0 B12R1.7 C#CCCCNC1COC(=O)O1 34a_100000718082_100000032252 [0,0,0,0,0,0|2,0,2]=4 1 B12R1.7 C#CCCCOC1CCC(=O)C1 34a_100012614533_100000695029 [0,0,0,0,0,0|2,0,2]=4 2 B12R1.7 C#CCCCOC1COC(=O)O1 34a_100000215630_100000032252 [0,0,0,0,0,0|2,0,2]=4 3 B12R1.7 C#CCCCSC1COC(=O)O1 62a_100011215417_100000032252 [0,0,0,0,0,0|2,0,2]=4 4 B12R1.7 C#CCCNCC1CNC(=O)O1 34a_100000755551_100000181169 [0,0,0,0,0,0|2,0,2]=4 5 B12R1.7 C#CCCNCC1COC(=O)O1 34a_100000755551_100000073702 [0,0,0,0,0,0|2,0,2]=4 6 B12R1.7 C#CCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000688953 [0,0,0,0,0,0|2,0,2]=4 7 B12R1.7 C#CCCNC[C@H]1CCC(=O)N1 34a_100015423886_100000688953 [0,0,0,0,0,0|2,0,2]=4 8 B12R1.7 C#CCCOCC1CCC(=O)N1 34a_100000737831_100000688953 [0,0,0,0,0,0|2,0,2]=4 9 B12R1.7 C#CCCOCC1CNC(=O)O1 34a_100011215631_100000181169 [0,0,0,0,0,0|2,0,2]=4 10 B12R1.7 C#CCCOCC1CNC(=O)O1 34a_100011315639_100000688953 [0,0,0,0,0,0|2,0,2]=4 11 B12R1.7 C#CCCOCC1COC(=O)O1 34a_100011215631_100000073702 [0,0,0,0,0,0|2,0,2]=4 12 B12R1.7 C#CCCSCC1CNC(=O)O1 62a_100000181169_100000688953 [0,0,0,0,0,0|2,0,2]=4 13 B12R1.7 C#CCCSCC1CNC(=O)O1 62a_100000688953_100000181169 [0,0,0,0,0,0|2,0,2]=4 14 B12R1.7 C#CCCSCC1COC(=O)O1 62a_100000073702_100000688953 [0,0,0,0,0,0|2,0,2]=4 15 B12R1.7 C#CCCSCC1COC(=O)O1 62a_100000688953_100000073702 [0,0,0,0,0,0|2,0,2]=4 16 B12R1.7 C#CCCSC[C@@H]1CCC(=O)N1 62a_100000688953_100015189358 [0,0,0,0,0,0|2,0,2]=4 17 B12R1.7 C#CCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000688953 [0,0,0,0,0,0|2,0,2]=4 18 B12R1.7 C/C=C/CCOC1COC(=O)O1 34a_100016278192_100000032252 [0,0,0,0,0,0|2,0,2]=4 19 B12R1.7 C/C=C/CNC[C@H]1CCC(=O)N1 34a_100015423886_100102629194 [0,0,0,0,0,0|2,0,2]=4 20 B12R1.7 C/C=C/COCC1CCC(=O)N1 34a_100000737831_100102629194 [0,0,0,0,0,0|2,0,2]=4 21 B12R1.7 C/C=C/COCC1CNC(=O)O1 34a_100011315639_100102629194 [0,0,0,0,0,0|2,0,2]=4 22 B12R1.7 C/C=C/COCC1CNC(=O)O1 34a_100016270725_100000181169 [0,0,0,0,0,0|2,0,2]=4 23 B12R1.7 C/C=C/COCC1COC(=O)O1 34a_100016270725_100000073702 [0,0,0,0,0,0|2,0,2]=4 24 B12R1.7 C/C=C/CSCC1CNC(=O)O1 62a_100000181169_100102629194 [0,0,0,0,0,0|2,0,2]=4 25 B12R1.7 C/C=C/CSCC1CNC(=O)O1 62a_100102629194_100000181169 [0,0,0,0,0,0|2,0,2]=4 26 B12R1.7 C/C=C/CSCC1COC(=O)O1 62a_100000073702_100102629194 [0,0,0,0,0,0|2,0,2]=4 27 B12R1.7 C/C=C/CSCC1COC(=O)O1 62a_100102629194_100000073702 [0,0,0,0,0,0|2,0,2]=4 28 B12R1.7 C/C=C/CSC[C@@H]1CCC(=O)N1 62a_100015189358_100102629194 [0,0,0,0,0,0|2,0,2]=4 29 B12R1.7 C/C=C/CSC[C@@H]1CCC(=O)N1 62a_100102629194_100015189358 [0,0,0,0,0,0|2,0,2]=4 30 B12R1.7 C=CCCCNC1COC(=O)O1 34a_100000700776_100000032252 [0,0,0,0,0,0|2,0,2]=4 31 B12R1.7 C=CCCCOC1CCC(=O)C1 34a_100012614533_100000757094 [0,0,0,0,0,0|2,0,2]=4 32 B12R1.7 C=CCCCOC1COC(=O)O1 34a_100000758997_100000032252 [0,0,0,0,0,0|2,0,2]=4 33 B12R1.7 C=CCCCSC1COC(=O)O1 62a_100011713584_100000032252 [0,0,0,0,0,0|2,0,2]=4 34 B12R1.7 C=CCCNCC1CNC(=O)O1 2230a_100015191253_100000181169 [0,0,0,0,0,0|2,0,2]=4 35 B12R1.7 C=CCCNC[C@@H]1CCC(=O)N1 2230a_100015191253_100015189358 [0,0,0,0,0,0|2,0,2]=4 36 B12R1.7 C=CCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000754431 [0,0,0,0,0,0|2,0,2]=4 37 B12R1.7 C=CCCNC[C@H]1CCC(=O)N1 34a_100015423886_100000754431 [0,0,0,0,0,0|2,0,2]=4 38 B12R1.7 C=CCCOCC1CCC(=O)N1 34a_100000737831_100000754431 [0,0,0,0,0,0|2,0,2]=4 39 B12R1.7 C=CCCOCC1CNC(=O)O1 34a_100011205117_100000181169 [0,0,0,0,0,0|2,0,2]=4 40 B12R1.7 C=CCCOCC1CNC(=O)O1 34a_100011315639_100000754431 [0,0,0,0,0,0|2,0,2]=4 41 B12R1.7 C=CCCOCC1COC(=O)O1 34a_100011205117_100000073702 [0,0,0,0,0,0|2,0,2]=4 42 B12R1.7 C=CCCSCC1CNC(=O)O1 62a_100000181169_100000754431 [0,0,0,0,0,0|2,0,2]=4 43 B12R1.7 C=CCCSCC1CNC(=O)O1 62a_100000754431_100000181169 [0,0,0,0,0,0|2,0,2]=4 44 B12R1.7 C=CCCSCC1COC(=O)O1 62a_100000073702_100000754431 [0,0,0,0,0,0|2,0,2]=4 45 B12R1.7 C=CCCSCC1COC(=O)O1 62a_100000754431_100000073702 [0,0,0,0,0,0|2,0,2]=4 46 B12R1.7 C=CCCSC[C@@H]1CCC(=O)N1 62a_100000754431_100015189358 [0,0,0,0,0,0|2,0,2]=4 47 B12R1.7 C=CCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000754431 [0,0,0,0,0,0|2,0,2]=4 48 B12R1.7 CC#CCCOC1COC(=O)O1 34a_100000750427_100000032252 [0,0,0,0,0,0|2,0,2]=4 49 B12R1.7 CC#CCNCC1CNC(=O)O1 2230a_100000685387_100000181169 [0,0,0,0,0,0|2,0,2]=4 50 B12R1.7 CC#CCNCC1CNC(=O)O1 34a_100000685387_100000181169 [0,0,0,0,0,0|2,0,2]=4 51 B12R1.7 CC#CCNCC1COC(=O)O1 34a_100000685387_100000073702 [0,0,0,0,0,0|2,0,2]=4 52 B12R1.7 CC#CCNC[C@@H]1CCC(=O)N1 2230a_100000685387_100015189358 [0,0,0,0,0,0|2,0,2]=4 53 B12R1.7 