 CCNC(=O)CC1CCCCC1 527a_100015525214_100000211666 [0,2,0,0,0,0|1,0,0]=3 4840 B12R1.32 CCNC(=O)CC1CCCCO1 11a_100015525214_100000238585 [0,2,0,0,0,0|2,0,0]=4 4841 B12R1.32 CCNC(=O)CC1CCCCO1 240690a_100015525214_100000238585 [0,2,0,0,0,0|2,0,0]=4 4842 B12R1.32 CCNC(=O)CC1CCCCO1 527a_100015525214_100000238585 [0,2,0,0,0,0|2,0,0]=4 4843 B12R1.32 CCNC(=O)CC1CCCOC1 11a_100015525214_100000741523 [0,2,0,0,0,0|2,0,0]=4 4844 B12R1.32 CCNC(=O)CC1CCCOC1 240690a_100015525214_100000741523 [0,2,0,0,0,0|2,0,0]=4 4845 B12R1.32 CCNC(=O)CC1CCCOC1 527a_100015525214_100000741523 [0,2,0,0,0,0|2,0,0]=4 4846 B12R1.32 CCNC(=O)CC1CCOCC1 11a_100015525214_100000757261 [0,2,0,0,0,0|2,0,0]=4 4847 B12R1.32 CCNC(=O)CC1CCOCC1 240690a_100015525214_100000757261 [0,2,0,0,0,0|2,0,0]=4 4848 B12R1.32 CCNC(=O)CC1CCOCC1 527a_100015525214_100000757261 [0,2,0,0,0,0|2,0,0]=4 4849 B12R1.32 CCNC(=O)CN1CCCCC1 11a_100015525214_100000740322 [0,2,0,0,0,0|2,0,0]=4 4850 B12R1.32 CCNC(=O)CN1CCCCC1 240690a_100015525214_100000740322 [0,2,0,0,0,0|2,0,0]=4 4851 B12R1.32 CCNC(=O)CN1CCCCC1 527a_100015525214_100000740322 [0,2,0,0,0,0|2,0,0]=4 4852 B12R1.32 CCNC(=O)NC1CCCCC1 2708a_100000182618_100015525214 [0,2,0,0,0,0|2,0,0]=4 4853 B12R1.32 CCNC(=O)NC1CCCCC1 2708a_100015525214_100000182618 [0,2,0,0,0,0|2,0,0]=4 4854 B12R1.32 CCNC(=O)NC1CCCCC1 273464a_100000182618_100015525214 [0,2,0,0,0,0|2,0,0]=4 4855 B12R1.32 CCNC(=O)NC1CCCCC1 273464a_100015525214_100000182618 [0,2,0,0,0,0|2,0,0]=4 4856 B12R1.32 CCOC(=O)CN1CCCOC1 2230a_100000131196_100000188475 [0,2,0,0,0,0|2,0,0]=4 4857 B12R1.32 CCOC(=O)CN1CCCOC1 269982a_100000131196_100000188475 [0,2,0,0,0,0|2,0,0]=4 4858 B12R1.32 CCOC(=O)CN1CCCOC1 34a_100000131196_100000188475 [0,2,0,0,0,0|2,0,0]=4 4859 B12R1.32 CCOC(=O)CN1CCOCC1 2230a_100015191051_100000188475 [0,2,0,0,0,0|2,0,0]=4 4860 B12R1.32 CCOC(=O)CN1CCOCC1 269982a_100015191051_100000188475 [0,2,0,0,0,0|2,0,0]=4 4861 B12R1.32 CCOC(=O)CN1CCOCC1 34a_100015191051_100000188475 [0,2,0,0,0,0|2,0,0]=4 4862 B12R1.32 CCOC(=O)CN1CCSCC1 2230a_100000737611_100000188475 [0,2,0,0,0,0|2,0,0]=4 4863 B12R1.32 CCOC(=O)CN1CCSCC1 269982a_100000737611_100000188475 [0,2,0,0,0,0|2,0,0]=4 4864 B12R1.32 CN(CC=O)CC1CCCCC1 2230a_100000736448_200015260668 [0,2,0,0,0,0|2,0,0]=4 4865 B12R1.32 CN(CC=O)CC1CCCCC1 269982a_100000736448_200015260668 [0,2,0,0,0,0|2,0,0]=4 4866 B12R1.32 CN(CC=O)CC1CCCCC1 34a_100000736448_200009817547 [0,2,0,0,0,0|2,0,0]=4 4867 B12R1.32 CN(CCO)CC1CCCCC1 2230a_100000210263_100000211423 [0,2,0,0,0,0|2,0,0]=4 4868 B12R1.32 CN(CCO)CC1CCCCC1 2230a_100000736448_100000211926 [0,2,0,0,0,0|2,0,0]=4 4869 B12R1.32 CN(CCO)CC1CCCCC1 269982a_100000210263_100000211423 [0,2,0,0,0,0|2,0,0]=4 4870 B12R1.32 CN(CCO)CC1CCCCC1 269982a_100000736448_100000211926 [0,2,0,0,0,0|2,0,0]=4 4871 B12R1.32 CN(CCO)CC1CCCCC1 34a_100000736448_100000211926 [0,2,0,0,0,0|2,0,0]=4 4872 B12R1.32 CNCC(=O)NC1CCCCC1 2230a_100015207117_200000210301 [0,2,0,0,0,0|2,0,0]=4 4873 B12R1.32 CNCC(=O)NC1CCCCC1 2230a_106832991635_100000183541 [0,2,0,0,0,0|2,0,0]=4 4874 B12R1.32 CNCC(=O)NC1CCCCC1 34a_100102657272_100000183541 [0,2,0,0,0,0|2,0,0]=4 4875 B12R1.32 CNCC(=O)NC1CCCCC1 7a_106832991635_100000183541 [0,2,0,0,0,0|2,0,0]=4 4876 B12R1.32 CNCC(=O)OC1CCCCC1 2230a_106832991635_100000041653 [0,2,0,0,0,0|2,0,0]=4 4877 B12R1.32 CNCC(=O)OC1CCCCC1 34a_100102657272_100000041653 [0,2,0,0,0,0|2,0,0]=4 4878 B12R1.32 CNCC(=O)OC1CCCCC1 7a_106832991635_100000041653 [0,2,0,0,0,0|2,0,0]=4 4879 B12R1.32 CNNC(=O)CC1CCCCC1 22a_100016993582_100000211666 [0,2,0,0,0,0|1,0,0]=3 4880 B12R1.32 CNNC(=O)CC1CCCCO1 22a_100016993582_100000238585 [0,2,0,0,0,0|2,0,0]=4 4881 B12R1.32 CNNC(=O)CC1CCCOC1 22a_100016993582_100000741523 [0,2,0,0,0,0|2,0,0]=4 4882 B12R1.32 CNNC(=O)CC1CCOCC1 22a_100016993582_100000757261 [0,2,0,0,0,0|2,0,0]=4 4883 B12R1.32 CNNC(=O)CN1CCCCC1 22a_100016993582_100000740322 [0,2,0,0,0,0|2,0,0]=4 4884 B12R1.32 CNNC(=O)NC1CCCCC1 273464a_100000182618_100016993582 [0,2,0,0,0,0|2,0,0]=4 4885 B12R1.32 COCC(=O)CC1CCCCC1 1458a_100000210968_100000211423 [0,2,0,0,0,0|0,0,0]=2 4886 B12R1.32 COCC(=O)CC1CCCCO1 1458a_100000210968_100000211543 [0,2,0,0,0,0|1,0,0]=3 4887 B12R1.32 COCC(=O)CC1CCCOC1 1458a_100000210968_100000741521 [0,2,0,0,0,0|1,0,0]=3 4888 B12R1.32 COCC(=O)CC1CCOCC1 1458a_100000210968_100000754603 [0,2,0,0,0,0|1,0,0]=3 4889 B12R1.32 COCC(=O)NC1CCCCC1 11a_100000182618_100000210968 [0,2,0,0,0,0|1,0,0]=3 4890 B12R1.32 COCC(=O)NC1CCCCC1 1626a_100000182618_100000210968 [0,2,0,0,0,0|1,0,0]=3 4891 B12R1.32 COCC(=O)NC1CCCCC1 240690a_100000182618_100000210968 [0,2,0,0,0,0|1,0,0]=3 4892 B12R1.32 COCC(=O)NC1CCCCC1 34a_100138415774_100000183541 [0,2,0,0,0,0|1,0,0]=3 4893 B12R1.32 COCC(=O)NC1CCCCC1 527a_100000182618_100000210968 [0,2,0,0,0,0|1,0,0]=3 4894 B12R1.32 COCC(=O)NC1CCCOC1 11a_100000719290_100000210968 [0,2,0,0,0,0|2,0,0]=4 4895 B12R1.32 COCC(=O)NC1CCCOC1 1626a_100000719290_100000210968 [0,2,0,0,0,0|2,0,0]=4 4896 B12R1.32 COCC(=O)NC1CCCOC1 240690a_100000719290_100000210968 [0,2,0,0,0,0|2,0,0]=4 4897 B12R1.32 COCC(=O)NC1CCCOC1 527a_100000719290_100000210968 [0,2,0,0,0,0|2,0,0]=4 4898 B12R1.32 COCC(=O)NC1CCOCC1 11a_100000741149_100000210968 [0,2,0,0,0,0|2,0,0]=4 4899 B12R1.32 COCC(=O)NC1CCOCC1 1626a_100000741149_100000210968 [0,2,0,0,0,0|2,0,0]=4 4900 B12R1.32 COCC(=O)NC1CCOCC1 240690a_100000741149_100000210968 [0,2,0,0,0,0|2,0,0]=4 4901 B12R1.32 COCC(=O)NC1CCOCC1 527a_100000741149_100000210968 [0,2,0,0,0,0|2,0,0]=4 4902 B12R1.32 COCC(=O)NC1CCSCC1 11a_100000748639_100000210968 [0,2,0,0,0,0|2,0,0]=4 4903 B12R1.32 COCC(=O)NC1CCSCC1 1626a_100000748639_100000210968 [0,2,0,0,0,0|2,0,0]=4 4904 B12R1.32 COCC(=O)NC1CCSCC1 240690a_100000748639_100000210968 [0,2,0,0,0,0|2,0,0]=4 4905 B12R1.32 COCC(=O)NC1CCSCC1 527a_100000748639_100000210968 [0,2,0,0,0,0|2,0,0]=4 4906 B12R1.32 COCC(=O)OC1CCCCC1 34a_100138415774_100000041653 [0,2,0,0,0,0|1,0,0]=3 4907 B12R1.32 COCN(C)CC1CCCCC1 2230a_100000736448_100000766300 [0,2,0,0,0,0|2,0,0]=4 4908 B12R1.32 COCN(C)CC1CCCCC1 269982a_100000736448_100000766300 [0,2,0,0,0,0|2,0,0]=4 4909 B12R1.32 COC[C@@H](N)CC1CCCCC1 34a_100015184289_200000210301 [0,2,0,0,0,0|1,0,1]=4 4910 B12R1.32 CSCC(=O)CC1CCCCC1 1458a_100000184570_100000211423 [0,2,0,0,0,0|0,1,0]=3 4911 B12R1.32 CSCC(=O)CC1CCCCO1 1458a_100000184570_100000211543 [0,2,0,0,0,0|1,1,0]=4 4912 B12R1.32 CSCC(=O)CC1CCCOC1 1458a_100000184570_100000741521 [0,2,0,0,0,0|1,1,0]=4 4913 B12R1.32 CSCC(=O)CC1CCOCC1 1458a_100000184570_100000754603 [0,2,0,0,0,0|1,1,0]=4 4914 B12R1.32 CSCC(=O)NC1CCCCC1 11a_100000182618_100000184570 [0,2,0,0,0,0|1,1,0]=4 4915 B12R1.32 CSCC(=O)NC1CCCCC1 1626a_100000182618_100000184570 [0,2,0,0,0,0|1,1,0]=4 4916 B12R1.32 CSCC(=O)NC1CCCCC1 240690a_100000182618_100000184570 [0,2,0,0,0,0|1,1,0]=4 4917 B12R1.32 CSCC(=O)NC1CCCCC1 527a_100000182618_100000184570 [0,2,0,0,0,0|1,1,0]=4 4918 B12R1.32 CSCC(=O)NC1CCCCC1 62a_100000183541_200000210301 [0,2,0,0,0,0|1,1,0]=4 4919 B12R1.32 CSCC(=O)NC1CCCCC1 62a_200000210301_100000183541 [0,2,0,0,0,0|1,1,0]=4 4920 B12R1.32 CSCC(=O)OC1CCCCC1 62a_100000041653_200000210301 [0,2,0,0,0,0|1,1,0]=4 4921 B12R1.32 CSCC(=O)OC1CCCCC1 62a_200000210301_100000041653 [0,2,0,0,0,0|1,1,0]=4 4922 B12R1.32 N#CCC(=O)CC1CCCCC1 1458a_100000211666_100011214920 [0,2,0,0,0,0|1,0,0]=3 4923 B12R1.32 N#CCC(=O)CC1CCCCC1 1458a_100051588842_100000211423 [0,2,0,0,0,0|1,0,0]=3 4924 B12R1.32 N#CCC(=O)CC1CCCCO1 1458a_100000238585_100011214920 [0,2,0,0,0,0|2,0,0]=4 4925 B12R1.32 N#CCC(=O)CC1CCCCO1 1458a_100051588842_100000211543 [0,2,0,0,0,0|2,0,0]=4 4926 B12R1.32 N#CCC(=O)CC1CCCOC1 1458a_100000741523_100011214920 [0,2,0,0,0,0|2,0,0]=4 4927 B12R1.32 N#CCC(=O)CC1CCCOC1 1458a_100051588842_100000741521 [0,2,0,0,0,0|2,0,0]=4 4928 B12R1.32 N#CCC(=O)CC1CCOCC1 1458a_100000757261_100011214920 [0,2,0,0,0,0|2,0,0]=4 4929 B12R1.32 N#CCC(=O)CC1CCOCC1 1458a_100051588842_100000754603 [0,2,0,0,0,0|2,0,0]=4 4930 B12R1.32 N#CCC(=O)CN1CCCCC1 1458a_100000740322_100011214920 [0,2,0,0,0,0|2,0,0]=4 4931 B12R1.32 N#CCC(=O)NC1CCCCC1 1626a_100000182618_100051588842 [0,2,0,0,0,0|2,0,0]=4 4932 B12R1.32 N#CCC(=O)NC1CCCCC1 240690a_100000182618_100051588842 [0,2,0,0,0,0|2,0,0]=4 4933 B12R1.32 O=C(C=C1CCCCC1)CCO 1458a_100000743792_100000211926 [0,2,0,0,0,0|0,0,2]=4 4934 B12R1.32 O=C(C=CBr)CC1CCCCC1 1458a_100016273825_100000211423 [0,2,0,0,0,0|1,0,0]=3 4935 B12R1.32 O=C(C=CBr)CC1CCCCO1 1458a_100016273825_100000211543 [0,2,0,0,0,0|2,0,0]=4 4936 B12R1.32 O=C(C=CBr)CC1CCCOC1 1458a_100016273825_100000741521 [0,2,0,0,0,0|2,0,0]=4 4937 B12R1.32 O=C(C=CBr)CC1CCOCC1 1458a_100016273825_100000754603 [0,2,0,0,0,0|2,0,0]=4 4938 B12R1.32 O=C(C=CBr)NC1CCCCC1 1626a_100000182618_100016273825 [0,2,0,0,0,0|2,0,0]=4 4939 B12R1.32 O=C(C=CBr)NC1CCCCC1 240690a_100000182618_100016273825 [0,2,0,0,0,0|2,0,0]=4 4940 B12R1.32 O=C(C=CCl)CC1CCCCC1 1458a_200016279998_100000211423 [0,2,0,0,0,0|1,0,0]=3 4941 B12R1.32 O=C(C=CCl)CC1CCCCO1 1458a_200016279998_100000211543 [0,2,0,0,0,0|2,0,0]=4 4942 B12R1.32 O=C(C=CCl)CC1CCCOC1 1458a_200016279998_100000741521 [0,2,0,0,0,0|2,0,0]=4 4943 B12R1.32 O=C(C=CCl)CC1CCOCC1 1458a_200016279998_100000754603 [0,2,0,0,0,0|2,0,0]=4 4944 B12R1.32 O=C(C=CCl)NC1CCCCC1 11a_100000182618_200016279998 [0,2,0,0,0,0|2,0,0]=4 4945 B12R1.32 O=C(C=CCl)NC1CCCCC1 1626a_100000182618_200016279998 [0,2,0,0,0,0|2,0,0]=4 4946 B12R1.32 O=C(C=CCl)NC1CCCCC1 240690a_100000182618_200016279998 [0,2,0,0,0,0|2,0,0]=4 4947 B12R1.32 O=C(C=CI)CC1CCCCC1 1458a_100016256311_100000211423 [0,2,0,0,0,0|1,0,0]=3 4948 B12R1.32 O=C(C=CI)CC1CCCCO1 1458a_100016256311_100000211543 [0,2,0,0,0,0|2,0,0]=4 4949 B12R1.32 O=C(C=CI)CC1CCCOC1 1458a_100016256311_100000741521 [0,2,0,0,0,0|2,0,0]=4 4950 B12R1.32 O=C(C=CI)CC1CCOCC1 1458a_100016256311_100000754603 [0,2,0,0,0,0|2,0,0]=4 4951 B12R1.32 O=C(C=CI)NC1CCCCC1 1626a_100000182618_100016256311 [0,2,0,0,0,0|2,0,0]=4 4952 B12R1.32 O=C(CCF)CC1CCCCC1 1458a_100000211666_100011217306 [0,2,0,0,0,0|1,0,0]=3 4953 B12R1.32 O=C(CCF)CC1CCCCO1 1458a_100000238585_100011217306 [0,2,0,0,0,0|2,0,0]=4 4954 B12R1.32 O=C(CCF)CC1CCCOC1 1458a_100000741523_100011217306 [0,2,0,0,0,0|2,0,0]=4 4955 B12R1.32 O=C(CCF)CC1CCOCC1 1458a_100000757261_100011217306 [0,2,0,0,0,0|2,0,0]=4 4956 B12R1.32 O=C(CCF)CN1CCCCC1 1458a_100000740322_100011217306 [0,2,0,0,0,0|2,0,0]=4 4957 B12R1.32 O=C(CCO)CC1=CCCCC1 1458a_100000039269_100000211926 [0,2,0,0,0,0|0,0,2]=4 4958 B12R1.32 O=C(CCO)CC1CCCCC1 1458a_100000211666_100000211926 [0,2,0,0,0,0|0,0,0]=2 4959 B12R1.32 O=C(CCO)CC1CCCCC1 1458a_100011216618_100000211423 [0,2,0,0,0,0|0,0,0]=2 4960 B12R1.32 O=C(CCO)CC1CCCCO1 1458a_100000238585_100000211926 [0,2,0,0,0,0|1,0,0]=3 4961 B12R1.32 O=C(CCO)CC1CCCCO1 1458a_100011216618_100000211543 [0,2,0,0,0,0|1,0,0]=3 4962 B12R1.32 O=C(CCO)CC1CCCOC1 1458a_100000741523_100000211926 [0,2,0,0,0,0|1,0,0]=3 4963 B12R1.32 O=C(CCO)CC1CCCOC1 1458a_100011216618_100000741521 [0,2,0,0,0,0|1,0,0]=3 4964 B12R1.32 O=C(CCO)CC1CCOCC1 1458a_100000757261_100000211926 [0,2,0,0,0,0|1,0,0]=3 4965 B12R1.32 O=C(CCO)CC1CCOCC1 1458a_100011216618_100000754603 [0,2,0,0,0,0|1,0,0]=3 4966 B12R1.32 O=C(CCO)CN1CCCCC1 1458a_100000740322_100000211926 [0,2,0,0,0,0|1,0,0]=3 4967 B12R1.32 O=C(CCO)CN1CCOCC1 1458a_100000740321_100000211926 [0,2,0,0,0,0|2,0,0]=4 4968 B12R1.32 O=C(CCO)NC1CCCCC1 240690a_100000182618_100011216618 [0,2,0,0,0,0|1,0,0]=3 4969 B12R1.32 O=C(CCO)NC1CCCOC1 240690a_100000719290_100011216618 [0,2,0,0,0,0|2,0,0]=4 4970 B12R1.32 O=C(CCO)NC1CCOCC1 240690a_100000741149_100011216618 [0,2,0,0,0,0|2,0,0]=4 4971 B12R1.32 O=C(CCO)NC1CCSCC1 240690a_100000748639_100011216618 [0,2,0,0,0,0|2,0,0]=4 4972 B12R1.32 O=C(CN1CCCOC1)NCO 2230a_100000131196_100000185155 [0,2,0,0,0,0|2,0,0]=4 4973 B12R1.32 O=C(CN1CCCOC1)NCO 269982a_100000131196_100000185155 [0,2,0,0,0,0|2,0,0]=4 4974 B12R1.32 O=C(CN1CCCOC1)NCO 34a_100000131196_100000185155 [0,2,0,0,0,0|2,0,0]=4 4975 B12R1.32 O=C(CN1CCOCC1)NCO 2230a_100015191051_100000185155 [0,2,0,0,0,0|2,0,0]=4 4976 B12R1.32 O=C(CN1CCOCC1)NCO 269982a_100015191051_100000185155 [0,2,0,0,0,0|2,0,0]=4 4977 B12R1.32 O=C(CN1CCOCC1)NCO 34a_100015191051_100000185155 [0,2,0,0,0,0|2,0,0]=4 4978 B12R1.32 O=C(CN1CCSCC1)NCO 2230a_100000737611_100000185155 [0,2,0,0,0,0|2,0,0]=4 4979 B12R1.32 O=C(CN1CCSCC1)NCO 269982a_100000737611_100000185155 [0,2,0,0,0,0|2,0,0]=4 4980 B12R1.32 [13CH3]NCC(=O)NC1CCCCC1 2230a_100015207117_200025704644 [0,2,0,0,0,0|2,0,0]=4 4981 B12R1.32 [13CH3]OC[C@@H](N)CC1CCCCC1 34a_100015184289_200025704644 [0,2,0,0,0,0|1,0,1]=4 4982 B12R1.32 [13CH3]SCC(=O)NC1CCCCC1 62a_100000183541_200025704644 [0,2,0,0,0,0|1,1,0]=4 4983 B12R1.32 [13CH3]SCC(=O)NC1CCCCC1 62a_200025704644_100000183541 [0,2,0,0,0,0|1,1,0]=4 4984 B12R1.32 [13CH3]SCC(=O)OC1CCCCC1 62a_100000041653_200025704644 [0,2,0,0,0,0|1,1,0]=4 4985 B12R1.32 [13CH3]SCC(=O)OC1CCCCC1 62a_200025704644_100000041653 [0,2,0,0,0,0|1,1,0]=4 4986 B12R1.50 C#CC(=O)CC1CCCN(C1)C 1458a_100000211873_100015183302 [0,2,0,0,0,0|2,0,0]=4 4987 B12R1.50 C=CC(=O)CC1CCCN(C1)C 1458a_100000185746_100015183302 [0,2,0,0,0,0|2,0,0]=4 4988 B12R1.50 C=CC(=O)NC1CCCC(C1)C 