CC#CCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000748600 [0,0,0,0,0,0|2,0,2]=4 54 B12R1.7 CC#CCNC[C@H]1CCC(=O)N1 34a_100015423886_100000748600 [0,0,0,0,0,0|2,0,2]=4 55 B12R1.7 CC#CCOCC1CCC(=O)N1 34a_100000737831_100000748600 [0,0,0,0,0,0|2,0,2]=4 56 B12R1.7 CC#CCOCC1CNC(=O)O1 34a_100000761923_100000181169 [0,0,0,0,0,0|2,0,2]=4 57 B12R1.7 CC#CCOCC1CNC(=O)O1 34a_100011315639_100000748600 [0,0,0,0,0,0|2,0,2]=4 58 B12R1.7 CC#CCOCC1COC(=O)O1 34a_100000761923_100000073702 [0,0,0,0,0,0|2,0,2]=4 59 B12R1.7 CC#CCSCC1CNC(=O)O1 62a_100000181169_100000748600 [0,0,0,0,0,0|2,0,2]=4 60 B12R1.7 CC#CCSCC1CNC(=O)O1 62a_100000748600_100000181169 [0,0,0,0,0,0|2,0,2]=4 61 B12R1.7 CC#CCSCC1COC(=O)O1 62a_100000073702_100000748600 [0,0,0,0,0,0|2,0,2]=4 62 B12R1.7 CC#CCSCC1COC(=O)O1 62a_100000748600_100000073702 [0,0,0,0,0,0|2,0,2]=4 63 B12R1.7 CC#CCSC[C@@H]1CCC(=O)N1 62a_100000748600_100015189358 [0,0,0,0,0,0|2,0,2]=4 64 B12R1.7 CC#CCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000748600 [0,0,0,0,0,0|2,0,2]=4 65 B12R1.7 CC/C=C\COC1CCC(=O)C1 34a_100012614533_100103147603 [0,0,0,0,0,0|2,0,2]=4 66 B12R1.7 CC/C=C\COC1COC(=O)O1 34a_100016268518_100000032252 [0,0,0,0,0,0|2,0,2]=4 67 B12R1.7 CC/C=C\CSC1COC(=O)O1 62a_100103147603_100000032252 [0,0,0,0,0,0|2,0,2]=4 68 B12R1.7 CC=CCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000070051 [0,0,0,0,0,0|2,0,2]=4 69 B12R1.7 CC=CCNC[C@H]1CCC(=O)N1 34a_100015423886_100000070051 [0,0,0,0,0,0|2,0,2]=4 70 B12R1.7 CC=CCOCC1CCC(=O)N1 34a_100000737831_100000070051 [0,0,0,0,0,0|2,0,2]=4 71 B12R1.7 CC=CCOCC1CNC(=O)O1 34a_100011315639_100000070051 [0,0,0,0,0,0|2,0,2]=4 72 B12R1.7 CC=CCSCC1CNC(=O)O1 62a_100000070051_100000181169 [0,0,0,0,0,0|2,0,2]=4 73 B12R1.7 CC=CCSCC1CNC(=O)O1 62a_100000181169_100000070051 [0,0,0,0,0,0|2,0,2]=4 74 B12R1.7 CC=CCSCC1COC(=O)O1 62a_100000070051_100000073702 [0,0,0,0,0,0|2,0,2]=4 75 B12R1.7 CC=CCSCC1COC(=O)O1 62a_100000073702_100000070051 [0,0,0,0,0,0|2,0,2]=4 76 B12R1.7 CC=CCSC[C@@H]1CCC(=O)N1 62a_100000070051_100015189358 [0,0,0,0,0,0|2,0,2]=4 77 B12R1.7 CC=CCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000070051 [0,0,0,0,0,0|2,0,2]=4 78 B12R1.7 CCC#CCOC1CCC(=O)C1 34a_100012614533_100009813939 [0,0,0,0,0,0|2,0,2]=4 79 B12R1.7 CCC#CCOC1COC(=O)O1 