1626a_100011194320_100000185746 [0,2,0,0,0,0|2,0,0]=4 4989 B12R1.50 C=CC(=O)NC1CCCC(C1)C 240690a_100011194320_200121576911 [0,2,0,0,0,0|2,0,0]=4 4990 B12R1.50 C=CC(=O)NC1CCCC(C1)O 1626a_100015190357_100000185746 [0,2,0,0,0,0|2,0,0]=4 4991 B12R1.50 C=CC(=O)NC1CCCC(C1)O 240690a_100015190357_200121576911 [0,2,0,0,0,0|2,0,0]=4 4992 B12R1.50 CC1CCCC(C1)CC(=O)CF 1458a_100000748788_100015361967 [0,2,0,0,0,0|1,0,0]=3 4993 B12R1.50 CC1CCCC(C1)NC(=O)CO 240690a_100011194320_100000210174 [0,2,0,0,0,0|1,0,0]=3 4994 B12R1.50 CC1CCCC(C1)NC(=O)CO 527a_100011194320_100000210174 [0,2,0,0,0,0|1,0,0]=3 4995 B12R1.50 CCC(=O)CC1CCCC(C1)C 1458a_100000748788_100000210202 [0,2,0,0,0,0|1,0,0]=3 4996 B12R1.50 CCC(=O)CC1CCCN(C1)C 1458a_100000210414_100015183302 [0,2,0,0,0,0|2,0,0]=4 4997 B12R1.50 CCC(=O)CN1CCCC(C1)F 269982a_100000697950_100000747405 [0,2,0,0,0,0|2,0,0]=4 4998 B12R1.50 CCC(=O)CN1CCCC(C1)O 269982a_100000211013_100000747405 [0,2,0,0,0,0|2,0,0]=4 4999 B12R1.50 CCC(=O)CN1CCC[C@@H](C1)C 269982a_100000717927_100000747405 [0,2,0,0,0,0|2,0,0]=4 5000 B12R1.50 CCC(=O)NC1CCCC(C1)C 11a_100011194320_100000210414 [0,2,0,0,0,0|2,0,0]=4 5001 B12R1.50 CCC(=O)NC1CCCC(C1)C 1626a_100011194320_100000210414 [0,2,0,0,0,0|2,0,0]=4 5002 B12R1.50 CCC(=O)NC1CCCC(C1)C 240690a_100011194320_100000210414 [0,2,0,0,0,0|2,0,0]=4 5003 B12R1.50 CCC(=O)NC1CCCC(C1)C 527a_100011194320_100000210414 [0,2,0,0,0,0|2,0,0]=4 5004 B12R1.50 CCC(=O)NC1CCCC(C1)O 1626a_100015190357_100000210414 [0,2,0,0,0,0|2,0,0]=4 5005 B12R1.50 CCC(=O)NC1CCCC(C1)O 240690a_100015190357_100000210414 [0,2,0,0,0,0|2,0,0]=4 5006 B12R1.50 CN1CCCC(C1)CC(=O)CO 1458a_100000210174_100015183302 [0,2,0,0,0,0|1,0,0]=3 5007 B12R1.50 CN1CCC[C@@H](C1)NC(=O)CO 240690a_100016992120_100000210174 [0,2,0,0,0,0|2,0,0]=4 5008 B12R1.50 CN1CCC[C@@H](C1)NC(=O)CO 527a_100016992120_100000210174 [0,2,0,0,0,0|2,0,0]=4 5009 B12R1.50 CNC(=O)CC1CCCC(C1)C 11a_106832991635_100000748788 [0,2,0,0,0,0|1,0,0]=3 5010 B12R1.50 CNC(=O)CC1CCCC(C1)C 1626a_100102657272_100000748788 [0,2,0,0,0,0|1,0,0]=3 5011 B12R1.50 CNC(=O)CC1CCCC(C1)C 240690a_100102657272_100000748788 [0,2,0,0,0,0|1,0,0]=3 5012 B12R1.50 CNC(=O)CC1CCCC(C1)C 527a_100102657272_100000748788 [0,2,0,0,0,0|1,0,0]=3 5013 B12R1.50 CNC(=O)CN1CCCC(C1)F 2230a_100000697950_100000183359 [0,2,0,0,0,0|2,0,0]=4 5014 B12R1.50 CNC(=O)CN1CCCC(C1)F 269982a_100000697950_100000183359 [0,2,0,0,0,0|2,0,0]=4 5015 B12R1.50 CNC(=O)CN1CCCC(C1)F 34a_100000697950_100000183359 [0,2,0,0,0,0|2,0,0]=4 5016 B12R1.50 CNC(=O)CN1CCCC(C1)O 2230a_100000211013_100000183359 [0,2,0,0,0,0|2,0,0]=4 5017 B12R1.50 CNC(=O)CN1CCCC(C1)O 269982a_100000211013_100000183359 [0,2,0,0,0,0|2,0,0]=4 5018 B12R1.50 CNC(=O)CN1CCC[C@@H](C1)C 2230a_100000717927_100000183359 [0,2,0,0,0,0|2,0,0]=4 5019 B12R1.50 CNC(=O)CN1CCC[C@@H](C1)C 269982a_100000717927_100000183359 [0,2,0,0,0,0|2,0,0]=4 5020 B12R1.50 CNC(=O)CN1CCC[C@@H](C1)C 34a_100000717927_100000183359 [0,2,0,0,0,0|2,0,0]=4 5021 B12R1.50 CNC(=O)NC1CCCC(C1)C 2708a_100011194320_106832991635 [0,2,0,0,0,0|2,0,0]=4 5022 B12R1.50 CNC(=O)NC1CCCC(C1)C 2708a_100102657272_100011194320 [0,2,0,0,0,0|2,0,0]=4 5023 B12R1.50 CNC(=O)NC1CCCC(C1)C 273464a_100011194320_100102657272 [0,2,0,0,0,0|2,0,0]=4 5024 B12R1.50 CNC(=O)NC1CCCC(C1)C 273464a_100102657272_100011194320 [0,2,0,0,0,0|2,0,0]=4 5025 B12R1.50 CNC(=O)NC1CCCC(C1)C 512a_100011194320_100102657272 [0,2,0,0,0,0|2,0,0]=4 5026 B12R1.50 CNC(=O)NC1CCCC(C1)C 512a_106832991638_100011194320 [0,2,0,0,0,0|2,0,0]=4 5027 B12R1.50 CNC(=O)NC1CCCC(C1)O 2708a_100102657272_100015190357 [0,2,0,0,0,0|2,0,0]=4 5028 B12R1.50 CNC(=O)NC1CCCC(C1)O 273464a_100015190357_100102657272 [0,2,0,0,0,0|2,0,0]=4 5029 B12R1.50 CNC(=O)NC1CCCC(C1)O 273464a_100102657272_100015190357 [0,2,0,0,0,0|2,0,0]=4 5030 B12R1.50 CNC(=O)NC1CCCC(C1)O 512a_100015190357_100102657272 [0,2,0,0,0,0|2,0,0]=4 5031 B12R1.50 CNC(=O)NC1CCCC(C1)O 512a_106832991638_100015190357 [0,2,0,0,0,0|2,0,0]=4 5032 B12R1.50 COC(=O)CC1CCCN(C1)C 2230a_100016989293_200000210301 [0,2,0,0,0,0|1,0,0]=3 5033 B12R1.50 COC(=O)CC1CCCN(C1)C 269982a_100016989293_200000210301 [0,2,0,0,0,0|1,0,0]=3 5034 B12R1.50 COC(=O)CC1CCCN(C1)[13CH3] 2230a_100016989293_200025704644 [0,2,0,0,0,0|1,0,0]=3 5035 B12R1.50 COC(=O)CC1CCCN(C1)[13CH3] 269982a_100016989293_200025704644 [0,2,0,0,0,0|1,0,0]=3 5036 B12R1.50 COC(=O)CC1CN(CCO1)C 2230a_100000684468_200000210301 [0,2,0,0,0,0|2,0,0]=4 5037 B12R1.50 COC(=O)CC1CN(CCO1)C 269982a_100000684468_200000210301 [0,2,0,0,0,0|2,0,0]=4 5038 B12R1.50 COC(=O)CC1CN(CCO1)[13CH3] 2230a_100000684468_200025704644 [0,2,0,0,0,0|2,0,0]=4 5039 B12R1.50 COC(=O)CC1CN(CCO1)[13CH3] 269982a_100000684468_200025704644 [0,2,0,0,0,0|2,0,0]=4 5040 B12R1.50 COC(=O)CN1CCCC(C1)F 2230a_100000697950_100000747449 [0,2,0,0,0,0|1,0,0]=3 5041 B12R1.50 COC(=O)CN1CCCC(C1)F 269982a_100000697950_100000747449 [0,2,0,0,0,0|1,0,0]=3 5042 B12R1.50 COC(=O)CN1CCCC(C1)F 34a_100000697950_100000747449 [0,2,0,0,0,0|1,0,0]=3 5043 B12R1.50 COC(=O)CN1CCCC(C1)O 2230a_100000211013_100000747449 [0,2,0,0,0,0|1,0,0]=3 5044 B12R1.50 COC(=O)CN1CCCC(C1)O 269982a_100000211013_100000747449 [0,2,0,0,0,0|1,0,0]=3 5045 B12R1.50 COC(=O)CN1CCC[C@@H](C1)C 2230a_100000717927_100000747449 [0,2,0,0,0,0|1,0,0]=3 5046 B12R1.50 COC(=O)CN1CCC[C@@H](C1)C 269982a_100000717927_100000747449 [0,2,0,0,0,0|1,0,0]=3 5047 B12R1.50 COC(=O)CN1CCC[C@@H](C1)C 34a_100000717927_100000747449 [0,2,0,0,0,0|1,0,0]=3 5048 B12R1.50 COC(=O)CN1CCOC(C1)C 2230a_100000729577_100000747449 [0,2,0,0,0,0|2,0,0]=4 5049 B12R1.50 COC(=O)CN1CCOC(C1)C 269982a_100000729577_100000747449 [0,2,0,0,0,0|2,0,0]=4 5050 B12R1.50 COC(=O)CN1CCOC(C1)C 34a_100000729577_100000747449 [0,2,0,0,0,0|2,0,0]=4 5051 B12R1.50 COC(=O)CN1CCOC(C1)O 2230a_100000688207_100000747449 [0,2,0,0,0,0|2,0,0]=4 5052 B12R1.50 COC(=O)CN1CCOC(C1)O 269982a_100000688207_100000747449 [0,2,0,0,0,0|2,0,0]=4 5053 B12R1.50 O=C(CO)NC1CCCC(C1)O 240690a_100015190357_100000210174 [0,2,0,0,0,0|1,0,0]=3 5054 B12R1.118 CN[C@H](CO)CC1CCCCC1 2230a_100015184289_200000210301 [0,2,0,0,0,0|1,0,1]=4 5055 B12R1.118 CN[C@H](CO)CC1CCCCC1 34a_100015184289_200000210301 [0,2,0,0,0,0|1,0,1]=4 5056 B12R1.118 [13CH3]N[C@H](CO)CC1CCCCC1 2230a_100015184289_200025704644 [0,2,0,0,0,0|1,0,1]=4 5057 B12R1.118 [13CH3]N[C@H](CO)CC1CCCCC1 34a_100015184289_200025704644 [0,2,0,0,0,0|1,0,1]=4 5058 B12R1.371 C#CC(=O)CC1CCCCN1C 1458a_100000211873_100015185383 [0,2,0,0,0,0|2,0,0]=4 5059 B12R1.371 C=CC(=O)CC1CCCCN1C 1458a_100000185746_100015185383 [0,2,0,0,0,0|2,0,0]=4 5060 B12R1.371 C=CC(=O)NC1CCCCC1C 1626a_100000211402_100000185746 [0,2,0,0,0,0|2,0,0]=4 5061 B12R1.371 C=CC(=O)NC1CCCCC1C 240690a_100000211402_200121576911 [0,2,0,0,0,0|2,0,0]=4 5062 B12R1.371 C=CC(=O)N[C@@H]1CCCC[C@@H]1O 240690a_100015191688_200121576911 [0,2,0,0,0,0|2,0,0]=4 5063 B12R1.371 C=CC(=O)N[C@@H]1CCCC[C@H]1F 1626a_100015195156_100000185746 [0,2,0,0,0,0|2,0,0]=4 5064 B12R1.371 C=CC(=O)N[C@@H]1CCCC[C@H]1F 240690a_100015195156_200121576911 [0,2,0,0,0,0|2,0,0]=4 5065 B12R1.371 CC1CCCCC1NC(=O)CO 240690a_100000211402_100000210174 [0,2,0,0,0,0|1,0,0]=3 5066 B12R1.371 CC1CCCCC1NC(=O)CO 527a_100000211402_100000210174 [0,2,0,0,0,0|1,0,0]=3 5067 B12R1.371 CCC(=O)CC1CCCCN1C 1458a_100000210414_100015185383 [0,2,0,0,0,0|2,0,0]=4 5068 B12R1.371 CCC(=O)CN1CCCCC1C 269982a_100000211376_100000747405 [0,2,0,0,0,0|2,0,0]=4 5069 B12R1.371 CCC(=O)NC1CCCCC1C 11a_100000211402_100000210414 [0,2,0,0,0,0|2,0,0]=4 5070 B12R1.371 CCC(=O)NC1CCCCC1C 1626a_100000211402_100000210414 [0,2,0,0,0,0|2,0,0]=4 5071 B12R1.371 CCC(=O)NC1CCCCC1C 240690a_100000211402_100000210414 [0,2,0,0,0,0|2,0,0]=4 5072 B12R1.371 CCC(=O)NC1CCCCC1C 527a_100000211402_100000210414 [0,2,0,0,0,0|2,0,0]=4 5073 B12R1.371 CCC(=O)N[C@@H]1CCCC[C@@H]1O 240690a_100015191688_100000210414 [0,2,0,0,0,0|2,0,0]=4 5074 B12R1.371 CCC(=O)N[C@@H]1CCCC[C@@H]1O 527a_100015191688_100000210414 [0,2,0,0,0,0|2,0,0]=4 5075 B12R1.371 CCC(=O)N[C@@H]1CCCC[C@H]1F 11a_100015195156_100000210414 [0,2,0,0,0,0|2,0,0]=4 5076 B12R1.371 CCC(=O)N[C@@H]1CCCC[C@H]1F 1626a_100015195156_100000210414 [0,2,0,0,0,0|2,0,0]=4 5077 B12R1.371 CCC(=O)N[C@@H]1CCCC[C@H]1F 240690a_100015195156_100000210414 [0,2,0,0,0,0|2,0,0]=4 5078 B12R1.371 CCC(=O)N[C@@H]1CCCC[C@H]1F 527a_100015195156_100000210414 [0,2,0,0,0,0|2,0,0]=4 5079 B12R1.371 CN1CCCCC1CC(=O)CO 1458a_100000210174_100015185383 [0,2,0,0,0,0|1,0,0]=3 5080 B12R1.371 CNC(=O)CN1CCCCC1C 2230a_100000211376_100000183359 [0,2,0,0,0,0|2,0,0]=4 5081 B12R1.371 CNC(=O)CN1CCCCC1C 269982a_100000211376_100000183359 [0,2,0,0,0,0|2,0,0]=4 5082 B12R1.371 CNC(=O)CN1CCCCC1C 34a_100000211376_100000183359 [0,2,0,0,0,0|2,0,0]=4 5083 B12R1.371 CNC(=O)NC1CCCCC1C 2708a_100000211402_106832991635 [0,2,0,0,0,0|2,0,0]=4 5084 B12R1.371 CNC(=O)NC1CCCCC1C 2708a_100102657272_100000211402 [0,2,0,0,0,0|2,0,0]=4 5085 B12R1.371 CNC(=O)NC1CCCCC1C 273464a_100000211402_100102657272 [0,2,0,0,0,0|2,0,0]=4 5086 B12R1.371 CNC(=O)NC1CCCCC1C 273464a_100102657272_100000211402 [0,2,0,0,0,0|2,0,0]=4 5087 B12R1.371 CNC(=O)NC1CCCCC1C 512a_100000211402_100102657272 [0,2,0,0,0,0|2,0,0]=4 5088 B12R1.371 CNC(=O)NC1CCCCC1C 512a_106832991638_100000211402 [0,2,0,0,0,0|2,0,0]=4 5089 B12R1.371 CNC(=O)N[C@@H]1CCCC[C@@H]1O 2708a_100102657272_100015191688 [0,2,0,0,0,0|2,0,0]=4 5090 B12R1.371 CNC(=O)N[C@@H]1CCCC[C@@H]1O 273464a_100102657272_100015191688 [0,2,0,0,0,0|2,0,0]=4 5091 B12R1.371 CNC(=O)N[C@@H]1CCCC[C@H]1F 2708a_100015195156_106832991635 [0,2,0,0,0,0|2,0,0]=4 5092 B12R1.371 CNC(=O)N[C@@H]1CCCC[C@H]1F 2708a_100102657272_100015195156 [0,2,0,0,0,0|2,0,0]=4 5093 B12R1.371 CNC(=O)N[C@@H]1CCCC[C@H]1F 273464a_100015195156_100102657272 [0,2,0,0,0,0|2,0,0]=4 5094 B12R1.371 CNC(=O)N[C@@H]1CCCC[C@H]1F 273464a_100102657272_100015195156 [0,2,0,0,0,0|2,0,0]=4 5095 B12R1.371 CNC(=O)N[C@@H]1CCCC[C@H]1F 512a_100015195156_100102657272 [0,2,0,0,0,0|2,0,0]=4 5096 B12R1.371 CNC(=O)N[C@@H]1CCCC[C@H]1F 512a_106832991638_100015195156 [0,2,0,0,0,0|2,0,0]=4 5097 B12R1.371 COC(=O)CC1COCCN1C 2230a_100000731486_200000210301 [0,2,0,0,0,0|2,0,0]=4 5098 B12R1.371 COC(=O)CC1COCCN1C 34a_100000731486_200000210301 [0,2,0,0,0,0|2,0,0]=4 5099 B12R1.371 COC(=O)CC1COCCN1[13CH3] 2230a_100000731486_200025704644 [0,2,0,0,0,0|2,0,0]=4 5100 B12R1.371 COC(=O)CC1COCCN1[13CH3] 34a_100000731486_200025704644 [0,2,0,0,0,0|2,0,0]=4 5101 B12R1.371 COC(=O)CN1CCCCC1C 2230a_100000211376_100000747449 [0,2,0,0,0,0|1,0,0]=3 5102 B12R1.371 COC(=O)CN1CCCCC1C 269982a_100000211376_100000747449 [0,2,0,0,0,0|1,0,0]=3 5103 B12R1.371 COC(=O)CN1CCCCC1C 34a_100000211376_100000747449 [0,2,0,0,0,0|1,0,0]=3 5104 B12R1.371 COC(=O)CN1CCOC[C@@H]1C 2230a_100009815349_100000747449 [0,2,0,0,0,0|2,0,0]=4 5105 B12R1.371 COC(=O)CN1CCOC[C@@H]1C 269982a_100009815349_100000747449 [0,2,0,0,0,0|2,0,0]=4 5106 B12R1.371 COC(=O)CN1CCOC[C@@H]1C 34a_100009815349_100000747449 [0,2,0,0,0,0|2,0,0]=4 5107 B12R1.371 O=C(CO)N[C@@H]1CCCC[C@@H]1O 240690a_100015191688_100000210174 [0,2,0,0,0,0|1,0,0]=3 5108 B12R1.371 O=C(CO)N[C@@H]1CCCC[C@@H]1O 527a_100015191688_100000210174 [0,2,0,0,0,0|1,0,0]=3 5109 B12R1.371 O=C(CO)N[C@@H]1CCCC[C@H]1F 240690a_100015195156_100000210174 [0,2,0,0,0,0|1,0,0]=3 5110 B12R1.371 O=C(CO)N[C@@H]1CCCC[C@H]1F 527a_100015195156_100000210174 [0,2,0,0,0,0|1,0,0]=3 5111 B12R1.371 O=C(CO)N[C@@H]1CCOC[C@@H]1O 240690a_100016994285_100000210174 [0,2,0,0,0,0|2,0,0]=4 5112 B12R1.371 O=C(CO)N[C@@H]1CCOC[C@@H]1O 527a_100016994285_100000210174 [0,2,0,0,0,0|2,0,0]=4 5113 B12R1.371 O=C(CO)N[C@H]1CCOC[C@@H]1F 240690a_100016994078_100000210174 [0,2,0,0,0,0|2,0,0]=4 5114 B12R1.371 O=C(CO)N[C@H]1CCOC[C@@H]1F 527a_100016994078_100000210174 [0,2,0,0,0,0|2,0,0]=4 5115 B12R1.371 O=C(CO)N[C@H]1COCC[C@@H]1O 240690a_100015739063_100000210174 [0,2,0,0,0,0|2,0,0]=4 5116 B12R1.3524 C=CC(=O)NC1(CCCCC1)C 1626a_100000741114_100000185746 [0,2,0,0,0,0|2,0,0]=4 5117 B12R1.3524 C=CC(=O)NC1(CCCCC1)C 240690a_100000741114_200121576911 [0,2,0,0,0,0|2,0,0]=4 5118 B12R1.3524 CC1(CCCCC1)NC(=O)CO 240690a_100000741114_100000210174 [0,2,0,0,0,0|1,0,0]=3 5119 B12R1.3524 CC1(CCCCC1)NC(=O)CO 527a_100000741114_100000210174 [0,2,0,0,0,0|1,0,0]=3 5120 B12R1.3524 CC1(CCOCC1)NC(=O)CO 240690a_100000692449_100000210174 [0,2,0,0,0,0|2,0,0]=4 5121 B12R1.3524 CC1(CCOCC1)NC(=O)CO 527a_100000692449_100000210174 [0,2,0,0,0,0|2,0,0]=4 5122 B12R1.3524 CCC(=O)CC1(CCCCC1)O 1458a_100000755886_100000210202 [0,2,0,0,0,0|1,0,0]=3 5123 B12R1.3524 CCC(=O)NC1(CCCCC1)C 11a_100000741114_100000210414 [0,2,0,0,0,0|2,0,0]=4 5124 B12R1.3524 CCC(=O)NC1(CCCCC1)C 1626a_100000741114_100000210414 [0,2,0,0,0,0|2,0,0]=4 5125 B12R1.3524 CCC(=O)NC1(CCCCC1)C 240690a_100000741114_100000210414 [0,2,0,0,0,0|2,0,0]=4 5126 B12R1.3524 CCC(=O)NC1(CCCCC1)C 527a_100000741114_100000210414 [0,2,0,0,0,0|2,0,0]=4 5127 B12R1.3524 CNC(=O)CC1(CCCCC1)O 240690a_100102657272_100000755886 [0,2,0,0,0,0|1,0,0]=3 5128 B12R1.3524 CNC(=O)CC1(CCCCC1)O 527a_100102657272_100000755886 [0,2,0,0,0,0|1,0,0]=3 5129 B12R1.3524 CNC(=O)NC1(CCCCC1)C 2708a_100102657272_100000741114 [0,2,0,0,0,0|2,0,0]=4 5130 B12R1.3524 