34a_100000032950_100000032252 [0,0,0,0,0,0|2,0,2]=4 80 B12R1.7 CCC#CCSC1COC(=O)O1 62a_100009813939_100000032252 [0,0,0,0,0,0|2,0,2]=4 81 B12R1.7 CCCCCCN1CCC(C1)O 2230a_100011215560_100000210314 [0,0,0,0,0,0|2,0,2]=4 82 B12R1.7 CCCCCCN1CCC(C1)O 269982a_100011215560_100000210757 [0,0,0,0,0,0|2,0,2]=4 83 B12R1.7 CCCCCCN1CC[C@@H](C1)F 2230a_100015203821_100000210314 [0,0,0,0,0,0|3,0,1]=4 84 B12R1.7 CCCCCCN1CC[C@@H](C1)F 269982a_100015203821_100000210757 [0,0,0,0,0,0|3,0,1]=4 85 B12R1.7 CCCCCCN1CC[C@@H](C1)F 34a_100015203821_100000210314 [0,0,0,0,0,0|3,0,1]=4 86 B12R1.7 CCCCCCN1CC[C@H](C1)C 2230a_100016987628_100000210314 [0,0,0,0,0,0|3,0,1]=4 87 B12R1.7 CCCCCCN1CC[C@H](C1)C 269982a_100016987628_100000210757 [0,0,0,0,0,0|3,0,1]=4 88 B12R1.7 CCCCCCN1CC[C@H](C1)C 34a_100016987628_100000210314 [0,0,0,0,0,0|3,0,1]=4 89 B12R1.7 CCCCCCN1CNC(=O)C1 2230a_200000708111_100000210314 [0,0,0,0,0,0|3,0,0]=3 90 B12R1.7 CCCCCNC1CCC(C1)C 270004a_100000209983_100011215218 [0,0,0,0,0,0|3,0,1]=4 91 B12R1.7 CCCCCNC1CCC(C1)O 270004a_100000209983_100012614533 [0,0,0,0,0,0|2,0,2]=4 92 B12R1.7 CCCCCNC1CNC(=O)C1 2230a_100000697751_100000210326 [0,0,0,0,0,0|3,0,0]=3 93 B12R1.7 CCCCCN[C@H]1CC[C@H](C1)O 2230a_100015195300_100000210326 [0,0,0,0,0,0|2,0,2]=4 94 B12R1.7 CCCCCOC1CCC(=O)C1 34a_100012614533_100000718602 [0,0,0,0,0,0|2,0,0]=2 95 B12R1.7 CCCCCOC1CCC(C1)C 34a_100000698185_100000718602 [0,0,0,0,0,0|3,0,1]=4 96 B12R1.7 CCCCCOC1CCN(C1)C 7a_100000210253_200012183744 [0,0,0,0,0,0|4,0,0]=4 97 B12R1.7 CCCCCOC1CNC(=O)C1 34a_100000690082_100000718602 [0,0,0,0,0,0|3,0,0]=3 98 B12R1.7 CCCCCOC1COC(=O)O1 34a_100000210253_100000032252 [0,0,0,0,0,0|2,0,0]=2 99 B12R1.7 CCCCCSC1CCN(C1)C 62a_100000210326_200012183744 [0,0,0,0,0,0|4,0,0]=4 100 B12R1.7 CCCCCSC1COC(=O)O1 62a_100000210326_100000032252 [0,0,0,0,0,0|2,0,0]=2 101 B12R1.7 CCCCNCC1CCN(C1)C 7a_106832991798_200000690779 [0,0,0,0,0,0|4,0,0]=4 102 B12R1.7 CCCCNCC1CNC(=O)C1 2230a_100016993742_100000210211 [0,0,0,0,0,0|3,0,0]=3 103 B12R1.7 CCCCNCC1CNC(=O)C1 34a_100016993742_100000210210 [0,0,0,0,0,0|3,0,0]=3 104 B12R1.7 CCCCNCC1CNC(=O)O1 2230a_100000102301_100000181169 [0,0,0,0,0,0|2,0,0]=2 105 B12R1.7 CCCCNCC1CNC(=O)O1 7a_106832991798_100000181169 [0,0,0,0,0,0|2,0,0]=2 106 B12R1.7 CCCCNC[C@@H]1CCC(=O)N1 