CNC(=O)NC1(CCCCC1)C 273464a_100000741114_100102657272 [0,2,0,0,0,0|2,0,0]=4 5131 B12R1.3524 CNC(=O)NC1(CCCCC1)C 273464a_100102657272_100000741114 [0,2,0,0,0,0|2,0,0]=4 5132 B12R1.3524 CNC(=O)NC1(CCCCC1)C 512a_100000741114_100102657272 [0,2,0,0,0,0|2,0,0]=4 5133 B12R1.3524 O=C(CF)CC1(CCCCC1)O 1458a_100000755886_100015361967 [0,2,0,0,0,0|1,0,0]=3 5134 B12R1.75 C#CC1CCCCN1CC(=O)N 2230a_200020621307_100000747473 [0,2,0,0,0,0|2,0,0]=4 5135 B12R1.75 C#CC1CCCCN1CC(=O)N 269982a_200020621307_100000187820 [0,2,0,0,0,0|2,0,0]=4 5136 B12R1.75 C#CC1CCCCN1CC(=O)N 34a_200020621307_100000187820 [0,2,0,0,0,0|2,0,0]=4 5137 B12R1.75 C#CC1CCCCN1CC(=O)[O-] 269982a_200020621307_100020667443 [0,2,0,0,0,0|1,0,1]=4 5138 B12R1.75 C#CC1CCCCN1CC(=O)[O-] 34a_200020621307_100020667443 [0,2,0,0,0,0|1,0,1]=4 5139 B12R1.75 CCC1CCCCN1CC(=O)N 2230a_100000210034_100000747473 [0,2,0,0,0,0|2,0,0]=4 5140 B12R1.75 CCC1CCCCN1CC(=O)N 269982a_100000210034_100000187820 [0,2,0,0,0,0|2,0,0]=4 5141 B12R1.75 CCC1CCCCN1CC(=O)N 34a_100000210034_100000187820 [0,2,0,0,0,0|2,0,0]=4 5142 B12R1.75 CCC1CCCCN1CC(=O)[O-] 269982a_100000210034_100020667443 [0,2,0,0,0,0|1,0,1]=4 5143 B12R1.75 CCC1CCCCN1CC(=O)[O-] 34a_100000210034_100020667443 [0,2,0,0,0,0|1,0,1]=4 5144 B12R1.75 CCN1CCCCC1CC(=O)N 2230a_100015184752_100000210202 [0,2,0,0,0,0|2,0,0]=4 5145 B12R1.75 CCN1CCCCC1CC(=O)N 269982a_100015184752_100000204670 [0,2,0,0,0,0|2,0,0]=4 5146 B12R1.75 CCN1CCCCC1CC(=O)N 34a_100015184752_100000210202 [0,2,0,0,0,0|2,0,0]=4 5147 B12R1.75 COC1CCCCC1NC(=O)C 11a_100011208099_100015343762 [0,2,0,0,0,0|2,0,0]=4 5148 B12R1.75 COC1CCCCC1NC(=O)C 1626a_100011208099_100015343762 [0,2,0,0,0,0|2,0,0]=4 5149 B12R1.75 COC1CCCCC1NC(=O)C 240690a_100011208099_100015343762 [0,2,0,0,0,0|2,0,0]=4 5150 B12R1.75 COC1CCCCC1NC(=O)C 527a_100011208099_100103153847 [0,2,0,0,0,0|2,0,0]=4 5151 B12R1.75 N#CC1CCCCN1CC(=O)N 34a_100016989756_100000187820 [0,2,0,0,0,0|2,0,0]=4 5152 B12R1.75 N#CC1CCCCN1CC(=O)[O-] 34a_100016989756_100020667443 [0,2,0,0,0,0|1,0,1]=4 5153 B12R1.75 NC(=O)CC1CCCCN1CF 269982a_100015184752_100015361967 [0,2,0,0,0,0|2,0,0]=4 5154 B12R1.75 NC(=O)CC1CCCCN1CF 34a_100015184752_100015361967 [0,2,0,0,0,0|2,0,0]=4 5155 B12R1.75 NC(=O)CN1CCCCC1CO 2230a_100000210821_100000747473 [0,2,0,0,0,0|2,0,0]=4 5156 B12R1.75 NC(=O)CN1CCCCC1CO 269982a_100000210821_100000187820 [0,2,0,0,0,0|2,0,0]=4 5157 B12R1.75 NC(=O)CN1CCCCC1CO 34a_100000210821_100000187820 [0,2,0,0,0,0|2,0,0]=4 5158 B12R1.75 O=C([O-])CN1CCCCC1CO 269982a_100000210821_100020667443 [0,2,0,0,0,0|1,0,1]=4 5159 B12R1.75 O=C([O-])CN1CCCCC1CO 34a_100000210821_100020667443 [0,2,0,0,0,0|1,0,1]=4 5160 B12R1.224 CC(=O)NC1CCCC(C1C)C 11a_100000211273_100015343762 [0,2,0,0,0,0|2,0,0]=4 5161 B12R1.224 CC(=O)NC1CCCC(C1C)C 1626a_100000211273_100015343762 [0,2,0,0,0,0|2,0,0]=4 5162 B12R1.224 CC(=O)NC1CCCC(C1C)C 240690a_100000211273_100015343762 [0,2,0,0,0,0|2,0,0]=4 5163 B12R1.224 CC(=O)NC1CCCC(C1C)C 527a_100000211273_100103153847 [0,2,0,0,0,0|2,0,0]=4 5164 B12R1.391 CC(=O)NC1CCCCC1(F)F 11a_100000686509_100015343762 [0,2,0,0,0,0|2,0,0]=4 5165 B12R1.391 CC(=O)NC1CCCCC1(F)F 1626a_100000686509_100015343762 [0,2,0,0,0,0|2,0,0]=4 5166 B12R1.391 CC(=O)NC1CCCCC1(F)F 240690a_100000686509_100015343762 [0,2,0,0,0,0|2,0,0]=4 5167 B12R1.391 CC(=O)NC1CCCCC1(F)F 527a_100000686509_100103153847 [0,2,0,0,0,0|2,0,0]=4 5168 B12R1.1009 CC1CCCC(N1CC(=O)N)C 2230a_100000210447_100000747473 [0,2,0,0,0,0|2,0,0]=4 5169 B12R1.1009 CC1CCCC(N1CC(=O)N)C 269982a_100000210447_100000187820 [0,2,0,0,0,0|2,0,0]=4 5170 B12R1.1009 CC1CCCC(N1CC(=O)N)C 34a_100000210447_100000187820 [0,2,0,0,0,0|2,0,0]=4 5171 B12R1.1009 CC1CCCC(N1CC(=O)[O-])C 269982a_100000210447_100020667443 [0,2,0,0,0,0|1,0,1]=4 5172 B12R1.1009 CC1CCCC(N1CC(=O)[O-])C 34a_100000210447_100020667443 [0,2,0,0,0,0|1,0,1]=4 5173 B12R1.101 CC1CC(CN(C1)CC(=O)N)C 2230a_100000210448_100000747473 [0,2,0,0,0,0|2,0,0]=4 5174 B12R1.101 CC1CC(CN(C1)CC(=O)N)C 269982a_100000210448_100000187820 [0,2,0,0,0,0|2,0,0]=4 5175 B12R1.101 CC1CC(CN(C1)CC(=O)N)C 34a_100000210448_100000187820 [0,2,0,0,0,0|2,0,0]=4 5176 B12R1.101 CC1CC(CN(C1)CC(=O)[O-])C 269982a_100000210448_100020667443 [0,2,0,0,0,0|1,0,1]=4 5177 B12R1.101 CC1CC(CN(C1)CC(=O)[O-])C 34a_100000210448_100020667443 [0,2,0,0,0,0|1,0,1]=4 5178 B12R1.438 C#CC1CCCN(C1)CC(=O)N 2230a_100015191679_100000747473 [0,2,0,0,0,0|2,0,0]=4 5179 B12R1.438 C#CC1CCCN(C1)CC(=O)N 269982a_100015191679_100000187820 [0,2,0,0,0,0|2,0,0]=4 5180 B12R1.438 C#CC1CCCN(C1)CC(=O)N 34a_100015191679_100000187820 [0,2,0,0,0,0|2,0,0]=4 5181 B12R1.438 C#CC1CCCN(C1)CC(=O)[O-] 269982a_100015191679_100020667443 [0,2,0,0,0,0|1,0,1]=4 5182 B12R1.438 C#CC1CCCN(C1)CC(=O)[O-] 34a_100015191679_100020667443 [0,2,0,0,0,0|1,0,1]=4 5183 B12R1.438 CCN1CCCC(C1)CC(=O)O 269956a_100015207179_100000210202 [0,2,0,0,0,0|1,0,0]=3 5184 B12R1.438 CCN1CCOC(C1)CC(=O)O 269956a_100015183369_100000210202 [0,2,0,0,0,0|2,0,0]=4 5185 B12R1.438 COC1CCCN(C1)CC(=O)N 2230a_100000695604_100000747473 [0,2,0,0,0,0|2,0,0]=4 5186 B12R1.438 COC1CCCN(C1)CC(=O)N 269982a_100000695604_100000187820 [0,2,0,0,0,0|2,0,0]=4 5187 B12R1.438 COC1CCCN(C1)CC(=O)N 34a_100000695604_100000187820 [0,2,0,0,0,0|2,0,0]=4 5188 B12R1.438 COC1CCCN(C1)CC(=O)[O-] 269982a_100000695604_100020667443 [0,2,0,0,0,0|1,0,1]=4 5189 B12R1.438 COC1CCCN(C1)CC(=O)[O-] 34a_100000695604_100020667443 [0,2,0,0,0,0|1,0,1]=4 5190 B12R1.438 N#CC1CCCN(C1)CC(=O)N 2230a_100016989302_100000747473 [0,2,0,0,0,0|2,0,0]=4 5191 B12R1.438 N#CC1CCCN(C1)CC(=O)N 269982a_206835378768_100000187820 [0,2,0,0,0,0|2,0,0]=4 5192 B12R1.438 N#CC1CCCN(C1)CC(=O)[O-] 269982a_206835378768_100020667443 [0,2,0,0,0,0|1,0,1]=4 5193 B12R1.438 NC(=O)CN1CCCC(C1)CF 2230a_100016992999_100000747473 [0,2,0,0,0,0|2,0,0]=4 5194 B12R1.438 NC(=O)CN1CCCC(C1)CF 269982a_100016992999_100000187820 [0,2,0,0,0,0|2,0,0]=4 5195 B12R1.438 NC(=O)CN1CCCC(C1)CF 34a_100016992999_100000187820 [0,2,0,0,0,0|2,0,0]=4 5196 B12R1.438 NC(=O)CN1CCCC(C1)CO 2230a_100000211344_100000747473 [0,2,0,0,0,0|2,0,0]=4 5197 B12R1.438 NC(=O)CN1CCCC(C1)CO 269982a_100000211344_100000187820 [0,2,0,0,0,0|2,0,0]=4 5198 B12R1.438 NC(=O)CN1CCCC(C1)CO 34a_100000211344_100000187820 [0,2,0,0,0,0|2,0,0]=4 5199 B12R1.438 O=C(O)CC1CCCN(C1)CF 269956a_100015207179_100015361967 [0,2,0,0,0,0|1,0,0]=3 5200 B12R1.438 O=C(O)CC1CN(CCO1)CF 269956a_100015183369_100015361967 [0,2,0,0,0,0|2,0,0]=4 5201 B12R1.438 O=C([O-])CN1CCCC(C1)CF 269982a_100016992999_100020667443 [0,2,0,0,0,0|1,0,1]=4 5202 B12R1.438 O=C([O-])CN1CCCC(C1)CF 34a_100016992999_100020667443 [0,2,0,0,0,0|1,0,1]=4 5203 B12R1.438 O=C([O-])CN1CCCC(C1)CO 269982a_100000211344_100020667443 [0,2,0,0,0,0|1,0,1]=4 5204 B12R1.438 O=C([O-])CN1CCCC(C1)CO 34a_100000211344_100020667443 [0,2,0,0,0,0|1,0,1]=4 5205 B12R1.1821 CC1(CCCN(C1)CC(=O)N)C 2230a_100000716857_100000747473 [0,2,0,0,0,0|2,0,0]=4 5206 B12R1.1821 CC1(CCCN(C1)CC(=O)N)C 269982a_100000716857_100000187820 [0,2,0,0,0,0|2,0,0]=4 5207 B12R1.1821 CC1(CCCN(C1)CC(=O)N)C 34a_100000716857_100000187820 [0,2,0,0,0,0|2,0,0]=4 5208 B12R1.1821 CC1(CCCN(C1)CC(=O)N)O 2230a_100000695535_100000747473 [0,2,0,0,0,0|2,0,0]=4 5209 B12R1.1821 CC1(CCCN(C1)CC(=O)N)O 269982a_100000695535_100000187820 [0,2,0,0,0,0|2,0,0]=4 5210 B12R1.1821 CC1(CCCN(C1)CC(=O)[O-])C 269982a_100000716857_100020667443 [0,2,0,0,0,0|1,0,1]=4 5211 B12R1.1821 CC1(CCCN(C1)CC(=O)[O-])C 34a_100000716857_100020667443 [0,2,0,0,0,0|1,0,1]=4 5212 B12R1.1821 CC1(CCCN(C1)CC(=O)[O-])O 269982a_100000695535_100020667443 [0,2,0,0,0,0|1,0,1]=4 5213 B12R1.1821 NC(=O)CN1CCCC(C1)(F)F 2230a_100000732682_100000747473 [0,2,0,0,0,0|2,0,0]=4 5214 B12R1.1821 NC(=O)CN1CCCC(C1)(F)F 269982a_100000732682_100000187820 [0,2,0,0,0,0|2,0,0]=4 5215 B12R1.1821 NC(=O)CN1CCCC(C1)(F)F 34a_100000732682_100000187820 [0,2,0,0,0,0|2,0,0]=4 5216 B12R1.1821 O=C([O-])CN1CCCC(C1)(F)F 269982a_100000732682_100020667443 [0,2,0,0,0,0|1,0,1]=4 5217 B12R1.1821 O=C([O-])CN1CCCC(C1)(F)F 34a_100000732682_100020667443 [0,2,0,0,0,0|1,0,1]=4 5218 B12R1.3862 C#CC1(CCCCC1)NC(=O)C 11a_100132314160_100015343762 [0,2,0,0,0,0|2,0,0]=4 5219 B12R1.3862 C#CC1(CCCCC1)NC(=O)C 1626a_100132314160_100015343762 [0,2,0,0,0,0|2,0,0]=4 5220 B12R1.3862 C#CC1(CCCCC1)NC(=O)C 240690a_100132314160_100015343762 [0,2,0,0,0,0|2,0,0]=4 5221 B12R1.3862 CC(=O)CC1(CCCCC1)C#N 1458a_100000070787_100011219015 [0,2,0,0,0,0|1,0,0]=3 5222 B12R1.3862 CC(=O)NC1(CCCCC1)C#N 11a_100000184641_100015343762 [0,2,0,0,0,0|2,0,0]=4 5223 B12R1.3862 CC(=O)NC1(CCCCC1)C#N 1626a_100000184641_100015343762 [0,2,0,0,0,0|2,0,0]=4 5224 B12R1.3862 CC(=O)NC1(CCCCC1)C#N 240690a_100000184641_100015343762 [0,2,0,0,0,0|2,0,0]=4 5225 B12R1.3862 CC(=O)NC1(CCCCC1)C#N 527a_100000184641_100103153847 [0,2,0,0,0,0|2,0,0]=4 5226 B12R1.3862 CC(=O)NC1(CCCCC1)CO 240690a_100000740034_100015343762 [0,2,0,0,0,0|2,0,0]=4 5227 B12R1.3862 CC(=O)NC1(CCCCC1)CO 527a_100000740034_100103153847 [0,2,0,0,0,0|2,0,0]=4 5228 B12R1.3862 CNC1(CCCCC1)CC(=O)O 269956a_100000723940_200000210301 [0,2,0,0,0,0|0,0,0]=2 5229 B12R1.3862 CNC1(CCOCC1)CC(=O)O 269956a_100000723900_200000210301 [0,2,0,0,0,0|1,0,0]=3 5230 B12R1.3862 [13CH3]NC1(CCCCC1)CC(=O)O 269956a_100000723940_200025704644 [0,2,0,0,0,0|0,0,0]=2 5231 B12R1.3862 [13CH3]NC1(CCOCC1)CC(=O)O 269956a_100000723900_200025704644 [0,2,0,0,0,0|1,0,0]=3 5232 B10R1.16 CCCOC1CCC(=O)C1 34a_100012614533_100000210303 [0,0,1,1,0,0|2,0,0]=4 5233 B10R1.16 CCCOC1COC(=O)O1 34a_100000210258_100000032252 [0,0,1,1,0,0|2,0,0]=4 5234 B10R1.16 CCCSC1COC(=O)O1 62a_100000210303_100000032252 [0,0,1,1,0,0|2,0,0]=4 5235 B10R1.16 CCNCC1CNC(=O)O1 2230a_100015525214_100000181169 [0,0,1,1,0,0|2,0,0]=4 5236 B10R1.16 CCNC[C@@H]1CCC(=O)N1 2230a_100015525214_100015189358 [0,0,1,1,0,0|2,0,0]=4 5237 B10R1.16 CCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000210202 [0,0,1,1,0,0|2,0,0]=4 5238 B10R1.16 CCNC[C@H]1CCC(=O)N1 34a_100015423886_100000210202 [0,0,1,1,0,0|2,0,0]=4 5239 B10R1.16 CCOCC1CCC(=O)N1 34a_100000737831_100000210202 [0,0,1,1,0,0|2,0,0]=4 5240 B10R1.16 CCOCC1CNC(=O)O1 34a_100011315639_100000210202 [0,0,1,1,0,0|2,0,0]=4 5241 B10R1.16 CCOCC1CNC(=O)O1 34a_100121572206_100000181169 [0,0,1,1,0,0|2,0,0]=4 5242 B10R1.16 CCOCC1COC(=O)O1 34a_100121572206_100000073702 [0,0,1,1,0,0|2,0,0]=4 5243 B10R1.16 CCSCC1CNC(=O)O1 62a_100000181169_100000210202 [0,0,1,1,0,0|2,0,0]=4 5244 B10R1.16 CCSCC1CNC(=O)O1 62a_100000210202_100000181169 [0,0,1,1,0,0|2,0,0]=4 5245 B10R1.16 CCSCC1COC(=O)O1 62a_100000073702_100000210202 [0,0,1,1,0,0|2,0,0]=4 5246 B10R1.16 CCSCC1COC(=O)O1 62a_100000210202_100000073702 [0,0,1,1,0,0|2,0,0]=4 5247 B10R1.16 CCSC[C@@H]1CCC(=O)N1 62a_100000210202_100015189358 [0,0,1,1,0,0|2,0,0]=4 5248 B10R1.16 CCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000210202 [0,0,1,1,0,0|2,0,0]=4 5249 B10R1.24 CCCCSC1CC(=O)C1 62a_100009894365_100000210210 [0,0,1,1,0,0|2,0,0]=4 5250 B10R1.24 CCCOCC1CC(=O)C1 34a_100000101936_100000210303 [0,0,1,1,0,0|2,0,0]=4 5251 B10R1.24 CCCSCC1CC(=O)C1 62a_100000210303_100009874392 [0,0,1,1,0,0|2,0,0]=4 5252 B10R1.24 CCCSCC1CC(=O)C1 62a_100009874392_100000210303 [0,0,1,1,0,0|2,0,0]=4 5253 B10R1.39 CCC1CCCN1C(=O)C 11a_100000754278_100015343762 [0,0,1,1,0,0|2,0,0]=4 5254 B10R1.39 CCC1CCCN1C(=O)C 1626a_100000754278_100015343762 [0,0,1,1,0,0|2,0,0]=4 5255 B10R1.39 CCC1CCCN1C(=O)C 240690a_100000754278_100015343762 [0,0,1,1,0,0|2,0,0]=4 5256 B10R1.39 CCC1CCCN1C(=O)C 527a_100000754278_100103153847 [0,0,1,1,0,0|2,0,0]=4 5257 B10R1.39 CCN1CCCC1C(=O)C 1458a_106256033941_200000210301 [0,0,1,1,0,0|2,0,0]=4 5258 B10R1.39 CCN1CCCC1C(=O)[13CH3] 1458a_106256033941_200025704644 [0,0,1,1,0,0|2,0,0]=4 5259 B10R1.39 CCN1CCC[C@H]1C(=O)N 2230a_100000003125_100000210202 [0,0,1,1,0,0|2,0,0]=4 5260 B10R1.39 CCN1CCC[C@H]1C(=O)O 269956a_100000743916_100000210202 [0,0,1,1,0,0|1,0,0]=3 5261 B10R1.39 CCN1CCSC1C(=O)O 269956a_100000035718_100000210202 [0,0,1,1,0,0|2,0,0]=4 5262 B10R1.39 CCN1CSC[C@H]1C(=O)O 269956a_100000743924_100000210202 [0,0,1,1,0,0|2,0,0]=4 5263 B10R1.39 O=C(O)[C@@H]1CCCN1CF 269956a_100000743916_100015361967 [0,0,1,1,0,0|2,0,0]=4 5264 B10R1.66 CC(=O)CCC1CCCC1 1458a_100000070787_100000760354 [0,0,1,1,0,0|1,0,0]=3 5265 B10R1.66 CC(=O)CCC1CCCC1 1458a_100000211120_200000210301 [0,0,1,1,0,0|1,0,0]=3 5266 B10R1.66 CC(=O)CCC1CCCO1 1458a_100011247709_200000210301 [0,0,1,1,0,0|2,0,0]=4 5267 B10R1.66 CC(=O)CCN1CCCC1 1458a_100000070787_100000004467 [0,0,1,1,0,0|2,0,0]=4 5268 B10R1.66 CC(=O)CCN1CCCC1 1458a_100000738983_200000210301 [0,0,1,1,0,0|2,0,0]=4 5269 B10R1.66 CC(=O)CCN1CCCC1 269982a_100000188435_100000053229 [0,0,1,1,0,0|2,0,0]=4 5270 B10R1.66 CC(=O)COC1CCCC1 1458a_100000741352_200000210301 [0,0,1,1,0,0|2,0,0]=4 5271 B10R1.66 CC(=O)COC1CCCC1 34a_100000211253_100000179811 [0,0,1,1,0,0|2,0,0]=4 5272 B10R1.66 CC(=O)NCC1CCCC1 11a_100000737975_100015343762 [0,0,1,1,0,0|2,0,0]=4 5273 B10R1.66 CC(=O)NCC1CCCC1 1626a_100000737975_100015343762 [0,0,1,1,0,0|2,0,0]=4 5274 B10R1.66 CC(=O)NCC1CCCC1 240690a_100000737975_100015343762 [0,0,1,1,0,0|2,0,0]=4 5275 B10R1.66 CC(=O)NCC1CCCC1 527a_100000737975_100103153847 [0,0,1,1,0,0|2,0,0]=4 5276 B10R1.66 NC(=O)CCN1CCCC1 2230a_100000188435_100000744528 [0,0,1,1,0,0|2,0,0]=4 5277 B10R1.66 NC(=O)CCN1CCCC1 269982a_100000188435_100000744528 [0,0,1,1,0,0|2,0,0]=4 5278 B10R1.66 NC(=O)CNC1CCCC1 2230a_100000211070_100000747473 [0,0,1,1,0,0|2,0,0]=4 5279 B10R1.66 NC(=O)CNC1CCCC1 2230a_100000711301_100000179811 [0,0,1,1,0,0|2,0,0]=4 5280 B10R1.66 NC(=O)CNC1CCCC1 34a_100000211070_100000187820 [0,0,1,1,0,0|2,0,0]=4 5281 B10R1.66 NC(=O)COC1CCCC1 34a_100000210269_100000187820 [0,0,1,1,0,0|2,0,0]=4 5282 B10R1.66 NC(=O)COC1CCCC1 7a_100000210269_100000187820 [0,0,1,1,0,0|2,0,0]=4 5283 B10R1.66 NC(=O)CSC1CCCC1 62a_100000747473_100000179811 [0,0,1,1,0,0|2,0,0]=4 5284 B10R1.66 NC(=O)CSC1CCCC1 62a_100011217020_100000747473 [0,0,1,1,0,0|2,0,0]=4 5285 B10R1.66 O=C(O)CNC1CCCC1 269956a_100016091260_100000179811 [0,0,1,1,0,0|1,0,0]=3 5286 B10R1.66 O=C(O)CNC1CCOC1 269956a_100016091260_100000731011 [0,0,1,1,0,0|2,0,0]=4 5287 B10R1.66 O=C([O-])CNC1CCCC1 34a_100000211070_100020667443 [0,0,1,1,0,0|1,0,1]=4 5288 B10R1.66 O=C([O-])COC1CCCC1 34a_100000210269_100020667443 [0,0,1,1,0,0|1,0,1]=4 5289 B10R1.66 O=C([O-])CSC1CCCC1 62a_100011217020_100020667443 [0,0,1,1,0,0|1,0,1]=4 5290 B10R1.66 O=C([O-])CSC1CCCC1 62a_100020667443_100000179811 [0,0,1,1,0,0|1,0,1]=4 5291 B10R1.66 [13CH3]C(=O)CCC1CCCC1 1458a_100000211120_200025704644 [0,0,1,1,0,0|1,0,0]=3 5292 B10R1.66 [13CH3]C(=O)CCC1CCCO1 1458a_100011247709_200025704644 [0,0,1,1,0,0|2,0,0]=4 5293 B10R1.66 [13CH3]C(=O)CCN1CCCC1 1458a_100000738983_200025704644 [0,0,1,1,0,0|2,0,0]=4 5294 B10R1.66 [13CH3]C(=O)COC1CCCC1 1458a_100000741352_200025704644 [0,0,1,1,0,0|2,0,0]=4 5295 B10R1.73 CC1CC1COCC(=O)N 34a_100000744939_100000187820 [0,0,1,1,0,0|2,0,0]=4 5296 B10R1.73 CC1CC1COCC(=O)N 7a_100000744939_100000187820 [0,0,1,1,0,0|2,0,0]=4 5297 B10R1.73 CC1CC1COCC(=O)[O-] 34a_100000744939_100020667443 [0,0,1,1,0,0|1,0,1]=4 5298 B10R1.86 CCCN1CCC1C(=O)O 269956a_100000021838_100000210207 [0,0,1,1,0,0|1,0,0]=3 5299 B10R1.86 COCN1CCC1C(=O)O 269956a_100000021838_100000766300 [0,0,1,1,0,0|2,0,0]=4 5300 B10R1.86 CSCN1CCC1C(=O)O 269956a_100000021838_100011218213 [0,0,1,1,0,0|2,0,0]=4 5301 B10R1.86 O=C(O)C1CCN1CCF 269956a_100000021838_100011217306 [0,0,1,1,0,0|2,0,0]=4 5302 B10R1.86 O=C(O)C1CCN1CCO 269956a_100000021838_100000211926 [0,0,1,1,0,0|2,0,0]=4 5303 B10R1.117 CC(=O)CCN1CCC1C 269982a_100000755817_100000053229 [0,0,1,1,0,0|2,0,0]=4 5304 B10R1.117 CC1CCN1CCC(=O)N 269982a_100000755817_100000744528 [0,0,1,1,0,0|2,0,0]=4 5305 B10R1.117 CC1CCN1CCC(=O)N 34a_100000755817_100000731001 [0,0,1,1,0,0|2,0,0]=4 5306 B10R1.126 CC(=O)CCCNC1CC1 34a_100000212008_100000685027 [0,0,1,1,0,0|2,0,0]=4 5307 B10R1.126 CC(=O)CCCOC1CC1 34a_100000759063_100000211595 [0,0,1,1,0,0|2,0,0]=4 5308 B10R1.126 CC(=O)CCCSC1CC1 62a_100011215641_100000211595 [0,0,1,1,0,0|2,0,0]=4 5309 B10R1.126 CC(=O)CCOCC1CC1 34a_100000759926_100000742324 [0,0,1,1,0,0|2,0,0]=4 5310 B10R1.126 CC(=O)CCOCC1CC1 7a_100000759926_100000742324 [0,0,1,1,0,0|2,0,0]=4 5311 B10R1.126 CC(=O)CCSCC1CC1 62a_100000053229_100000742324 [0,0,1,1,0,0|2,0,0]=4 5312 B10R1.126 CC(=O)CCSCC1CC1 62a_100000756562_100000053229 [0,0,1,1,0,0|2,0,0]=4 5313 B10R1.126 CC(=O)COCCC1CC1 34a_100000211253_100000694398 [0,0,1,1,0,0|2,0,0]=4 5314 B10R1.126 NC(=O)CCCNC1CC1 34a_100000212008_100102525003 [0,0,1,1,0,0|2,0,0]=4 5315 B10R1.126 NC(=O)CCCNC1CC1 34a_100000739312_100000211595 [0,0,1,1,0,0|2,0,0]=4 5316 B10R1.126 NC(=O)CCCSC1CC1 62a_100102525003_100000211595 [0,0,1,1,0,0|2,0,0]=4 5317 B10R1.126 NC(=O)CCNCC1CC1 2230a_100000735609_100000744528 [0,0,1,1,0,0|2,0,0]=4 5318 B10R1.126 NC(=O)CCNCC1CC1 269862a_100000740010_100000741477 [0,0,1,1,0,0|2,0,0]=4 5319 B10R1.126 NC(=O)CCNCC1CC1 34a_100000735609_100000731001 [0,0,1,1,0,0|2,0,0]=4 5320 B10R1.126 NC(=O)CCOCC1CC1 34a_100000211283_100000731001 [0,0,1,1,0,0|2,0,0]=4 5321 B10R1.126 NC(=O)CCOCC1CC1 34a_100000757172_100000742324 [0,0,1,1,0,0|2,0,0]=4 5322 B10R1.126 NC(=O)CCOCC1CC1 7a_100000757172_100000742324 [0,0,1,1,0,0|2,0,0]=4 5323 B10R1.126 NC(=O)CCSCC1CC1 62a_100000744528_100000742324 [0,0,1,1,0,0|2,0,0]=4 5324 B10R1.126 NC(=O)CCSCC1CC1 62a_100000756562_100000744528 [0,0,1,1,0,0|2,0,0]=4 5325 B10R1.126 NC(=O)CNCCC1CC1 2230a_100000711301_100000694398 [0,0,1,1,0,0|2,0,0]=4 5326 B10R1.126 NC(=O)CNCCC1CC1 34a_100000764129_100000187820 [0,0,1,1,0,0|2,0,0]=4 5327 B10R1.126 NC(=O)COCCC1CC1 34a_100000754188_100000187820 [0,0,1,1,0,0|2,0,0]=4 5328 B10R1.126 NC(=O)COCCC1CC1 7a_100000754188_100000187820 [0,0,1,1,0,0|2,0,0]=4 5329 B10R1.126 NC(=O)CSCCC1CC1 62a_100000747473_100000764125 [0,0,1,1,0,0|2,0,0]=4 5330 B10R1.126 NC(=O)CSCCC1CC1 62a_100000764125_100000747473 [0,0,1,1,0,0|2,0,0]=4 5331 B10R1.126 O=C(O)CNCCC1CC1 269956a_100016091260_100000694398 [0,0,1,1,0,0|1,0,0]=3 5332 B10R1.126 O=C(O)CNCCC1CO1 269956a_100016091260_100000732470 [0,0,1,1,0,0|2,0,0]=4 5333 B10R1.126 O=C(O)CONCC1CC1 269956a_100000106656_100000742324 [0,0,1,1,0,0|2,0,0]=4 5334 B10R1.126 O=C([O-])CNCCC1CC1 34a_100000764129_100020667443 [0,0,1,1,0,0|1,0,1]=4 5335 B10R1.126 O=C([O-])COCCC1CC1 34a_100000754188_100020667443 [0,0,1,1,0,0|1,0,1]=4 5336 B10R1.126 O=C([O-])CSCCC1CC1 62a_100000764125_100020667443 [0,0,1,1,0,0|1,0,1]=4 5337 B10R1.126 O=C([O-])CSCCC1CC1 62a_100020667443_100000764125 [0,0,1,1,0,0|1,0,1]=4 5338 B10R1.127 CC(=O)CCCN1CCC1 269982a_100000754969_100011215641 [0,0,1,1,0,0|2,0,0]=4 5339 B10R1.127 CC(=O)CCOC1CCC1 34a_100000759926_100000749161 [0,0,1,1,0,0|2,0,0]=4 5340 B10R1.127 CC(=O)CCSC1CCC1 62a_100000053229_100000749161 [0,0,1,1,0,0|2,0,0]=4 5341 B10R1.127 CC(=O)COCC1CCC1 34a_100000211253_100000763275 [0,0,1,1,0,0|2,0,0]=4 5342 B10R1.127 NC(=O)CCCN1CCC1 269982a_100000754969_100102525003 [0,0,1,1,0,0|2,0,0]=4 5343 B10R1.127 NC(=O)CCNC1CCC1 2230a_100000749019_100000744528 [0,0,1,1,0,0|2,0,0]=4 5344 B10R1.127 NC(=O)CCNC1CCC1 34a_100000749019_100000731001 [0,0,1,1,0,0|2,0,0]=4 5345 B10R1.127 NC(=O)CCOC1CCC1 34a_100000748187_100000731001 [0,0,1,1,0,0|2,0,0]=4 5346 B10R1.127 NC(=O)CCOC1CCC1 34a_100000757172_100000749161 [0,0,1,1,0,0|2,0,0]=4 5347 B10R1.127 NC(=O)CCSC1CCC1 62a_100000744528_100000749161 [0,0,1,1,0,0|2,0,0]=4 5348 B10R1.127 NC(=O)CNCC1CCC1 2230a_100000711301_100000763275 [0,0,1,1,0,0|2,0,0]=4 5349 B10R1.127 NC(=O)CNCC1CCC1 2230a_100000738700_100000747473 [0,0,1,1,0,0|2,0,0]=4 5350 B10R1.127 NC(=O)CNCC1CCC1 34a_100000738700_100000187820 [0,0,1,1,0,0|2,0,0]=4 5351 B10R1.127 NC(=O)COCC1CCC1 34a_100000760304_100000187820 [0,0,1,1,0,0|2,0,0]=4 5352 B10R1.127 NC(=O)CSCC1CCC1 62a_100000747473_100000763275 [0,0,1,1,0,0|2,0,0]=4 5353 B10R1.127 NC(=O)CSCC1CCC1 62a_100000763275_100000747473 [0,0,1,1,0,0|2,0,0]=4 5354 B10R1.127 O=C(O)CNCC1CCC1 269956a_100016091260_100000763275 [0,0,1,1,0,0|1,0,0]=3 5355 B10R1.127 O=C(O)CNCC1CCO1 269956a_100016091260_100000103362 [0,0,1,1,0,0|2,0,0]=4 5356 B10R1.127 O=C(O)CNCC1COC1 269956a_100016091260_100010264016 [0,0,1,1,0,0|2,0,0]=4 5357 B10R1.127 O=C(O)CONC1CCC1 269956a_100000106656_100000749161 [0,0,1,1,0,0|2,0,0]=4 5358 B10R1.127 O=C([O-])CNCC1CCC1 34a_100000738700_100020667443 [0,0,1,1,0,0|1,0,1]=4 5359 B10R1.127 O=C([O-])COCC1CCC1 34a_100000760304_100020667443 [0,0,1,1,0,0|1,0,1]=4 5360 B10R1.127 O=C([O-])CSCC1CCC1 62a_100000763275_100020667443 [0,0,1,1,0,0|1,0,1]=4 5361 B10R1.127 O=C([O-])CSCC1CCC1 62a_100020667443_100000763275 [0,0,1,1,0,0|1,0,1]=4 5362 B10R1.348 CC(=O)C1CCCCCC1 1458a_100000070787_100011217769 [0,0,1,1,0,0|1,0,0]=3 5363 B10R1.348 CC(=O)C1CCCCCC1 1458a_100000749507_200000210301 [0,0,1,1,0,0|1,0,0]=3 5364 B10R1.348 CC(=O)N1CCCCCC1 11a_100000185865_100015343762 [0,0,1,1,0,0|2,0,0]=4 5365 B10R1.348 CC(=O)N1CCCCCC1 1626a_100000185865_100015343762 [0,0,1,1,0,0|2,0,0]=4 5366 B10R1.348 CC(=O)N1CCCCCC1 240690a_100000185865_100015343762 [0,0,1,1,0,0|2,0,0]=4 5367 B10R1.348 CC(=O)N1CCCCCC1 527a_100000185865_100103153847 [0,0,1,1,0,0|2,0,0]=4 5368 B10R1.348 [13CH3]C(=O)C1CCCCCC1 1458a_100000749507_200025704644 [0,0,1,1,0,0|1,0,0]=3 5369 B10R1.168 CCC1CN(C1)CC(=O)N 2230a_100015205115_100000747473 [0,0,1,1,0,0|2,0,0]=4 5370 B10R1.168 CCC1CN(C1)CC(=O)N 269982a_100015205115_100000187820 [0,0,1,1,0,0|2,0,0]=4 5371 B10R1.168 CCC1CN(C1)CC(=O)[O-] 269982a_100015205115_100020667443 [0,0,1,1,0,0|1,0,1]=4 5372 B10R1.168 CCN1CC(C1)CC(=O)O 269956a_100016993960_100000210202 [0,0,1,1,0,0|1,0,0]=3 5373 B10R1.168 O=C(O)CC1CN(C1)CF 269956a_100016993960_100015361967 [0,0,1,1,0,0|2,0,0]=4 5374 B10R1.192 CC(=O)N1C(CCC1C)C 11a_100000687148_100015343762 [0,0,1,1,0,0|2,0,0]=4 5375 B10R1.192 CC(=O)N1C(CCC1C)C 240690a_100000687148_100015343762 [0,0,1,1,0,0|2,0,0]=4 5376 B10R1.192 CC(=O)N1C(CCC1C)C 527a_100000687148_100103153847 [0,0,1,1,0,0|2,0,0]=4 5377 B10R1.266 CC(=O)NC(C)C1CCC1 11a_100016994624_100015343762 [0,0,1,1,0,0|2,0,0]=4 5378 B10R1.266 CC(=O)NC(C)C1CCC1 1626a_100016994624_100015343762 [0,0,1,1,0,0|2,0,0]=4 5379 B10R1.266 CC(=O)NC(C)C1CCC1 240690a_100016994624_100015343762 [0,0,1,1,0,0|2,0,0]=4 5380 B10R1.266 CC(=O)NC(C)C1CCC1 527a_100016994624_100103153847 [0,0,1,1,0,0|2,0,0]=4 5381 B10R1.266 CN(CC(=O)N)C1CCC1 2230a_100000758072_100000747473 [0,0,1,1,0,0|2,0,0]=4 5382 B10R1.266 CN(CC(=O)N)C1CCC1 269982a_100000758072_100000187820 [0,0,1,1,0,0|2,0,0]=4 5383 B10R1.266 CN(CC(=O)N)C1CCC1 270004a_100000739694_100000241760 [0,0,1,1,0,0|2,0,0]=4 5384 B10R1.266 CN(CC(=O)N)C1CCC1 34a_100000758072_100000187820 [0,0,1,1,0,0|2,0,0]=4 5385 B10R1.266 CN(CC(=O)O)C1CCC1 269956a_100000746989_100000749161 [0,0,1,1,0,0|1,0,0]=3 5386 B10R1.266 CN(CC(=O)O)C1COC1 269956a_100000746989_100009818527 [0,0,1,1,0,0|2,0,0]=4 5387 B10R1.266 CN(CC(=O)[O-])C1CCC1 269982a_100000758072_100020667443 [0,0,1,1,0,0|1,0,1]=4 5388 B10R1.266 CN(CC(=O)[O-])C1CCC1 34a_100000758072_100020667443 [0,0,1,1,0,0|1,0,1]=4 5389 B10R1.268 CN(CC(=O)N)CC1CC1 2230a_100000739694_100000742324 [0,0,1,1,0,0|2,0,0]=4 5390 B10R1.268 CN(CC(=O)N)CC1CC1 2230a_100000741881_100000747473 [0,0,1,1,0,0|2,0,0]=4 5391 B10R1.268 CN(CC(=O)N)CC1CC1 269982a_100000741881_100000187820 [0,0,1,1,0,0|2,0,0]=4 5392 B10R1.268 CN(CC(=O)O)CC1CC1 269956a_100000746989_100000742324 [0,0,1,1,0,0|1,0,0]=3 5393 B10R1.268 CN(CC(=O)O)CC1CO1 269956a_100000746989_102125554688 [0,0,1,1,0,0|2,0,0]=4 5394 B10R1.268 CN(CC(=O)O)CC1CS1 269956a_100000746989_100000031435 [0,0,1,1,0,0|2,0,0]=4 5395 B10R1.268 CN(CC(=O)O)C[C@@H]1CO1 269956a_100000746989_100000745022 [0,0,1,1,0,0|2,0,0]=4 5396 B10R1.268 CN(CC(=O)[O-])CC1CC1 269982a_100000741881_100020667443 [0,0,1,1,0,0|1,0,1]=4 5397 B10R1.227 CCC1(COC1)CC(=O)C 1458a_100000070787_200009907690 [0,0,1,1,0,0|2,0,0]=4 5398 B10R1.374 CCC(NC(=O)C)C1CC1 11a_100025715781_100015343762 [0,0,1,1,0,0|2,0,0]=4 5399 B10R1.374 CCC(NC(=O)C)C1CC1 1626a_100025715781_100015343762 [0,0,1,1,0,0|2,0,0]=4 5400 B10R1.374 CCC(NC(=O)C)C1CC1 240690a_100025715781_100015343762 [0,0,1,1,0,0|2,0,0]=4 5401 B10R1.374 CCC(NC(=O)C)C1CC1 527a_100025715781_100103153847 [0,0,1,1,0,0|2,0,0]=4 5402 B10R1.374 CCN(CC(=O)N)C1CC1 2230a_100000738653_100000747473 [0,0,1,1,0,0|2,0,0]=4 5403 B10R1.374 CCN(CC(=O)N)C1CC1 269982a_100000738653_100000187820 [0,0,1,1,0,0|2,0,0]=4 5404 B10R1.374 CCN(CC(=O)O)C1CC1 269956a_100000746405_100000211595 [0,0,1,1,0,0|1,0,0]=3 5405 B10R1.374 CCN(CC(=O)[O-])C1CC1 269982a_100000738653_100020667443 [0,0,1,1,0,0|1,0,1]=4 5406 B10R1.394 CCCC1(CC1)NC(=O)C 11a_100015185929_100015343762 [0,0,1,1,0,0|2,0,0]=4 5407 B10R1.394 CCCC1(CC1)NC(=O)C 1626a_100015185929_100015343762 [0,0,1,1,0,0|2,0,0]=4 5408 B10R1.394 CCCC1(CC1)NC(=O)C 240690a_100015185929_100015343762 [0,0,1,1,0,0|2,0,0]=4 5409 B10R1.394 CCCC1(CC1)NC(=O)C 527a_100015185929_100103153847 [0,0,1,1,0,0|2,0,0]=4 5410 B10R1.394 CNCC1(CC1)CC(=O)O 269956a_100020588786_200000210301 [0,0,1,1,0,0|1,0,0]=3 5411 B10R1.394 [13CH3]NCC1(CC1)CC(=O)O 269956a_100020588786_200025704644 [0,0,1,1,0,0|1,0,0]=3 5412 B10R2.58 C=CCN1CC2CC2C1 2230a_100000741873_100000210623 [1,0,0,1,0,0|2,0,0]=4 5413 B10R2.58 C=CCN1CC2CC2C1 269982a_100000741873_100000210623 [1,0,0,1,0,0|2,0,0]=4 5414 B10R2.58 C=CCN1CC2CC2C1 34a_100000741873_100015514636 [1,0,0,1,0,0|2,0,0]=4 5415 B10R2.58 O=CCN1CC2CC2C1 2230a_100000741873_200015260668 [1,0,0,1,0,0|1,0,0]=3 5416 B10R2.58 O=CCN1CC2CC2C1 269982a_100000741873_200015260668 [1,0,0,1,0,0|1,0,0]=3 5417 B10R2.58 O=CCN1CC2CC2C1 34a_100000741873_200009817547 [1,0,0,1,0,0|1,0,0]=3 5418 B10R2.58 OCCN1CC2CC2C1 2230a_100000741873_100000211926 [1,0,0,1,0,0|1,0,1]=4 5419 B10R2.58 OCCN1CC2CC2C1 269982a_100000741873_100000211926 [1,0,0,1,0,0|1,0,1]=4 5420 B10R2.58 OCCN1CC2CC2C1 34a_100000741873_100000211926 [1,0,0,1,0,0|1,0,1]=4 5421 B10R2.62 CN1CC2CCC1CC2 2230a_100000750499_200000210301 [1,0,0,1,0,0|2,0,0]=4 5422 B10R2.62 CN1CC2CCC1CC2 269982a_100000750499_200000210301 [1,0,0,1,0,0|2,0,0]=4 5423 B10R2.62 CN1CC2CCC1CC2 34a_100000750499_200000210301 [1,0,0,1,0,0|2,0,0]=4 5424 B10R2.62 [13CH3]N1CC2CCC1CC2 2230a_100000750499_200025704644 [1,0,0,1,0,0|2,0,0]=4 5425 B10R2.62 [13CH3]N1CC2CCC1CC2 269982a_100000750499_200025704644 [1,0,0,1,0,0|2,0,0]=4 5426 B10R2.62 [13CH3]N1CC2CCC1CC2 34a_100000750499_200025704644 [1,0,0,1,0,0|2,0,0]=4 5427 B10R2.161 CNC1C2CCC1CC2 34a_100102657272_100009813300 [1,0,0,1,0,0|2,0,0]=4 5428 B10R2.161 COC1C2CCC1CC2 34a_100138415774_100009813300 [1,0,0,1,0,0|2,0,0]=4 5429 B10R2.161 CSC1C2CCC1CC2 62a_100009813300_200000210301 [1,0,0,1,0,0|2,0,0]=4 5430 B10R2.161 CSC1C2CCC1CC2 62a_200000210301_100009813300 [1,0,0,1,0,0|2,0,0]=4 5431 B10R2.161 [13CH3]SC1C2CCC1CC2 62a_100009813300_200025704644 [1,0,0,1,0,0|2,0,0]=4 5432 B10R2.161 [13CH3]SC1C2CCC1CC2 62a_200025704644_100009813300 [1,0,0,1,0,0|2,0,0]=4 5433 B10R2.351 CC(=O)C1C2C1COC2 1458a_100000138910_200000210301 [0,0,0,1,1,0|2,0,0]=4 5434 B10R2.351 [13CH3]C(=O)C1C2C1COC2 1458a_100000138910_200025704644 [0,0,0,1,1,0|2,0,0]=4 5435 B10R2.357 CC(=O)N1CC2CC2C1 11a_100000741873_100015343762 [0,0,0,1,1,0|2,0,0]=4 5436 B10R2.357 CC(=O)N1CC2CC2C1 1626a_100000741873_100015343762 [0,0,0,1,1,0|2,0,0]=4 5437 B10R2.357 CC(=O)N1CC2CC2C1 240690a_100000741873_100015343762 [0,0,0,1,1,0|2,0,0]=4 5438 B10R2.357 CC(=O)N1CC2CC2C1 527a_100000741873_100103153847 [0,0,0,1,1,0|2,0,0]=4 5439 B12R2.22 OC1CN(C1)C2CCCCC2 269982a_100000749847_100000210327 [0,0,0,1,0,1|1,0,1]=4 5440 B12R2.250 CC(=O)C1CC12CCOCC2 1458a_100000766831_200000210301 [0,0,0,1,0,1|2,0,0]=4 5441 B12R2.250 [13CH3]C(=O)C1CC12CCOCC2 1458a_100000766831_200025704644 [0,0,0,1,0,1|2,0,0]=4 5442 B12R2.1367 C=C(C)CN1C2CCC1CC2 2230a_100000735658_100000748629 [0,0,0,1,0,1|2,0,0]=4 5443 B12R2.1367 C=C(C)CN1C2CCC1CC2 269982a_100000735658_100000748629 [0,0,0,1,0,1|2,0,0]=4 5444 B12R2.1367 C=C(C)CN1C2CCC1CC2 34a_100000735658_100000748629 [0,0,0,1,0,1|2,0,0]=4 5445 B12R2.1367 C=C(F)CN1C2CCC1CC2 2230a_100000735658_100009893438 [0,0,0,1,0,1|2,0,0]=4 5446 B12R2.1367 C=C(F)CN1C2CCC1CC2 269982a_100000735658_100009893438 [0,0,0,1,0,1|2,0,0]=4 5447 B12R2.1367 C=C(F)CN1C2CCC1CC2 34a_100000735658_100009893438 [0,0,0,1,0,1|2,0,0]=4 5448 B12R2.1367 CC(O)CN1C2CCC1CC2 2230a_100000735658_100011218427 [0,0,0,1,0,1|1,0,1]=4 5449 B12R2.1367 CC(O)CN1C2CCC1CC2 269982a_100000735658_100011218427 [0,0,0,1,0,1|1,0,1]=4 5450 B12R2.1367 CC(O)CN1C2CCC1CC2 34a_100000735658_100011218427 [0,0,0,1,0,1|1,0,1]=4 5451 B12R2.1367 C[C@@H](O)CN1C2CCC1CC2 2230a_100000735658_100009817552 [0,0,0,1,0,1|1,0,1]=4 5452 B12R2.1367 C[C@@H](O)CN1C2CCC1CC2 269982a_100000735658_100009817552 [0,0,0,1,0,1|1,0,1]=4 5453 B12R2.1367 C[C@@H](O)CN1C2CCC1CC2 34a_100000735658_100009817552 [0,0,0,1,0,1|1,0,1]=4 5454 B12R2.1367 NC(=O)CN1C2CCC1CC2 2230a_100000735658_100000747473 [0,0,0,1,0,1|1,0,0]=3 5455 B12R2.1367 NC(=O)CN1C2CCC1CC2 269982a_100000735658_100000187820 [0,0,0,1,0,1|1,0,0]=3 5456 B12R2.1367 NC(=O)CN1C2CCC1CC2 34a_100000735658_100000187820 [0,0,0,1,0,1|1,0,0]=3 5457 B12R2.1367 O=C([O-])CN1C2CCC1CC2 269982a_100000735658_100020667443 [0,0,0,1,0,1|0,0,1]=3 5458 B12R2.1367 O=C([O-])CN1C2CCC1CC2 34a_100000735658_100020667443 [0,0,0,1,0,1|0,0,1]=3 5459 B12R2.1367 O=[N+]([O-])CN1C2CCC1CC2 269982a_100000735658_100000761209 [0,0,0,1,0,1|1,0,1]=4 5460 B12R2.1367 O=[N+]([O-])CN1C2CCC1CC2 34a_100000735658_100000761209 [0,0,0,1,0,1|1,0,1]=4 5461 B12R2.1377 NC(=O)CNC1C2C1COC2 2230a_100000702821_100000747473 [0,0,0,1,0,1|2,0,0]=4 5462 B12R2.1377 NC(=O)CNC1C2C1COC2 34a_100000702821_100000187820 [0,0,0,1,0,1|2,0,0]=4 5463 B12R2.1377 O=C([O-])CNC1C2C1COC2 34a_100000702821_100020667443 [0,0,0,1,0,1|1,0,1]=4 5464 B12R2.1381 CC(=O)CCN1CC2CC2C1 269982a_100000741873_100000053229 [0,0,0,1,0,1|2,0,0]=4 5465 B12R2.1381 CC(=O)OCN1CC2CC2C1 269982a_100000741873_100000076356 [0,0,0,1,0,1|2,0,0]=4 5466 B12R2.1381 CC(=O)OCN1CC2CC2C1 34a_100000741873_100009813279 [0,0,0,1,0,1|2,0,0]=4 5467 B12R2.1381 CC(O)CNC1CC2CC2C1 270004a_100000210904_100010340937 [0,0,0,1,0,1|1,0,1]=4 5468 B12R2.1381 NC(=O)CCN1CC2CC2C1 2230a_100000741873_100000744528 [0,0,0,1,0,1|2,0,0]=4 5469 B12R2.1381 NC(=O)CCN1CC2CC2C1 269982a_100000741873_100000744528 [0,0,0,1,0,1|2,0,0]=4 5470 B12R2.1381 NC(=O)CCN1CC2CC2C1 34a_100000741873_100000731001 [0,0,0,1,0,1|2,0,0]=4 5471 B12R2.1392 CC(=O)C1CC2CCN1CC2 1458a_100102578056_200000210301 [0,0,0,1,0,1|2,0,0]=4 5472 B12R2.1392 CC(=O)N1CC2CCC1CC2 11a_100000750499_100015343762 [0,0,0,1,0,1|1,0,0]=3 5473 B12R2.1392 CC(=O)N1CC2CCC1CC2 1626a_100000750499_100015343762 [0,0,0,1,0,1|1,0,0]=3 5474 B12R2.1392 CC(=O)N1CC2CCC1CC2 240690a_100000750499_100015343762 [0,0,0,1,0,1|1,0,0]=3 5475 B12R2.1392 CC(=O)N1CC2CCC1CC2 527a_100000750499_100103153847 [0,0,0,1,0,1|1,0,0]=3 5476 B12R2.1392 [13CH3]C(=O)C1CC2CCN1CC2 1458a_100102578056_200025704644 [0,0,0,1,0,1|2,0,0]=4 5477 B12R2.2057 C1CCC(CC1)NCC2CO2 2230a_100000182618_100011216344 [0,0,0,1,0,1|1,0,1]=4 5478 B12R2.2057 C1CCC(CC1)NCC2CO2 34a_100000182618_102125554688 [0,0,0,1,0,1|1,0,1]=4 5479 B12R2.2057 C1CCC(CC1)OCC2CO2 34a_100000210231_102125554688 [0,0,0,1,0,1|1,0,1]=4 5480 B12R2.2057 C1CCC(CC1)OCC2CO2 7a_100000210231_102125554688 [0,0,0,1,0,1|1,0,1]=4 5481 B12R2.2057 C1CCC(CC1)OC[C@@H]2CO2 34a_100000757423_100000210327 [0,0,0,1,0,1|1,0,1]=4 5482 B12R2.2057 C1CCC(CC1)OC[C@@H]2CO2 7a_100000210231_100000745022 [0,0,0,1,0,1|1,0,1]=4 5483 B12R2.2057 C1CCC(CC1)SCC2CO2 62a_100000210327_102125554688 [0,0,0,1,0,1|1,0,1]=4 5484 B12R2.2057 C1CCC(CC1)SCC2CO2 62a_102125554688_100000210327 [0,0,0,1,0,1|1,0,1]=4 5485 B12R2.2057 C1CCC(CC1)SC[C@@H]2CO2 62a_100000210327_100000745022 [0,0,0,1,0,1|1,0,1]=4 5486 B12R2.2057 C1CCC(CC1)SC[C@@H]2CO2 62a_100000745022_100000210327 [0,0,0,1,0,1|1,0,1]=4 5487 B12R2.5266 C=C(C)COC1CCC2C1C2 34a_200012295571_100000748629 [0,0,0,1,0,1|2,0,0]=4 5488 B12R2.5266 C=C(F)COC1CCC2C1C2 34a_200012295571_100009893438 [0,0,0,1,0,1|2,0,0]=4 5489 B12R2.5266 CC(O)CNC1CCC2C1C2 269862a_100000210904_100000692480 [0,0,0,1,0,1|1,0,1]=4 5490 B12R2.5266 CC(O)CNC1CCC2C1C2 270004a_100000210904_100000692480 [0,0,0,1,0,1|1,0,1]=4 5491 B12R2.5266 CC(O)COC1CCC2C1C2 34a_200012295571_100011218427 [0,0,0,1,0,1|1,0,1]=4 5492 B12R2.5266 C[C@@H](O)COC1CCC2C1C2 34a_200012295571_100009817552 [0,0,0,1,0,1|1,0,1]=4 5493 B12R2.5266 NC(=O)COC1CCC2C1C2 34a_200012295571_100000187820 [0,0,0,1,0,1|1,0,0]=3 5494 B12R2.5266 O=C([O-])COC1CCC2C1C2 34a_200012295571_100020667443 [0,0,0,1,0,1|0,0,1]=3 5495 B12R2.5266 O=[N+]([O-])COC1CCC2C1C2 34a_200012295571_100000761209 [0,0,0,1,0,1|1,0,1]=4 5496 B12R2.1365 CC(=O)N1C2CCC1COC2 11a_100015205251_100015343762 [0,0,0,1,0,1|2,0,0]=4 5497 B12R2.1365 CC(=O)N1C2CCC1COC2 1626a_100015205251_100015343762 [0,0,0,1,0,1|2,0,0]=4 5498 B12R2.1365 CC(=O)N1C2CCC1COC2 240690a_100015205251_100015343762 [0,0,0,1,0,1|2,0,0]=4 5499 B12R2.1365 CC(=O)N1C2CCC1COC2 527a_100015205251_100103153847 [0,0,0,1,0,1|2,0,0]=4 5500 B12R2.1209 CN1CCC2(CC1)CC(=O)N2 2230a_100000746869_200000210301 [0,1,0,1,0,0|2,0,0]=4 5501 B12R2.1209 CN1CCC2(CC1)CC(=O)N2 34a_100000746869_200000210301 [0,1,0,1,0,0|2,0,0]=4 5502 B12R2.1209 [13CH3]N1CCC2(CC1)CC(=O)N2 2230a_100000746869_200025704644 [0,1,0,1,0,0|2,0,0]=4 5503 B12R2.1209 [13CH3]N1CCC2(CC1)CC(=O)N2 34a_100000746869_200025704644 [0,1,0,1,0,0|2,0,0]=4 5504 B12R2.4309 CC(=O)C(C)N1CC2CC2C1 2230a_100000741873_100009814033 [0,1,0,1,0,0|2,0,0]=4 5505 B12R2.4309 CC(=O)C(C)N1CC2CC2C1 269982a_100000741873_100009814033 [0,1,0,1,0,0|2,0,0]=4 5506 B12R2.4309 CC(C(=O)N)N1CC2CC2C1 2230a_100000741873_100000702099 [0,1,0,1,0,0|2,0,0]=4 5507 B12R2.4309 CC(C(=O)N)N1CC2CC2C1 269982a_100000741873_100000184083 [0,1,0,1,0,0|2,0,0]=4 5508 B12R2.4309 CC(C(=O)N)N1CC2CC2C1 34a_100000741873_100000702099 [0,1,0,1,0,0|2,0,0]=4 5509 B12R2.4309 NC(=O)C(F)N1CC2CC2C1 2230a_100000741873_100009813875 [0,1,0,1,0,0|2,0,0]=4 5510 B12R2.4309 NC(=O)C(F)N1CC2CC2C1 269982a_100000741873_100009813875 [0,1,0,1,0,0|2,0,0]=4 5511 B12R2.4309 NC(=O)C(F)N1CC2CC2C1 34a_100000741873_100009813875 [0,1,0,1,0,0|2,0,0]=4 5512 B12R2.4309 O=C([O-])C(F)N1CC2CC2C1 34a_100000741873_100020610796 [0,1,0,1,0,0|1,0,1]=4 5513 B12R2.1561 C=CC(=O)N1C2CCC1CC2 1626a_100000735658_100000185746 [0,1,0,1,0,0|2,0,0]=4 5514 B12R2.1561 C=CC(=O)N1C2CCC1CC2 240690a_100000735658_200121576911 [0,1,0,1,0,0|2,0,0]=4 5515 B12R2.1561 CCC(=O)N1C2CCC1CC2 11a_100000735658_100000210414 [0,1,0,1,0,0|2,0,0]=4 5516 B12R2.1561 CCC(=O)N1C2CCC1CC2 1626a_100000735658_100000210414 [0,1,0,1,0,0|2,0,0]=4 5517 B12R2.1561 CCC(=O)N1C2CCC1CC2 240690a_100000735658_100000210414 [0,1,0,1,0,0|2,0,0]=4 5518 B12R2.1561 CCC(=O)N1C2CCC1CC2 527a_100000735658_100000210414 [0,1,0,1,0,0|2,0,0]=4 5519 B12R2.1561 CNC(=O)N1C2CCC1CC2 2708a_100102657272_100000735658 [0,1,0,1,0,0|2,0,0]=4 5520 B12R2.1561 CNC(=O)N1C2CCC1CC2 273464a_100102657272_100000735658 [0,1,0,1,0,0|2,0,0]=4 5521 B12R2.1561 O=C(CO)N1C2CCC1CC2 240690a_100000735658_100000210174 [0,1,0,1,0,0|1,0,0]=3 5522 B12R2.1561 O=C(CO)N1C2CCC1CC2 527a_100000735658_100000210174 [0,1,0,1,0,0|1,0,0]=3 5523 B12R2.1619 CCC(=O)CN1CC2CC2C1 269982a_100000741873_100000747405 [0,1,0,1,0,0|2,0,0]=4 5524 B12R2.1619 CNC(=O)CN1CC2CC2C1 2230a_100000741873_100000183359 [0,1,0,1,0,0|2,0,0]=4 5525 B12R2.1619 CNC(=O)CN1CC2CC2C1 269982a_100000741873_100000183359 [0,1,0,1,0,0|2,0,0]=4 5526 B12R2.1619 CNC(=O)CN1CC2CC2C1 34a_100000741873_100000183359 [0,1,0,1,0,0|2,0,0]=4 5527 B12R2.1619 COC(=O)CN1CC2CC2C1 2230a_100000741873_100000747449 [0,1,0,1,0,0|1,0,0]=3 5528 B12R2.1619 COC(=O)CN1CC2CC2C1 269982a_100000741873_100000747449 [0,1,0,1,0,0|1,0,0]=3 5529 B12R2.1619 COC(=O)CN1CC2CC2C1 34a_100000741873_100000747449 [0,1,0,1,0,0|1,0,0]=3 5530 B12R2.1626 O=C(CO)NC1C2C1COC2 240690a_100000702821_100000210174 [0,1,0,1,0,0|2,0,0]=4 5531 B12R2.1626 O=C(CO)NC1C2C1COC2 527a_100000702821_100000210174 [0,1,0,1,0,0|2,0,0]=4 5532 B12R2.3511 CCC(=O)[C@H]1[C@H]2[C@@H]1CCCC2 1458a_100153394716_100000210202 [0,1,0,1,0,0|1,0,0]=3 5533 B12R2.3511 CNC(=O)[C@H]1[C@H]2[C@@H]1CCCC2 11a_106832991635_100153394716 [0,1,0,1,0,0|1,0,0]=3 5534 B12R2.3511 CNC(=O)[C@H]1[C@H]2[C@@H]1CCCC2 1626a_100102657272_100153394716 [0,1,0,1,0,0|1,0,0]=3 5535 B12R2.3511 CNC(=O)[C@H]1[C@H]2[C@@H]1CCCC2 240690a_100102657272_100153394716 [0,1,0,1,0,0|1,0,0]=3 5536 B12R2.3511 CNC(=O)[C@H]1[C@H]2[C@@H]1CCCC2 527a_100102657272_100153394716 [0,1,0,1,0,0|1,0,0]=3 5537 B12R2.3511 O=C(CF)[C@H]1[C@H]2[C@@H]1CCCC2 1458a_100153394716_100015361967 [0,1,0,1,0,0|1,0,0]=3 5538 B12R2.1661 CC(=O)CC1CC2CCC1C2 1458a_100000211222_200000210301 [0,1,0,1,0,0|1,0,0]=3 5539 B12R2.1661 CC(=O)NC1CC2CCC1C2 11a_100000758229_100015343762 [0,1,0,1,0,0|2,0,0]=4 5540 B12R2.1661 CC(=O)NC1CC2CCC1C2 1626a_100000758229_100015343762 [0,1,0,1,0,0|2,0,0]=4 5541 B12R2.1661 CC(=O)NC1CC2CCC1C2 240690a_100000758229_100015343762 [0,1,0,1,0,0|2,0,0]=4 5542 B12R2.1661 CC(=O)NC1CC2CCC1C2 527a_100000758229_100103153847 [0,1,0,1,0,0|2,0,0]=4 5543 B12R2.1661 NC(=O)CN1CC2CCC1C2 2230a_100000743476_100000747473 [0,1,0,1,0,0|2,0,0]=4 5544 B12R2.1661 NC(=O)CN1CC2CCC1C2 269982a_100000743476_100000187820 [0,1,0,1,0,0|2,0,0]=4 5545 B12R2.1661 NC(=O)CN1CC2CCC1C2 34a_100000743476_100000187820 [0,1,0,1,0,0|2,0,0]=4 5546 B12R2.1661 O=C([O-])CN1CC2CCC1C2 269982a_100000743476_100020667443 [0,1,0,1,0,0|1,0,1]=4 5547 B12R2.1661 O=C([O-])CN1CC2CCC1C2 34a_100000743476_100020667443 [0,1,0,1,0,0|1,0,1]=4 5548 B12R2.1661 [13CH3]C(=O)CC1CC2CCC1C2 1458a_100000211222_200025704644 [0,1,0,1,0,0|1,0,0]=3 5549 B8R0.8 CC(CNCF)C(=O)O 269956a_100000749485_100015361967 [0,0,1,0,1,0|2,0,0]=4 5550 B8R0.8 CCCCC(C)C(=O)C 1458a_100000070787_200011215066 [0,0,1,0,1,0|1,0,0]=3 5551 B8R0.8 CCCCC(C)C(=O)C 1458a_100000725509_200000210301 [0,0,1,0,1,0|1,0,0]=3 5552 B8R0.8 CCCCC(C)C(=O)[13CH3] 1458a_100000725509_200025704644 [0,0,1,0,1,0|1,0,0]=3 5553 B8R0.8 CCCCC(O)C(=O)C 1458a_100000720857_200000210301 [0,0,1,0,1,0|2,0,0]=4 5554 B8R0.8 CCCCC(O)C(=O)[13CH3] 1458a_100000720857_200025704644 [0,0,1,0,1,0|2,0,0]=4 5555 B8R0.8 CCCCN(C)C(=O)C 11a_100000207549_100015343762 [0,0,1,0,1,0|2,0,0]=4 5556 B8R0.8 CCCCN(C)C(=O)C 1626a_100000207549_100015343762 [0,0,1,0,1,0|2,0,0]=4 5557 B8R0.8 CCCCN(C)C(=O)C 240690a_100000207549_100015343762 [0,0,1,0,1,0|2,0,0]=4 5558 B8R0.8 CCCCN(C)C(=O)C 527a_100000207549_100103153847 [0,0,1,0,1,0|2,0,0]=4 5559 B8R0.8 CCCN[C@@H](C)C(=O)O 269956a_100000743915_100000210207 [0,0,1,0,1,0|1,0,0]=3 5560 B8R0.8 CCCN[C@H](C)C(=O)N 2230a_100000119354_100000210303 [0,0,1,0,1,0|2,0,0]=4 5561 B8R0.8 CCCN[C@H](C)C(=O)N 34a_100000119354_100000210303 [0,0,1,0,1,0|2,0,0]=4 5562 B8R0.8 CCCOC(C)C(=O)C 34a_100000212229_100000210303 [0,0,1,0,1,0|2,0,0]=4 5563 B8R0.8 CCCOC(C)C(=O)N 34a_100000210258_100000702099 [0,0,1,0,1,0|2,0,0]=4 5564 B8R0.8 CCCO[C@@H](C)C(=O)[O-] 7a_217856618621_100000210303 [0,0,1,0,1,0|1,0,1]=4 5565 B8R0.8 CCCO[C@H](C)C(=O)N 34a_100000731257_100000210303 [0,0,1,0,1,0|2,0,0]=4 5566 B8R0.8 CCCO[C@H](C)C(=O)N 7a_100000731257_100000210303 [0,0,1,0,1,0|2,0,0]=4 5567 B8R0.8 CCCSC(C)C(=O)C 62a_100000210303_100009814033 [0,0,1,0,1,0|2,0,0]=4 5568 B8R0.8 CCCSC(C)C(=O)C 62a_100009814033_100000210303 [0,0,1,0,1,0|2,0,0]=4 5569 B8R0.8 CCCSC(C)C(=O)N 62a_100000210303_100000702099 [0,0,1,0,1,0|2,0,0]=4 5570 B8R0.8 CCCSC(C)C(=O)N 62a_100000702099_100000210303 [0,0,1,0,1,0|2,0,0]=4 5571 B8R0.8 CCNCC(C)C(=O)O 269956a_100000749485_100000210202 [0,0,1,0,1,0|1,0,0]=3 5572 B8R0.8 CCNCC(F)C(=O)O 269956a_100000084737_100000210202 [0,0,1,0,1,0|2,0,0]=4 5573 B8R0.8 CCOCC(C)C(=O)C 34a_100000032740_100000210202 [0,0,1,0,1,0|2,0,0]=4 5574 B8R0.8 CCOCC(C)C(=O)C 7a_100000032740_100000210202 [0,0,1,0,1,0|2,0,0]=4 5575 B8R0.8 COCN[C@@H](C)C(=O)O 269956a_100000743915_100000766300 [0,0,1,0,1,0|2,0,0]=4 5576 B8R0.8 CSCN[C@@H](C)C(=O)O 269956a_100000743915_100011218213 [0,0,1,0,1,0|2,0,0]=4 5577 B8R0.8 C[C@H](NCCF)C(=O)O 269956a_100000743915_100011217306 [0,0,1,0,1,0|2,0,0]=4 5578 B8R0.8 C[C@H](NCCO)C(=O)O 269956a_100000743915_100000211926 [0,0,1,0,1,0|2,0,0]=4 5579 B8R0.15 CCCC(CC)C(=O)C 1458a_100000070787_100011219200 [0,0,1,0,1,0|1,0,0]=3 5580 B8R0.15 CCCC(CC)C(=O)C 1458a_100011416436_200000210301 [0,0,1,0,1,0|1,0,0]=3 5581 B8R0.15 CCCC(CC)C(=O)[13CH3] 1458a_100011416436_200025704644 [0,0,1,0,1,0|1,0,0]=3 5582 B8R0.15 CCCC(OC)C(=O)N 34a_100011626294_200000210301 [0,0,1,0,1,0|2,0,0]=4 5583 B8R0.15 CCCC(OC)C(=O)N 7a_100011626294_200000210301 [0,0,1,0,1,0|2,0,0]=4 5584 B8R0.15 CCCC(O[13CH3])C(=O)N 34a_100011626294_200025704644 [0,0,1,0,1,0|2,0,0]=4 5585 B8R0.15 CCCC(O[13CH3])C(=O)N 7a_100011626294_200025704644 [0,0,1,0,1,0|2,0,0]=4 5586 B8R0.15 CCCN(CC)C(=O)C 11a_100000226822_100015343762 [0,0,1,0,1,0|2,0,0]=4 5587 B8R0.15 CCCN(CC)C(=O)C 1626a_100000226822_100015343762 [0,0,1,0,1,0|2,0,0]=4 5588 B8R0.15 CCCN(CC)C(=O)C 240690a_100000226822_100015343762 [0,0,1,0,1,0|2,0,0]=4 5589 B8R0.15 CCCN(CC)C(=O)C 527a_100000226822_100103153847 [0,0,1,0,1,0|2,0,0]=4 5590 B8R0.15 CCC[C@H](NC)C(=O)N 2230a_100000729256_200000210301 [0,0,1,0,1,0|2,0,0]=4 5591 B8R0.15 CCC[C@H](NC)C(=O)N 34a_100000729256_200000210301 [0,0,1,0,1,0|2,0,0]=4 5592 B8R0.15 CCC[C@H](NC)C(=O)O 269956a_100000750406_200000210301 [0,0,1,0,1,0|1,0,0]=3 5593 B8R0.15 CCC[C@H](N[13CH3])C(=O)N 2230a_100000729256_200025704644 [0,0,1,0,1,0|2,0,0]=4 5594 B8R0.15 CCC[C@H](N[13CH3])C(=O)N 34a_100000729256_200025704644 [0,0,1,0,1,0|2,0,0]=4 5595 B8R0.15 CCC[C@H](N[13CH3])C(=O)O 269956a_100000750406_200025704644 [0,0,1,0,1,0|1,0,0]=3 5596 B8R0.15 CCNC(CC)C(=O)N 2230a_100000733705_100000210202 [0,0,1,0,1,0|2,0,0]=4 5597 B8R0.15 CCNC(CC)C(=O)N 2230a_100015525214_100000750255 [0,0,1,0,1,0|2,0,0]=4 5598 B8R0.15 CCNC(CC)C(=O)N 34a_100000733705_100000210202 [0,0,1,0,1,0|2,0,0]=4 5599 B8R0.15 CCNC(CO)C(=O)O 269956a_100000187304_100000210202 [0,0,1,0,1,0|2,0,0]=4 5600 B8R0.15 CCN[C@H](CC)C(=O)O 269956a_100000747097_100000210202 [0,0,1,0,1,0|1,0,0]=3 5601 B8R0.15 CCOC(CC)C(=O)N 34a_100121572206_100000750255 [0,0,1,0,1,0|2,0,0]=4 5602 B8R0.15 CCSC(CC)C(=O)N 62a_100000210202_100000750255 [0,0,1,0,1,0|2,0,0]=4 5603 B8R0.15 CCSC(CC)C(=O)N 62a_100000750255_100000210202 [0,0,1,0,1,0|2,0,0]=4 5604 B8R0.15 CC[C@@H](NCF)C(=O)O 269956a_100000747097_100015361967 [0,0,1,0,1,0|2,0,0]=4 5605 B8R0.15 CN[C@@H](CSC)C(=O)O 269956a_100011421858_200000210301 [0,0,1,0,1,0|2,0,0]=4 5606 B8R0.15 CN[C@@H](C[Se]C)C(=O)O 269956a_100015254316_200000210301 [0,0,1,0,1,0|2,0,0]=4 5607 B8R0.15 CN[C@H](COC)C(=O)O 269956a_100011998655_200000210301 [0,0,1,0,1,0|2,0,0]=4 5608 B8R0.15 COC[C@@H](N[13CH3])C(=O)O 269956a_100011998655_200025704644 [0,0,1,0,1,0|2,0,0]=4 5609 B8R0.15 CSC[C@H](N[13CH3])C(=O)O 269956a_100011421858_200025704644 [0,0,1,0,1,0|2,0,0]=4 5610 B8R0.15 C[Se]C[C@H](N[13CH3])C(=O)O 269956a_100015254316_200025704644 [0,0,1,0,1,0|2,0,0]=4 5611 B8R1.8 C=CCN1CCCC1 2230a_100000188435_100000210623 [1,0,0,0,1,0|2,0,0]=4 5612 B8R1.8 C=CCN1CCCC1 269982a_100000188435_100000210623 [1,0,0,0,1,0|2,0,0]=4 5613 B8R1.8 CNCC1CCCC1 2230a_100000737975_200000210301 [1,0,0,0,1,0|2,0,0]=4 5614 B8R1.8 CNCC1CCCC1 2230a_106832991635_100000740388 [1,0,0,0,1,0|2,0,0]=4 5615 B8R1.8 CNCC1CCCC1 269862a_106832991636_100000746403 [1,0,0,0,1,0|2,0,0]=4 5616 B8R1.8 CNCC1CCCC1 34a_100000737975_200000210301 [1,0,0,0,1,0|2,0,0]=4 5617 B8R1.8 CNCC1CCCC1 34a_100102657272_100000740388 [1,0,0,0,1,0|2,0,0]=4 5618 B8R1.8 CNCC1CCCC1 7a_106832991635_100000740388 [1,0,0,0,1,0|2,0,0]=4 5619 B8R1.8 COCC1CCCC1 34a_100000742336_200000210301 [1,0,0,0,1,0|2,0,0]=4 5620 B8R1.8 COCC1CCCC1 34a_100138415774_100000740388 [1,0,0,0,1,0|2,0,0]=4 5621 B8R1.8 COCC1CCCC1 7a_100000742336_200000210301 [1,0,0,0,1,0|2,0,0]=4 5622 B8R1.8 CSCC1CCCC1 62a_100000740388_200000210301 [1,0,0,0,1,0|2,0,0]=4 5623 B8R1.8 CSCC1CCCC1 62a_200000210301_100000740388 [1,0,0,0,1,0|2,0,0]=4 5624 B8R1.8 O=CCN1CCCC1 2230a_100000188435_200015260668 [1,0,0,0,1,0|1,0,0]=3 5625 B8R1.8 O=CCN1CCCC1 269982a_100000188435_200015260668 [1,0,0,0,1,0|1,0,0]=3 5626 B8R1.8 O=CCN1CCSC1 2230a_100011215254_200015260668 [1,0,0,0,1,0|2,0,0]=4 5627 B8R1.8 O=CCN1CCSC1 269982a_100011215254_200015260668 [1,0,0,0,1,0|2,0,0]=4 5628 B8R1.8 OCCN1CCCC1 2230a_100000188435_100000211926 [1,0,0,0,1,0|1,0,1]=4 5629 B8R1.8 OCCN1CCCC1 269982a_100000188435_100000211926 [1,0,0,0,1,0|1,0,1]=4 5630 B8R1.8 [13CH3]NCC1CCCC1 2230a_100000737975_200025704644 [1,0,0,0,1,0|2,0,0]=4 5631 B8R1.8 [13CH3]NCC1CCCC1 34a_100000737975_200025704644 [1,0,0,0,1,0|2,0,0]=4 5632 B8R1.8 [13CH3]OCC1CCCC1 34a_100000742336_200025704644 [1,0,0,0,1,0|2,0,0]=4 5633 B8R1.8 [13CH3]OCC1CCCC1 7a_100000742336_200025704644 [1,0,0,0,1,0|2,0,0]=4 5634 B8R1.8 [13CH3]SCC1CCCC1 62a_100000740388_200025704644 [1,0,0,0,1,0|2,0,0]=4 5635 B8R1.8 [13CH3]SCC1CCCC1 62a_200025704644_100000740388 [1,0,0,0,1,0|2,0,0]=4 5636 B8R1.7 CC(=O)C1CCCC1 1458a_100000070787_100000179811 [0,0,0,0,2,0|1,0,0]=3 5637 B8R1.7 CC(=O)C1CCCC1 1458a_100000210718_200000210301 [0,0,0,0,2,0|1,0,0]=3 5638 B8R1.7 CC(=O)C1CCCS1 1458a_100012002731_200000210301 [0,0,0,0,2,0|2,0,0]=4 5639 B8R1.7 CC(=O)C1CCOC1 1458a_100000070787_100000690089 [0,0,0,0,2,0|2,0,0]=4 5640 B8R1.7 CC(=O)C1CCOC1 1458a_100011219752_200000210301 [0,0,0,0,2,0|2,0,0]=4 5641 B8R1.7 CC(=O)N1CCCC1 240690a_100000188435_100015343762 [0,0,0,0,2,0|2,0,0]=4 5642 B8R1.7 CC(=O)N1CCCC1 527a_100000188435_100103153847 [0,0,0,0,2,0|2,0,0]=4 5643 B8R1.7 CC(=O)[C@@H]1CCCO1 1458a_100000686382_200000210301 [0,0,0,0,2,0|2,0,0]=4 5644 B8R1.7 [13CH3]C(=O)C1CCCC1 1458a_100000210718_200025704644 [0,0,0,0,2,0|1,0,0]=3 5645 B8R1.7 [13CH3]C(=O)C1CCCS1 1458a_100012002731_200025704644 [0,0,0,0,2,0|2,0,0]=4 5646 B8R1.7 [13CH3]C(=O)C1CCOC1 1458a_100011219752_200025704644 [0,0,0,0,2,0|2,0,0]=4 5647 B8R1.7 [13CH3]C(=O)[C@@H]1CCCO1 1458a_100000686382_200025704644 [0,0,0,0,2,0|2,0,0]=4 5648 B8R1.34 CC(=O)CC1CCC1 1458a_100000070787_100000763275 [0,0,0,0,2,0|1,0,0]=3 5649 B8R1.34 CC(=O)CC1CCC1 1458a_100000763092_200000210301 [0,0,0,0,2,0|1,0,0]=3 5650 B8R1.34 CC(=O)CC1CCO1 1458a_100000070787_100000103362 [0,0,0,0,2,0|2,0,0]=4 5651 B8R1.34 CC(=O)CC1COC1 1458a_100000070787_100010264016 [0,0,0,0,2,0|2,0,0]=4 5652 B8R1.34 CC(=O)CC1COC1 1458a_100000687760_200000210301 [0,0,0,0,2,0|2,0,0]=4 5653 B8R1.34 CC(=O)NC1CCC1 11a_100000749019_100015343762 [0,0,0,0,2,0|2,0,0]=4 5654 B8R1.34 CC(=O)NC1CCC1 1626a_100000749019_100015343762 [0,0,0,0,2,0|2,0,0]=4 5655 B8R1.34 CC(=O)NC1CCC1 240690a_100000749019_100015343762 [0,0,0,0,2,0|2,0,0]=4 5656 B8R1.34 CC(=O)NC1CCC1 527a_100000749019_100103153847 [0,0,0,0,2,0|2,0,0]=4 5657 B8R1.34 NC(=O)CN1CCC1 269982a_100000754969_100000187820 [0,0,0,0,2,0|2,0,0]=4 5658 B8R1.34 O=C([O-])CN1CCC1 269982a_100000754969_100020667443 [0,0,0,0,2,0|1,0,1]=4 5659 B8R1.34 [13CH3]C(=O)CC1CCC1 1458a_100000763092_200025704644 [0,0,0,0,2,0|1,0,0]=3 5660 B8R1.34 [13CH3]C(=O)CC1COC1 1458a_100000687760_200025704644 [0,0,0,0,2,0|2,0,0]=4 5661 B10R0.27 C=C(C)CNC(CC)CCC 2230a_100000747048_100000748629 [0,0,1,0,0,1|2,0,0]=4 5662 B10R0.27 C=C(C)COC(CC)CCC 34a_100000687864_100000748629 [0,0,1,0,0,1|2,0,0]=4 5663 B10R0.27 C=C(C)COC(CC)CCC 7a_100000687864_100000748629 [0,0,1,0,0,1|2,0,0]=4 5664 B10R0.27 C=C(C)CSC(CC)CCC 62a_100000748629_100011219200 [0,0,1,0,0,1|2,0,0]=4 5665 B10R0.27 C=C(C)CSC(CC)CCC 62a_100011219200_100000211660 [0,0,1,0,0,1|2,0,0]=4 5666 B10R0.27 C=C(F)CNC(CC)CCC 2230a_100000747048_100009893438 [0,0,1,0,0,1|2,0,0]=4 5667 B10R0.27 C=C(F)COC(CC)CCC 34a_100000687864_100009893438 [0,0,1,0,0,1|2,0,0]=4 5668 B10R0.27 C=C(F)COC(CC)CCC 7a_100000687864_100000042424 [0,0,1,0,0,1|2,0,0]=4 5669 B10R0.27 C=C(F)CSC(CC)CCC 62a_100000042424_100011219200 [0,0,1,0,0,1|2,0,0]=4 5670 B10R0.27 C=C(F)CSC(CC)CCC 62a_100011219200_100000042424 [0,0,1,0,0,1|2,0,0]=4 5671 B10R0.27 CCC(COC)NCC(=O)N 2230a_100000757820_100000747473 [0,0,1,0,0,1|2,0,0]=4 5672 B10R0.27 CCC(COC)OCC(=O)N 7a_200011214946_100000187820 [0,0,1,0,0,1|2,0,0]=4 5673 B10R0.27 CCCC(CC)NCC(=O)N 2230a_100000747048_100000747473 [0,0,1,0,0,1|1,0,0]=3 5674 B10R0.27 CCCC(CC)NCC(=O)O 269956a_100016091260_100011219200 [0,0,1,0,0,1|0,0,0]=2 5675 B10R0.27 CCCC(CC)NCC(C)O 2230a_100000747048_100011218427 [0,0,1,0,0,1|1,0,1]=4 5676 B10R0.27 CCCC(CC)NCC(C)O 270004a_100000210904_100000687865 [0,0,1,0,0,1|1,0,1]=4 5677 B10R0.27 CCCC(CC)NC[C@@H](C)O 2230a_100000747048_100009817552 [0,0,1,0,0,1|1,0,1]=4 5678 B10R0.27 CCCC(CC)OCC(=O)N 34a_100000687864_100000187820 [0,0,1,0,0,1|1,0,0]=3 5679 B10R0.27 CCCC(CC)OCC(=O)N 7a_100000687864_100000187820 [0,0,1,0,0,1|1,0,0]=3 5680 B10R0.27 CCCC(CC)OCC(=O)[O-] 34a_100000687864_100020667443 [0,0,1,0,0,1|0,0,1]=3 5681 B10R0.27 CCCC(CC)OCC(C)O 34a_100000687864_100011218427 [0,0,1,0,0,1|1,0,1]=4 5682 B10R0.27 CCCC(CC)OCC(C)O 7a_100000687864_100011218427 [0,0,1,0,0,1|1,0,1]=4 5683 B10R0.27 CCCC(CC)OC[C@@H](C)O 34a_100000687864_100009817552 [0,0,1,0,0,1|1,0,1]=4 5684 B10R0.27 CCCC(CC)OC[C@@H](C)O 7a_100000687864_100009817552 [0,0,1,0,0,1|1,0,1]=4 5685 B10R0.27 CCCC(CC)OC[N+](=O)[O-] 34a_100000687864_100000761209 [0,0,1,0,0,1|1,0,1]=4 5686 B10R0.27 CCCC(CC)SCC(=O)N 62a_100000747473_100011219200 [0,0,1,0,0,1|1,0,0]=3 5687 B10R0.27 CCCC(CC)SCC(=O)N 62a_100011219200_100000747473 [0,0,1,0,0,1|1,0,0]=3 5688 B10R0.27 CCCC(CC)SCC(=O)[O-] 62a_100011219200_100020667443 [0,0,1,0,0,1|0,0,1]=3 5689 B10R0.27 CCCC(CC)SCC(=O)[O-] 62a_100020667443_100011219200 [0,0,1,0,0,1|0,0,1]=3 5690 B10R0.27 CCCC(CC)SCC(C)O 62a_100011218427_100011219200 [0,0,1,0,0,1|1,0,1]=4 5691 B10R0.27 CCCC(CC)SCC(C)O 62a_100011219200_100011218427 [0,0,1,0,0,1|1,0,1]=4 5692 B10R0.27 CCCC(CC)SC[C@@H](C)O 62a_100009817552_100011219200 [0,0,1,0,0,1|1,0,1]=4 5693 B10R0.27 CCCC(CC)SC[C@@H](C)O 62a_100011219200_100009817552 [0,0,1,0,0,1|1,0,1]=4 5694 B10R0.27 CCCC(CC)SC[N+](=O)[O-] 62a_100011219200_100000761209 [0,0,1,0,0,1|1,0,1]=4 5695 B10R0.27 CCCN(CC)CCC(=O)C 269982a_100000226822_100000053229 [0,0,1,0,0,1|2,0,0]=4 5696 B10R0.27 CCCN(CC)CCC(=O)N 2230a_100000226822_100000744528 [0,0,1,0,0,1|2,0,0]=4 5697 B10R0.27 CCCN(CC)CCC(=O)N 2230a_100020645749_100000210303 [0,0,1,0,0,1|2,0,0]=4 5698 B10R0.27 CCCN(CC)CCC(=O)N 269982a_100000226822_100000744528 [0,0,1,0,0,1|2,0,0]=4 5699 B10R0.27 CCCN(CC)COC(=O)C 269982a_100000226822_100000076356 [0,0,1,0,0,1|2,0,0]=4 5700 B10R0.27 CCC[C@@H](CO)NCC(=O)N 2230a_100000732646_100000747473 [0,0,1,0,0,1|2,0,0]=4 5701 B10R0.27 CCC[C@@H](CO)NCC(=O)N 34a_100000732646_100000187820 [0,0,1,0,0,1|2,0,0]=4 5702 B10R0.27 CCC[C@@H](CO)NCC(=O)[O-] 34a_100000732646_100020667443 [0,0,1,0,0,1|1,0,1]=4 5703 B10R0.27 CCOC(CC)CNC(=O)C 11a_100015183923_100015343762 [0,0,1,0,0,1|2,0,0]=4 5704 B10R0.27 CCOC(CC)CNC(=O)C 1626a_100015183923_100015343762 [0,0,1,0,0,1|2,0,0]=4 5705 B10R0.27 CCOC(CC)CNC(=O)C 240690a_100015183923_100015343762 [0,0,1,0,0,1|2,0,0]=4 5706 B10R0.27 CCOC(CC)CNC(=O)C 527a_100015183923_100103153847 [0,0,1,0,0,1|2,0,0]=4 5707 B10R1.85 C=CCN1CCCCCC1 2230a_100000185865_100000210623 [1,0,0,0,0,1|2,0,0]=4 5708 B10R1.85 C=CCN1CCCCCC1 269982a_100000185865_100000210623 [1,0,0,0,0,1|2,0,0]=4 5709 B10R1.85 C=CCN1CCCCCC1 34a_100000185865_100015514636 [1,0,0,0,0,1|2,0,0]=4 5710 B10R1.85 C=CCN1CCCOCC1 2230a_100000685342_100000210623 [1,0,0,0,0,1|2,0,0]=4 5711 B10R1.85 C=CCN1CCCOCC1 269982a_100000685342_100000210623 [1,0,0,0,0,1|2,0,0]=4 5712 B10R1.85 C=CCN1CCCOCC1 34a_100000685342_100015514636 [1,0,0,0,0,1|2,0,0]=4 5713 B10R1.85 CNCC1CCCCCC1 2230a_100015204231_200000210301 [1,0,0,0,0,1|2,0,0]=4 5714 B10R1.85 CNCC1CCCCCC1 2230a_106832991635_200000696569 [1,0,0,0,0,1|2,0,0]=4 5715 B10R1.85 CNCC1CCCCCC1 269862a_106832991636_200000763224 [1,0,0,0,0,1|2,0,0]=4 5716 B10R1.85 CNCC1CCCCCC1 34a_100015204231_200000210301 [1,0,0,0,0,1|2,0,0]=4 5717 B10R1.85 CNCC1CCCCCC1 34a_100102657272_200000696569 [1,0,0,0,0,1|2,0,0]=4 5718 B10R1.85 CNCC1CCCCCC1 7a_106832991635_200000696569 [1,0,0,0,0,1|2,0,0]=4 5719 B10R1.85 COCC1CCCCCC1 34a_100000699130_200000210301 [1,0,0,0,0,1|2,0,0]=4 5720 B10R1.85 COCC1CCCCCC1 34a_100138415774_200000696569 [1,0,0,0,0,1|2,0,0]=4 5721 B10R1.85 COCC1CCCCCC1 7a_100000699130_200000210301 [1,0,0,0,0,1|2,0,0]=4 5722 B10R1.85 CSCC1CCCCCC1 62a_200000210301_200000696569 [1,0,0,0,0,1|2,0,0]=4 5723 B10R1.85 CSCC1CCCCCC1 62a_200000696569_200000210301 [1,0,0,0,0,1|2,0,0]=4 5724 B10R1.85 O=CCN1CCCCCC1 2230a_100000185865_200015260668 [1,0,0,0,0,1|1,0,0]=3 5725 B10R1.85 O=CCN1CCCCCC1 269982a_100000185865_200015260668 [1,0,0,0,0,1|1,0,0]=3 5726 B10R1.85 O=CCN1CCCCCC1 34a_100000185865_200009817547 [1,0,0,0,0,1|1,0,0]=3 5727 B10R1.85 O=CCN1CCCOCC1 2230a_100000685342_200015260668 [1,0,0,0,0,1|1,0,0]=3 5728 B10R1.85 O=CCN1CCCOCC1 269982a_100000685342_200015260668 [1,0,0,0,0,1|1,0,0]=3 5729 B10R1.85 O=CCN1CCCOCC1 34a_100000685342_200009817547 [1,0,0,0,0,1|1,0,0]=3 5730 B10R1.85 OCCN1CCCCCC1 2230a_100000185865_100000211926 [1,0,0,0,0,1|1,0,1]=4 5731 B10R1.85 OCCN1CCCCCC1 269982a_100000185865_100000211926 [1,0,0,0,0,1|1,0,1]=4 5732 B10R1.85 OCCN1CCCCCC1 34a_100000185865_100000211926 [1,0,0,0,0,1|1,0,1]=4 5733 B10R1.85 OCCN1CCCOCC1 2230a_100000685342_100000211926 [1,0,0,0,0,1|1,0,1]=4 5734 B10R1.85 OCCN1CCCOCC1 269982a_100000685342_100000211926 [1,0,0,0,0,1|1,0,1]=4 5735 B10R1.85 OCCN1CCCOCC1 34a_100000685342_100000211926 [1,0,0,0,0,1|1,0,1]=4 5736 B10R1.85 [13CH3]NCC1CCCCCC1 2230a_100015204231_200025704644 [1,0,0,0,0,1|2,0,0]=4 5737 B10R1.85 [13CH3]NCC1CCCCCC1 34a_100015204231_200025704644 [1,0,0,0,0,1|2,0,0]=4 5738 B10R1.85 [13CH3]OCC1CCCCCC1 34a_100000699130_200025704644 [1,0,0,0,0,1|2,0,0]=4 5739 B10R1.85 [13CH3]OCC1CCCCCC1 7a_100000699130_200025704644 [1,0,0,0,0,1|2,0,0]=4 5740 B10R1.85 [13CH3]SCC1CCCCCC1 62a_200000696569_200025704644 [1,0,0,0,0,1|2,0,0]=4 5741 B10R1.85 [13CH3]SCC1CCCCCC1 62a_200025704644_200000696569 [1,0,0,0,0,1|2,0,0]=4 5742 B12R1.252 C=C(Br)CCOC1CCCCC1 34a_100009813270_100000210327 [0,0,0,0,0,2|2,0,0]=4 5743 B12R1.252 C=C(C)CCNC1CCCCC1 2230a_100000182618_100000730704 [0,0,0,0,0,2|2,0,0]=4 5744 B12R1.252 C=C(C)CCNC1CCCCC1 34a_100000182618_100000730704 [0,0,0,0,0,2|2,0,0]=4 5745 B12R1.252 C=C(C)CCOC1CCCCC1 34a_100000210231_100000730704 [0,0,0,0,0,2|2,0,0]=4 5746 B12R1.252 C=C(C)CCOC1CCCCC1 34a_100000764851_100000210327 [0,0,0,0,0,2|2,0,0]=4 5747 B12R1.252 C=C(C)CCOC1CCCCC1 7a_100000210231_100000730704 [0,0,0,0,0,2|2,0,0]=4 5748 B12R1.252 C=C(C)CCSC1CCCCC1 62a_100000210327_100000730704 [0,0,0,0,0,2|2,0,0]=4 5749 B12R1.252 C=C(C)CCSC1CCCCC1 62a_100000730704_100000210327 [0,0,0,0,0,2|2,0,0]=4 5750 B12R1.252 C=C(C)CNCC1CCCCC1 2230a_100000210473_100000748629 [0,0,0,0,0,2|2,0,0]=4 5751 B12R1.252 C=C(C)CNCC1CCCCC1 34a_100000210473_100000748629 [0,0,0,0,0,2|2,0,0]=4 5752 B12R1.252 C=C(C)COCC1CCCCC1 34a_100000210245_100000211423 [0,0,0,0,0,2|2,0,0]=4 5753 B12R1.252 C=C(C)COCC1CCCCC1 34a_100000212181_100000748629 [0,0,0,0,0,2|2,0,0]=4 5754 B12R1.252 C=C(C)COCC1CCCCC1 7a_100000212181_100000748629 [0,0,0,0,0,2|2,0,0]=4 5755 B12R1.252 C=C(C)CSCC1CCCCC1 62a_100000211423_100000211660 [0,0,0,0,0,2|2,0,0]=4 5756 B12R1.252 C=C(C)CSCC1CCCCC1 62a_100000748629_100000211423 [0,0,0,0,0,2|2,0,0]=4 5757 B12R1.252 C=C(F)CNCC1CCCCC1 2230a_100000210473_100009893438 [0,0,0,0,0,2|2,0,0]=4 5758 B12R1.252 C=C(F)CNCC1CCCCC1 34a_100000210473_100009893438 [0,0,0,0,0,2|2,0,0]=4 5759 B12R1.252 C=C(F)COCC1CCCCC1 34a_100000212181_100009893438 [0,0,0,0,0,2|2,0,0]=4 5760 B12R1.252 C=C(F)COCC1CCCCC1 34a_200010262243_100000211423 [0,0,0,0,0,2|2,0,0]=4 5761 B12R1.252 C=C(F)COCC1CCCCC1 7a_100000212181_100000042424 [0,0,0,0,0,2|2,0,0]=4 5762 B12R1.252 C=C(F)CSCC1CCCCC1 62a_100000042424_100000211423 [0,0,0,0,0,2|2,0,0]=4 5763 B12R1.252 C=C(F)CSCC1CCCCC1 62a_100000211423_100000042424 [0,0,0,0,0,2|2,0,0]=4 5764 B12R1.252 CC(=CCNC1CCCCC1)C 2230a_100000182618_100000761012 [0,0,0,0,0,2|2,0,0]=4 5765 B12R1.252 CC(=CCNC1CCCCC1)C 270004a_100000718196_100000210434 [0,0,0,0,0,2|2,0,0]=4 5766 B12R1.252 CC(=CCNC1CCCCC1)C 34a_100000182618_100000761012 [0,0,0,0,0,2|2,0,0]=4 5767 B12R1.252 CC(=CCNC1CCCCC1)C 34a_100000718196_100000210327 [0,0,0,0,0,2|2,0,0]=4 5768 B12R1.252 CC(=CCOC1CCCCC1)C 34a_100000210231_100000761012 [0,0,0,0,0,2|2,0,0]=4 5769 B12R1.252 CC(=CCOC1CCCCC1)C 34a_100000753907_100000210327 [0,0,0,0,0,2|2,0,0]=4 5770 B12R1.252 CC(=CCOC1CCCCC1)C 7a_100000210231_100000761012 [0,0,0,0,0,2|2,0,0]=4 5771 B12R1.252 CC(=CCSC1CCCCC1)C 62a_100000210327_100000761012 [0,0,0,0,0,2|2,0,0]=4 5772 B12R1.252 CC(=CCSC1CCCCC1)C 62a_100000761012_100000210327 [0,0,0,0,0,2|2,0,0]=4 5773 B12R1.252 CC(=O)C=CCN1CCCCC1 1458a_100015232380_200000210301 [0,0,0,0,0,2|2,0,0]=4 5774 B12R1.252 CC(=O)CCCC1CCCCC1 1458a_100000070787_100011713725 [0,0,0,0,0,2|1,0,0]=3 5775 B12R1.252 CC(=O)CCCC1CCCCC1 1458a_100000211478_200000210301 [0,0,0,0,0,2|1,0,0]=3 5776 B12R1.252 CC(=O)CCCN1CCCCC1 1458a_100000070787_100000690320 [0,0,0,0,0,2|2,0,0]=4 5777 B12R1.252 CC(=O)CCCN1CCCCC1 1458a_100000742516_200000210301 [0,0,0,0,0,2|2,0,0]=4 5778 B12R1.252 CC(=O)CCOC1CCCCC1 1458a_100000070787_100011211530 [0,0,0,0,0,2|1,0,0]=3 5779 B12R1.252 CC(=O)CCOC1CCCCC1 34a_100000759926_100000210327 [0,0,0,0,0,2|1,0,0]=3 5780 B12R1.252 CC(=O)CCOC1CCCCC1 7a_100000210231_100000053229 [0,0,0,0,0,2|1,0,0]=3 5781 B12R1.252 CC(=O)CCOC1CCCCC1 7a_100000759926_100000210327 [0,0,0,0,0,2|1,0,0]=3 5782 B12R1.252 CC(=O)CCOC1CCCCO1 1458a_100000070787_100000744793 [0,0,0,0,0,2|2,0,0]=4 5783 B12R1.252 CC(=O)CCOC1CCCOC1 34a_100000759926_100000693364 [0,0,0,0,0,2|2,0,0]=4 5784 B12R1.252 CC(=O)CCOC1CCCOC1 7a_100000759926_100000693364 [0,0,0,0,0,2|2,0,0]=4 5785 B12R1.252 CC(=O)CCOC1CCCSC1 7a_100015962668_100000053229 [0,0,0,0,0,2|2,0,0]=4 5786 B12R1.252 CC(=O)CCOC1CCOCC1 7a_100000759926_100000686592 [0,0,0,0,0,2|2,0,0]=4 5787 B12R1.252 CC(=O)CCOC1CCSCC1 34a_100000759926_100000069128 [0,0,0,0,0,2|2,0,0]=4 5788 B12R1.252 CC(=O)CCOC1CCSCC1 7a_100000731022_100000053229 [0,0,0,0,0,2|2,0,0]=4 5789 B12R1.252 CC(=O)CCOC1CCSCC1 7a_100000759926_100011500858 [0,0,0,0,0,2|2,0,0]=4 5790 B12R1.252 CC(=O)CCSC1CCCCC1 62a_100000053229_100000210327 [0,0,0,0,0,2|1,0,0]=3 5791 B12R1.252 CC(=O)CCSC1CCCCC1 62a_100000210327_100000053229 [0,0,0,0,0,2|1,0,0]=3 5792 B12R1.252 CC(=O)CCSC1CCCOC1 62a_100000053229_100000693364 [0,0,0,0,0,2|2,0,0]=4 5793 B12R1.252 CC(=O)CCSC1CCOCC1 62a_100000053229_100011324220 [0,0,0,0,0,2|2,0,0]=4 5794 B12R1.252 CC(=O)CCSC1CCSCC1 62a_100000053229_100000069128 [0,0,0,0,0,2|2,0,0]=4 5795 B12R1.252 CC(=O)COCC1CCCCC1 34a_100000211253_100000211423 [0,0,0,0,0,2|1,0,0]=3 5796 B12R1.252 CC(=O)COCC1CCCCO1 1458a_100011223378_200000210301 [0,0,0,0,0,2|2,0,0]=4 5797 B12R1.252 CC(=O)COCC1CCCCO1 34a_100000211253_100000211543 [0,0,0,0,0,2|2,0,0]=4 5798 B12R1.252 CC(=O)COCC1CCCOC1 34a_100000211253_100000741521 [0,0,0,0,0,2|2,0,0]=4 5799 B12R1.252 CC(=O)COCC1CCOCC1 34a_100000211253_100000754603 [0,0,0,0,0,2|2,0,0]=4 5800 B12R1.252 CC(=O)NCCC1CCCCC1 11a_100000738074_100015343762 [0,0,0,0,0,2|1,0,0]=3 5801 B12R1.252 CC(=O)NCCC1CCCCC1 1626a_100000738074_100015343762 [0,0,0,0,0,2|1,0,0]=3 5802 B12R1.252 CC(=O)NCCC1CCCCC1 240690a_100000738074_100015343762 [0,0,0,0,0,2|1,0,0]=3 5803 B12R1.252 CC(=O)NCCC1CCCCC1 527a_100000738074_100103153847 [0,0,0,0,0,2|1,0,0]=3 5804 B12R1.252 CC(=O)NCCC1CCCCO1 11a_100015183643_100015343762 [0,0,0,0,0,2|2,0,0]=4 5805 B12R1.252 CC(=O)NCCC1CCCCO1 1626a_100015183643_100015343762 [0,0,0,0,0,2|2,0,0]=4 5806 B12R1.252 CC(=O)NCCC1CCCCO1 240690a_100015183643_100015343762 [0,0,0,0,0,2|2,0,0]=4 5807 B12R1.252 CC(=O)NCCC1CCCCO1 527a_100015183643_100103153847 [0,0,0,0,0,2|2,0,0]=4 5808 B12R1.252 CC(=O)NCCC1CCOCC1 11a_100000755988_100015343762 [0,0,0,0,0,2|2,0,0]=4 5809 B12R1.252 CC(=O)NCCC1CCOCC1 1626a_100000755988_100015343762 [0,0,0,0,0,2|2,0,0]=4 5810 B12R1.252 CC(=O)NCCC1CCOCC1 240690a_100000755988_100015343762 [0,0,0,0,0,2|2,0,0]=4 5811 B12R1.252 CC(=O)NCCC1CCOCC1 527a_100000755988_100103153847 [0,0,0,0,0,2|2,0,0]=4 5812 B12R1.252 CC(=O)NCCN1CCCCC1 240690a_100000216509_100015343762 [0,0,0,0,0,2|2,0,0]=4 5813 B12R1.252 CC(=O)NCCN1CCCCC1 527a_100000216509_100103153847 [0,0,0,0,0,2|2,0,0]=4 5814 B12R1.252 CC(=O)NN=CC1CCCCC1 4a_100000189765_100000211278 [0,0,0,0,0,2|1,0,1]=4 5815 B12R1.252 CC(=O)NNCC1CCCCC1 22a_100000740227_100000070787 [0,0,0,0,0,2|1,0,0]=3 5816 B12R1.252 CC(=O)NNCC1CCOCC1 22a_200000757053_100000070787 [0,0,0,0,0,2|2,0,0]=4 5817 B12R1.252 CC(=O)OCNC1CCCCC1 34a_100000182618_100009813279 [0,0,0,0,0,2|1,0,0]=3 5818 B12R1.252 CC(=O)OCNC1CCCOC1 34a_100000719290_100009813279 [0,0,0,0,0,2|2,0,0]=4 5819 B12R1.252 CC(=O)OCNC1CCOCC1 34a_100000741149_100009813279 [0,0,0,0,0,2|2,0,0]=4 5820 B12R1.252 CC(=O)OCNC1CCSCC1 34a_100000748639_100009813279 [0,0,0,0,0,2|2,0,0]=4 5821 B12R1.252 CC(=O)OCOC1CCCCC1 34a_100000210231_100009813279 [0,0,0,0,0,2|1,0,0]=3 5822 B12R1.252 CC(=O)OCOC1CCCCO1 34a_100000033831_100009813279 [0,0,0,0,0,2|2,0,0]=4 5823 B12R1.252 CC(=O)OCOC1CCCOC1 34a_100000754041_100009813279 [0,0,0,0,0,2|2,0,0]=4 5824 B12R1.252 CC(=O)OCOC1CCOCC1 34a_100000744328_100009813279 [0,0,0,0,0,2|2,0,0]=4 5825 B12R1.252 CC(=O)OCOC1CCSCC1 34a_100000731022_100009813279 [0,0,0,0,0,2|2,0,0]=4 5826 B12R1.252 CC(=O)OCSC1CCCCC1 62a_100000076356_100000210327 [0,0,0,0,0,2|1,0,0]=3 5827 B12R1.252 CC(=O)OCSC1CCCCC1 62a_100000210327_100000076356 [0,0,0,0,0,2|1,0,0]=3 5828 B12R1.252 CC(=O)OCSC1CCCOC1 62a_100000076356_100000693364 [0,0,0,0,0,2|2,0,0]=4 5829 B12R1.252 CC(=O)OCSC1CCOCC1 62a_100000076356_100011324220 [0,0,0,0,0,2|2,0,0]=4 5830 B12R1.252 CC(=O)OCSC1CCSCC1 62a_100000076356_100000069128 [0,0,0,0,0,2|2,0,0]=4 5831 B12R1.252 CC(O)CCNC1CCCCC1 2230a_100000182618_100012276601 [0,0,0,0,0,2|1,0,1]=4 5832 B12R1.252 CC(O)CCNC1CCCCC1 270004a_200000755665_100000210434 [0,0,0,0,0,2|1,0,1]=4 5833 B12R1.252 CC(O)CCNC1CCCCC1 34a_100000182618_100012276601 [0,0,0,0,0,2|1,0,1]=4 5834 B12R1.252 CC(O)CCOC1CCCCC1 34a_100000210231_100012276601 [0,0,0,0,0,2|1,0,1]=4 5835 B12R1.252 CC(O)CCOC1CCCCC1 7a_100000210231_100012276601 [0,0,0,0,0,2|1,0,1]=4 5836 B12R1.252 CC(O)CCSC1CCCCC1 62a_100000210327_100012276601 [0,0,0,0,0,2|1,0,1]=4 5837 B12R1.252 CC(O)CCSC1CCCCC1 62a_100012276601_100000210327 [0,0,0,0,0,2|1,0,1]=4 5838 B12R1.252 CC(O)CNCC1CCCCC1 2230a_100000210473_100011218427 [0,0,0,0,0,2|1,0,1]=4 5839 B12R1.252 CC(O)CNCC1CCCCC1 2230a_100000210904_100000211423 [0,0,0,0,0,2|1,0,1]=4 5840 B12R1.252 CC(O)CNCC1CCCCC1 269862a_100000210904_100000211278 [0,0,0,0,0,2|1,0,1]=4 5841 B12R1.252 CC(O)CNCC1CCCCC1 34a_100000210473_100011218427 [0,0,0,0,0,2|1,0,1]=4 5842 B12R1.252 CC(O)CNCC1CCCCC1 34a_100000210904_100000211423 [0,0,0,0,0,2|1,0,1]=4 5843 B12R1.252 CC(O)COCC1CCCCC1 34a_100000212181_100011218427 [0,0,0,0,0,2|1,0,1]=4 5844 B12R1.252 CC(O)COCC1CCCCC1 7a_100000212181_100011218427 [0,0,0,0,0,2|1,0,1]=4 5845 B12R1.252 CC(O)CSCC1CCCCC1 62a_100000211423_100011218427 [0,0,0,0,0,2|1,0,1]=4 5846 B12R1.252 CC(O)CSCC1CCCCC1 62a_100011218427_100000211423 [0,0,0,0,0,2|1,0,1]=4 5847 B12R1.252 C[C@@H](O)CNCC1CCCCC1 2230a_100000210473_100009817552 [0,0,0,0,0,2|1,0,1]=4 5848 B12R1.252 C[C@@H](O)CNCC1CCCCC1 34a_100000210473_100009817552 [0,0,0,0,0,2|1,0,1]=4 5849 B12R1.252 C[C@@H](O)COCC1CCCCC1 34a_100000212181_100009817552 [0,0,0,0,0,2|1,0,1]=4 5850 B12R1.252 C[C@@H](O)COCC1CCCCC1 7a_100000212181_100009817552 [0,0,0,0,0,2|1,0,1]=4 5851 B12R1.252 C[C@@H](O)CSCC1CCCCC1 62a_100000211423_100009817552 [0,0,0,0,0,2|1,0,1]=4 5852 B12R1.252 C[C@@H](O)CSCC1CCCCC1 62a_100009817552_100000211423 [0,0,0,0,0,2|1,0,1]=4 5853 B12R1.252 NC(=O)CCNC1CCCCC1 2230a_100000182618_100000744528 [0,0,0,0,0,2|1,0,0]=3 5854 B12R1.252 NC(=O)CCNC1CCCCC1 34a_100000182618_100000731001 [0,0,0,0,0,2|1,0,0]=3 5855 B12R1.252 NC(=O)CCNC1CCCOC1 2230a_100000719290_100000744528 [0,0,0,0,0,2|2,0,0]=4 5856 B12R1.252 NC(=O)CCNC1CCCOC1 34a_100000719290_100000731001 [0,0,0,0,0,2|2,0,0]=4 5857 B12R1.252 NC(=O)CCNC1CCOCC1 2230a_100000741149_100000744528 [0,0,0,0,0,2|2,0,0]=4 5858 B12R1.252 NC(=O)CCNC1CCOCC1 34a_100000741149_100000731001 [0,0,0,0,0,2|2,0,0]=4 5859 B12R1.252 NC(=O)CCNC1CCSCC1 2230a_100000748639_100000744528 [0,0,0,0,0,2|2,0,0]=4 5860 B12R1.252 NC(=O)CCNC1CCSCC1 34a_100000748639_100000731001 [0,0,0,0,0,2|2,0,0]=4 5861 B12R1.252 NC(=O)CCOC1CCCCC1 34a_100000210231_100000731001 [0,0,0,0,0,2|1,0,0]=3 5862 B12R1.252 NC(=O)CCOC1CCCCC1 34a_100000757172_100000210327 [0,0,0,0,0,2|1,0,0]=3 5863 B12R1.252 NC(=O)CCOC1CCCCC1 7a_100000210231_100000744528 [0,0,0,0,0,2|1,0,0]=3 5864 B12R1.252 NC(=O)CCOC1CCCCC1 7a_100000757172_100000210327 [0,0,0,0,0,2|1,0,0]=3 5865 B12R1.252 NC(=O)CCOC1CCCCO1 34a_100000033831_100000731001 [0,0,0,0,0,2|2,0,0]=4 5866 B12R1.252 NC(=O)CCOC1CCCOC1 34a_100000754041_100000731001 [0,0,0,0,0,2|2,0,0]=4 5867 B12R1.252 NC(=O)CCOC1CCCOC1 34a_100000757172_100000693364 [0,0,0,0,0,2|2,0,0]=4 5868 B12R1.252 NC(=O)CCOC1CCCOC1 7a_100000757172_100000693364 [0,0,0,0,0,2|2,0,0]=4 5869 B12R1.252 NC(=O)CCOC1CCCSC1 7a_100015962668_100000744528 [0,0,0,0,0,2|2,0,0]=4 5870 B12R1.252 NC(=O)CCOC1CCOCC1 34a_100000744328_100000731001 [0,0,0,0,0,2|2,0,0]=4 5871 B12R1.252 NC(=O)CCOC1CCOCC1 7a_100000757172_100000686592 [0,0,0,0,0,2|2,0,0]=4 5872 B12R1.252 NC(=O)CCOC1CCSCC1 34a_100000731022_100000731001 [0,0,0,0,0,2|2,0,0]=4 5873 B12R1.252 NC(=O)CCOC1CCSCC1 34a_100000757172_100000069128 [0,0,0,0,0,2|2,0,0]=4 5874 B12R1.252 NC(=O)CCOC1CCSCC1 7a_100000731022_100000744528 [0,0,0,0,0,2|2,0,0]=4 5875 B12R1.252 NC(=O)CCOC1CCSCC1 7a_100000757172_100011500858 [0,0,0,0,0,2|2,0,0]=4 5876 B12R1.252 NC(=O)CCSC1CCCCC1 62a_100000210327_100000744528 [0,0,0,0,0,2|1,0,0]=3 5877 B12R1.252 NC(=O)CCSC1CCCCC1 62a_100000744528_100000210327 [0,0,0,0,0,2|1,0,0]=3 5878 B12R1.252 NC(=O)CCSC1CCCOC1 62a_100000744528_100000693364 [0,0,0,0,0,2|2,0,0]=4 5879 B12R1.252 NC(=O)CCSC1CCOCC1 62a_100000744528_100011324220 [0,0,0,0,0,2|2,0,0]=4 5880 B12R1.252 NC(=O)CCSC1CCSCC1 62a_100000744528_100000069128 [0,0,0,0,0,2|2,0,0]=4 5881 B12R1.252 NC(=O)CNCC1CCCCC1 2230a_100000210473_100000747473 [0,0,0,0,0,2|1,0,0]=3 5882 B12R1.252 NC(=O)CNCC1CCCCC1 2230a_100000711301_100000211423 [0,0,0,0,0,2|1,0,0]=3 5883 B12R1.252 NC(=O)CNCC1CCCCC1 34a_100000210473_100000187820 [0,0,0,0,0,2|1,0,0]=3 5884 B12R1.252 NC(=O)CNCC1CCCCO1 2230a_100000174945_100000747473 [0,0,0,0,0,2|2,0,0]=4 5885 B12R1.252 NC(=O)CNCC1CCCCO1 2230a_100000711301_100000211543 [0,0,0,0,0,2|2,0,0]=4 5886 B12R1.252 NC(=O)CNCC1CCCCO1 34a_100000174945_100000187820 [0,0,0,0,0,2|2,0,0]=4 5887 B12R1.252 NC(=O)CNCC1CCCOC1 2230a_100000711301_100000741521 [0,0,0,0,0,2|2,0,0]=4 5888 B12R1.252 NC(=O)CNCC1CCCOC1 2230a_100000720124_100000747473 [0,0,0,0,0,2|2,0,0]=4 5889 B12R1.252 NC(=O)CNCC1CCCOC1 34a_100000720124_100000187820 [0,0,0,0,0,2|2,0,0]=4 5890 B12R1.252 NC(=O)CNCC1CCOCC1 2230a_100000711301_100000754603 [0,0,0,0,0,2|2,0,0]=4 5891 B12R1.252 NC(=O)CNCC1CCOCC1 2230a_100000746373_100000747473 [0,0,0,0,0,2|2,0,0]=4 5892 B12R1.252 NC(=O)CNCC1CCOCC1 34a_100000746373_100000187820 [0,0,0,0,0,2|2,0,0]=4 5893 B12R1.252 NC(=O)CNCC1CCSCC1 2230a_100015188806_100000747473 [0,0,0,0,0,2|2,0,0]=4 5894 B12R1.252 NC(=O)CNCC1CCSCC1 34a_100015188806_100000187820 [0,0,0,0,0,2|2,0,0]=4 5895 B12R1.252 NC(=O)COCC1CCCCC1 34a_100000212181_100000187820 [0,0,0,0,0,2|1,0,0]=3 5896 B12R1.252 NC(=O)COCC1CCCCC1 7a_100000212181_100000187820 [0,0,0,0,0,2|1,0,0]=3 5897 B12R1.252 NC(=O)COCC1CCCCN1 34a_100000210821_100000187820 [0,0,0,0,0,2|2,0,0]=4 5898 B12R1.252 NC(=O)COCC1CCCCO1 34a_100000211370_100000187820 [0,0,0,0,0,2|2,0,0]=4 5899 B12R1.252 NC(=O)COCC1CCCCO1 7a_100000211370_100000187820 [0,0,0,0,0,2|2,0,0]=4 5900 B12R1.252 NC(=O)COCC1CCCNC1 34a_100000211344_100000187820 [0,0,0,0,0,2|2,0,0]=4 5901 B12R1.252 NC(=O)COCC1CCCOC1 34a_100000741520_100000187820 [0,0,0,0,0,2|2,0,0]=4 5902 B12R1.252 NC(=O)COCC1CCNCC1 34a_100000738675_100000187820 [0,0,0,0,0,2|2,0,0]=4 5903 B12R1.252 NC(=O)COCC1CCOCC1 34a_100000749013_100000187820 [0,0,0,0,0,2|2,0,0]=4 5904 B12R1.252 NC(=O)COCC1CCSCC1 34a_100000070558_100000187820 [0,0,0,0,0,2|2,0,0]=4 5905 B12R1.252 NC(=O)COCC1CCSCC1 7a_100000070558_100000187820 [0,0,0,0,0,2|2,0,0]=4 5906 B12R1.252 NC(=O)CSCC1CCCCC1 62a_100000211423_100000747473 [0,0,0,0,0,2|1,0,0]=3 5907 B12R1.252 NC(=O)CSCC1CCCCC1 62a_100000747473_100000211423 [0,0,0,0,0,2|1,0,0]=3 5908 B12R1.252 NC(=O)CSCC1CCCCO1 62a_100000211543_100000747473 [0,0,0,0,0,2|2,0,0]=4 5909 B12R1.252 NC(=O)CSCC1CCCCO1 62a_100000747473_100000211543 [0,0,0,0,0,2|2,0,0]=4 5910 B12R1.252 NC(=O)CSCC1CCCOC1 62a_100000741521_100000747473 [0,0,0,0,0,2|2,0,0]=4 5911 B12R1.252 NC(=O)CSCC1CCCOC1 62a_100000747473_100000741521 [0,0,0,0,0,2|2,0,0]=4 5912 B12R1.252 NC(=O)CSCC1CCOCC1 62a_100000747473_100000749018 [0,0,0,0,0,2|2,0,0]=4 5913 B12R1.252 NC(=O)CSCC1CCOCC1 62a_100000754603_100000747473 [0,0,0,0,0,2|2,0,0]=4 5914 B12R1.252 O=C(O)CNCC1CCCCC1 269956a_100016091260_100000211423 [0,0,0,0,0,2|0,0,0]=2 5915 B12R1.252 O=C(O)CNCC1CCCCO1 269956a_100016091260_100000211543 [0,0,0,0,0,2|1,0,0]=3 5916 B12R1.252 O=C(O)CNCC1CCCOC1 269956a_100016091260_100000741521 [0,0,0,0,0,2|1,0,0]=3 5917 B12R1.252 O=C(O)CNCC1CCOCC1 269956a_100016091260_100000754603 [0,0,0,0,0,2|1,0,0]=3 5918 B12R1.252 O=C(O)CONC1C=CCCC1 269956a_100000106656_100000751183 [0,0,0,0,0,2|0,0,2]=4 5919 B12R1.252 O=C(O)CONC1CCCCC1 269956a_100000106656_100000210327 [0,0,0,0,0,2|0,0,0]=2 5920 B12R1.252 O=C(O)CONC1CCCOC1 269956a_100000106656_100000693364 [0,0,0,0,0,2|1,0,0]=3 5921 B12R1.252 O=C(O)CONC1CCOCC1 269956a_100000106656_100011324220 [0,0,0,0,0,2|1,0,0]=3 5922 B12R1.252 O=C(O)CONC1CCSCC1 269956a_100000106656_100000069128 [0,0,0,0,0,2|1,0,0]=3 5923 B12R1.252 O=C([O-])CNCC1CCCCC1 34a_100000210473_100020667443 [0,0,0,0,0,2|0,0,1]=3 5924 B12R1.252 O=C([O-])CNCC1CCCCO1 34a_100000174945_100020667443 [0,0,0,0,0,2|1,0,1]=4 5925 B12R1.252 O=C([O-])CNCC1CCCOC1 34a_100000720124_100020667443 [0,0,0,0,0,2|1,0,1]=4 5926 B12R1.252 O=C([O-])CNCC1CCOCC1 34a_100000746373_100020667443 [0,0,0,0,0,2|1,0,1]=4 5927 B12R1.252 O=C([O-])CNCC1CCSCC1 34a_100015188806_100020667443 [0,0,0,0,0,2|1,0,1]=4 5928 B12R1.252 O=C([O-])COCC1CCCCC1 34a_100000212181_100020667443 [0,0,0,0,0,2|0,0,1]=3 5929 B12R1.252 O=C([O-])COCC1CCCCN1 34a_100000210821_100020667443 [0,0,0,0,0,2|1,0,1]=4 5930 B12R1.252 O=C([O-])COCC1CCCCO1 34a_100000211370_100020667443 [0,0,0,0,0,2|1,0,1]=4 5931 B12R1.252 O=C([O-])COCC1CCCNC1 34a_100000211344_100020667443 [0,0,0,0,0,2|1,0,1]=4 5932 B12R1.252 O=C([O-])COCC1CCCOC1 34a_100000741520_100020667443 [0,0,0,0,0,2|1,0,1]=4 5933 B12R1.252 O=C([O-])COCC1CCNCC1 34a_100000738675_100020667443 [0,0,0,0,0,2|1,0,1]=4 5934 B12R1.252 O=C([O-])COCC1CCOCC1 34a_100000749013_100020667443 [0,0,0,0,0,2|1,0,1]=4 5935 B12R1.252 O=C([O-])COCC1CCSCC1 34a_100000070558_100020667443 [0,0,0,0,0,2|1,0,1]=4 5936 B12R1.252 O=C([O-])CSCC1CCCCC1 62a_100000211423_100020667443 [0,0,0,0,0,2|0,0,1]=3 5937 B12R1.252 O=C([O-])CSCC1CCCCC1 62a_100020667443_100000211423 [0,0,0,0,0,2|0,0,1]=3 5938 B12R1.252 O=C([O-])CSCC1CCCCO1 62a_100000211543_100020667443 [0,0,0,0,0,2|1,0,1]=4 5939 B12R1.252 O=C([O-])CSCC1CCCCO1 62a_100020667443_100000211543 [0,0,0,0,0,2|1,0,1]=4 5940 B12R1.252 O=C([O-])CSCC1CCCOC1 62a_100000741521_100020667443 [0,0,0,0,0,2|1,0,1]=4 5941 B12R1.252 O=C([O-])CSCC1CCCOC1 62a_100020667443_100000741521 [0,0,0,0,0,2|1,0,1]=4 5942 B12R1.252 O=C([O-])CSCC1CCOCC1 62a_100000754603_100020667443 [0,0,0,0,0,2|1,0,1]=4 5943 B12R1.252 O=C([O-])CSCC1CCOCC1 62a_100020667443_100000749018 [0,0,0,0,0,2|1,0,1]=4 5944 B12R1.252 O=[N+]([O-])CNCC1CCCCC1 34a_100000210473_100000761209 [0,0,0,0,0,2|1,0,1]=4 5945 B12R1.252 O=[N+]([O-])COCC1CCCCC1 34a_100000212181_100000761209 [0,0,0,0,0,2|1,0,1]=4 5946 B12R1.252 O=[N+]([O-])CSCC1CCCCC1 62a_100000211423_100000761209 [0,0,0,0,0,2|1,0,1]=4 5947 B12R1.252 [13CH3]C(=O)C=CCN1CCCCC1 1458a_100015232380_200025704644 [0,0,0,0,0,2|2,0,0]=4 5948 B12R1.252 [13CH3]C(=O)CCCC1CCCCC1 1458a_100000211478_200025704644 [0,0,0,0,0,2|1,0,0]=3 5949 B12R1.252 [13CH3]C(=O)CCCN1CCCCC1 1458a_100000742516_200025704644 [0,0,0,0,0,2|2,0,0]=4 5950 B12R1.252 [13CH3]C(=O)COCC1CCCCO1 1458a_100011223378_200025704644 [0,0,0,0,0,2|2,0,0]=4 5951 B12R1.1343 C=C(C)CNC1CCCCCC1 2230a_100000210984_100000748629 [0,0,0,0,0,2|2,0,0]=4 5952 B12R1.1343 C=C(C)CNC1CCCCCC1 34a_100000210984_100000748629 [0,0,0,0,0,2|2,0,0]=4 5953 B12R1.1343 C=C(C)COC1CCCCCC1 34a_100000210245_100011217769 [0,0,0,0,0,2|2,0,0]=4 5954 B12R1.1343 C=C(C)COC1CCCCCC1 34a_100000210887_100000748629 [0,0,0,0,0,2|2,0,0]=4 5955 B12R1.1343 C=C(C)COC1CCCCCC1 7a_100000210887_100000748629 [0,0,0,0,0,2|2,0,0]=4 5956 B12R1.1343 C=C(C)CSC1CCCCCC1 62a_100000748629_100011217769 [0,0,0,0,0,2|2,0,0]=4 5957 B12R1.1343 C=C(C)CSC1CCCCCC1 62a_100011217769_100000211660 [0,0,0,0,0,2|2,0,0]=4 5958 B12R1.1343 C=C(F)CNC1CCCCCC1 2230a_100000210984_100009893438 [0,0,0,0,0,2|2,0,0]=4 5959 B12R1.1343 C=C(F)CNC1CCCCCC1 34a_100000210984_100009893438 [0,0,0,0,0,2|2,0,0]=4 5960 B12R1.1343 C=C(F)COC1CCCCCC1 34a_100000210887_100009893438 [0,0,0,0,0,2|2,0,0]=4 5961 B12R1.1343 C=C(F)COC1CCCCCC1 34a_200010262243_100011217769 [0,0,0,0,0,2|2,0,0]=4 5962 B12R1.1343 C=C(F)COC1CCCCCC1 7a_100000210887_100000042424 [0,0,0,0,0,2|2,0,0]=4 5963 B12R1.1343 C=C(F)CSC1CCCCCC1 62a_100000042424_100011217769 [0,0,0,0,0,2|2,0,0]=4 5964 B12R1.1343 C=C(F)CSC1CCCCCC1 62a_100011217769_100000042424 [0,0,0,0,0,2|2,0,0]=4 5965 B12R1.1343 CC(=O)CCN1CCCCCC1 1458a_100000070787_100000722644 [0,0,0,0,0,2|2,0,0]=4 5966 B12R1.1343 CC(=O)CCN1CCCCCC1 1458a_100000740320_200000210301 [0,0,0,0,0,2|2,0,0]=4 5967 B12R1.1343 CC(=O)CCN1CCCCCC1 269982a_100000185865_100000053229 [0,0,0,0,0,2|2,0,0]=4 5968 B12R1.1343 CC(=O)CCN1CCCOCC1 269982a_100000685342_100000053229 [0,0,0,0,0,2|2,0,0]=4 5969 B12R1.1343 CC(=O)CNC1=NCCCCC1 1458a_100000016077_200000210301 [0,0,0,0,0,2|1,0,1]=4 5970 B12R1.1343 CC(=O)COC1CCCCCC1 34a_100000211253_100011217769 [0,0,0,0,0,2|1,0,0]=3 5971 B12R1.1343 CC(=O)NCC1CCCCCC1 11a_100015204231_100015343762 [0,0,0,0,0,2|1,0,0]=3 5972 B12R1.1343 CC(=O)NCC1CCCCCC1 1626a_100015204231_100015343762 [0,0,0,0,0,2|1,0,0]=3 5973 B12R1.1343 CC(=O)NCC1CCCCCC1 240690a_100015204231_100015343762 [0,0,0,0,0,2|1,0,0]=3 5974 B12R1.1343 CC(=O)NCC1CCCCCC1 527a_100015204231_100103153847 [0,0,0,0,0,2|1,0,0]=3 5975 B12R1.1343 CC(=O)OCN1CCCCCC1 269982a_100000185865_100000076356 [0,0,0,0,0,2|2,0,0]=4 5976 B12R1.1343 CC(=O)OCN1CCCCCC1 34a_100000185865_100009813279 [0,0,0,0,0,2|2,0,0]=4 5977 B12R1.1343 CC(=O)OCN1CCCOCC1 269982a_100000685342_100000076356 [0,0,0,0,0,2|2,0,0]=4 5978 B12R1.1343 CC(=O)OCN1CCCOCC1 34a_100000685342_100009813279 [0,0,0,0,0,2|2,0,0]=4 5979 B12R1.1343 CC(O)CNC1CCCCCC1 2230a_100000210984_100011218427 [0,0,0,0,0,2|1,0,1]=4 5980 B12R1.1343 CC(O)CNC1CCCCCC1 270004a_100000210904_100000210131 [0,0,0,0,0,2|1,0,1]=4 5981 B12R1.1343 CC(O)CNC1CCCCCC1 34a_100000210904_100011217769 [0,0,0,0,0,2|1,0,1]=4 5982 B12R1.1343 CC(O)CNC1CCCCCC1 34a_100000210984_100011218427 [0,0,0,0,0,2|1,0,1]=4 5983 B12R1.1343 CC(O)CNC1CCCNCC1 270004a_100000210904_100015187895 [0,0,0,0,0,2|1,0,1]=4 5984 B12R1.1343 CC(O)COC1CCCCCC1 34a_100000210887_100011218427 [0,0,0,0,0,2|1,0,1]=4 5985 B12R1.1343 CC(O)COC1CCCCCC1 7a_100000210887_100011218427 [0,0,0,0,0,2|1,0,1]=4 5986 B12R1.1343 CC(O)CSC1CCCCCC1 62a_100011217769_100011218427 [0,0,0,0,0,2|1,0,1]=4 5987 B12R1.1343 CC(O)CSC1CCCCCC1 62a_100011218427_100011217769 [0,0,0,0,0,2|1,0,1]=4 5988 B12R1.1343 C[C@@H](O)CNC1CCCCCC1 2230a_100000210984_100009817552 [0,0,0,0,0,2|1,0,1]=4 5989 B12R1.1343 C[C@@H](O)CNC1CCCCCC1 34a_100000210984_100009817552 [0,0,0,0,0,2|1,0,1]=4 5990 B12R1.1343 C[C@@H](O)COC1CCCCCC1 34a_100000210887_100009817552 [0,0,0,0,0,2|1,0,1]=4 5991 B12R1.1343 C[C@@H](O)COC1CCCCCC1 7a_100000210887_100009817552 [0,0,0,0,0,2|1,0,1]=4 5992 B12R1.1343 C[C@@H](O)CSC1CCCCCC1 62a_100009817552_100011217769 [0,0,0,0,0,2|1,0,1]=4 5993 B12R1.1343 C[C@@H](O)CSC1CCCCCC1 62a_100011217769_100009817552 [0,0,0,0,0,2|1,0,1]=4 5994 B12R1.1343 NC(=O)CCN1CCCCCC1 2230a_100000185865_100000744528 [0,0,0,0,0,2|2,0,0]=4 5995 B12R1.1343 NC(=O)CCN1CCCCCC1 269982a_100000185865_100000744528 [0,0,0,0,0,2|2,0,0]=4 5996 B12R1.1343 NC(=O)CCN1CCCCCC1 34a_100000185865_100000731001 [0,0,0,0,0,2|2,0,0]=4 5997 B12R1.1343 NC(=O)CCN1CCCOCC1 2230a_100000685342_100000744528 [0,0,0,0,0,2|2,0,0]=4 5998 B12R1.1343 NC(=O)CCN1CCCOCC1 269982a_100000685342_100000744528 [0,0,0,0,0,2|2,0,0]=4 5999 B12R1.1343 NC(=O)CCN1CCCOCC1 34a_100000685342_100000731001 [0,0,0,0,0,2|2,0,0]=4 6000 B12R1.1343 NC(=O)CNC1CCCCCC1 2230a_100000210984_100000747473 [0,0,0,0,0,2|1,0,0]=3 6001 B12R1.1343 NC(=O)CNC1CCCCCC1 34a_100000210984_100000187820 [0,0,0,0,0,2|1,0,0]=3 6002 B12R1.1343 NC(=O)COC1CCCCCC1 34a_100000210887_100000187820 [0,0,0,0,0,2|1,0,0]=3 6003 B12R1.1343 NC(=O)COC1CCCCCC1 7a_100000210887_100000187820 [0,0,0,0,0,2|1,0,0]=3 6004 B12R1.1343 NC(=O)CSC1CCCCCC1 62a_100000747473_100011217769 [0,0,0,0,0,2|1,0,0]=3 6005 B12R1.1343 NC(=O)CSC1CCCCCC1 62a_100011217769_100000747473 [0,0,0,0,0,2|1,0,0]=3 6006 B12R1.1343 O=C(O)CNC1CCCCCC1 269956a_100016091260_100011217769 [0,0,0,0,0,2|0,0,0]=2 6007 B12R1.1343 O=C([O-])CNC1CCCCCC1 34a_100000210984_100020667443 [0,0,0,0,0,2|0,0,1]=3 6008 B12R1.1343 O=C([O-])COC1CCCCCC1 34a_100000210887_100020667443 [0,0,0,0,0,2|0,0,1]=3 6009 B12R1.1343 O=C([O-])CSC1CCCCCC1 62a_100011217769_100020667443 [0,0,0,0,0,2|0,0,1]=3 6010 B12R1.1343 O=C([O-])CSC1CCCCCC1 62a_100020667443_100011217769 [0,0,0,0,0,2|0,0,1]=3 6011 B12R1.1343 O=[N+]([O-])CNC1CCCCCC1 34a_100000210984_100000761209 [0,0,0,0,0,2|1,0,1]=4 6012 B12R1.1343 O=[N+]([O-])COC1CCCCCC1 34a_100000210887_100000761209 [0,0,0,0,0,2|1,0,1]=4 6013 B12R1.1343 O=[N+]([O-])CSC1CCCCCC1 62a_100011217769_100000761209 [0,0,0,0,0,2|1,0,1]=4 6014 B12R1.1343 [13CH3]C(=O)CCN1CCCCCC1 1458a_100000740320_200025704644 [0,0,0,0,0,2|2,0,0]=4 6015 B12R1.1343 [13CH3]C(=O)CNC1=NCCCCC1 1458a_100000016077_200025704644 [0,0,0,0,0,2|1,0,1]=4 6016 B12R1.1392 CC(=O)NC1CCCCCCC1 11a_100000211152_100015343762 [0,0,0,0,0,2|2,0,0]=4 6017 B12R1.1392 CC(=O)NC1CCCCCCC1 1626a_100000211152_100015343762 [0,0,0,0,0,2|2,0,0]=4 6018 B12R1.1392 CC(=O)NC1CCCCCCC1 240690a_100000211152_100015343762 [0,0,0,0,0,2|2,0,0]=4 6019 B12R1.1392 CC(=O)NC1CCCCCCC1 527a_100000211152_100103153847 [0,0,0,0,0,2|2,0,0]=4 6020 B12R1.1392 NC(=O)CN1CCCCCCC1 2230a_100000211400_100000747473 [0,0,0,0,0,2|2,0,0]=4 6021 B12R1.1392 NC(=O)CN1CCCCCCC1 269982a_100000211400_100000187820 [0,0,0,0,0,2|2,0,0]=4 6022 B12R1.1392 NC(=O)CN1CCCCCCC1 34a_100000211400_100000187820 [0,0,0,0,0,2|2,0,0]=4 6023 B12R1.1392 O=C([O-])CN1CCCCCCC1 269982a_100000211400_100020667443 [0,0,0,0,0,2|1,0,1]=4 6024 B12R1.1392 O=C([O-])CN1CCCCCCC1 34a_100000211400_100020667443 [0,0,0,0,0,2|1,0,1]=4