2230a_100000102301_100015189358 [0,0,0,0,0,0|2,0,0]=2 107 B12R1.7 CCCCNC[C@@H]1CCC(=O)N1 7a_106832991798_100015189358 [0,0,0,0,0,0|2,0,0]=2 108 B12R1.7 CCCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000210211 [0,0,0,0,0,0|2,0,0]=2 109 B12R1.7 CCCCNC[C@H]1CCC(=O)N1 34a_100015423886_100000210210 [0,0,0,0,0,0|2,0,0]=2 110 B12R1.7 CCCCNC[C@H]1COC(=O)N1 2230a_100000102301_100015307671 [0,0,0,0,0,0|3,0,0]=3 111 B12R1.7 CCCCNC[C@H]1COC(=O)N1 7a_106832991798_100015307671 [0,0,0,0,0,0|3,0,0]=3 112 B12R1.7 CCCCOCC1=CC(=O)OC1 34a_100000210227_100000716558 [0,0,0,0,0,0|3,0,1]=4 113 B12R1.7 CCCCOCC1CCC(=O)N1 34a_100000737831_100000210210 [0,0,0,0,0,0|2,0,0]=2 114 B12R1.7 CCCCOCC1CCN(C1)C 34a_100000210227_200000690779 [0,0,0,0,0,0|4,0,0]=4 115 B12R1.7 CCCCOCC1CCN(C1)C 7a_100000210227_200000690779 [0,0,0,0,0,0|4,0,0]=4 116 B12R1.7 CCCCOCC1CNC(=O)C1 34a_100016041077_100000210210 [0,0,0,0,0,0|3,0,0]=3 117 B12R1.7 CCCCOCC1CNC(=O)O1 34a_100000210227_100000181169 [0,0,0,0,0,0|2,0,0]=2 118 B12R1.7 CCCCOCC1CNC(=O)O1 34a_100011315639_100000210210 [0,0,0,0,0,0|2,0,0]=2 119 B12R1.7 CCCCOCC1CNC(=O)O1 7a_100000210227_100000181169 [0,0,0,0,0,0|2,0,0]=2 120 B12R1.7 CCCCOCC1COC(=O)O1 34a_100000210227_100000073702 [0,0,0,0,0,0|2,0,0]=2 121 B12R1.7 CCCCOCN1CNC(=O)C1 2230a_200000708111_100011995733 [0,0,0,0,0,0|4,0,0]=4 122 B12R1.7 CCCCOC[C@@H]1CCC(=O)N1 7a_100000210227_100015189358 [0,0,0,0,0,0|2,0,0]=2 123 B12R1.7 CCCCOC[C@H]1COC(=O)N1 34a_100000210227_100015307671 [0,0,0,0,0,0|3,0,0]=3 124 B12R1.7 CCCCOC[C@H]1COC(=O)N1 7a_100000210227_100015307671 [0,0,0,0,0,0|3,0,0]=3 125 B12R1.7 CCCCSCC1=CC(=O)OC1 62a_100000210211_100000716558 [0,0,0,0,0,0|3,0,1]=4 126 B12R1.7 CCCCSCC1=CC(=O)OC1 62a_100000716558_100000210210 [0,0,0,0,0,0|3,0,1]=4 127 B12R1.7 CCCCSCC1CCN(C1)C 62a_100000210211_200000690779 [0,0,0,0,0,0|4,0,0]=4 128 B12R1.7 CCCCSCC1CCN(C1)C 62a_200000690779_100000210210 [0,0,0,0,0,0|4,0,0]=4 129 B12R1.7 CCCCSCC1CNC(=O)O1 62a_100000181169_100000210210 [0,0,0,0,0,0|2,0,0]=2 130 B12R1.7 CCCCSCC1CNC(=O)O1 62a_100000210211_100000181169 [0,0,0,0,0,0|2,0,0]=2 131 B12R1.7 CCCCSCC1COC(=O)O1 62a_100000073702_100000210210 [0,0,0,0,0,0|2,0,0]=2 132 B12R1.7 CCCCSCC1COC(=O)O1 62a_100000210211_100000073702 [0,0,0,0,0,0|2,0,0]=2 133 B12R1.7 CCCCSC[C@@H]1CCC(=O)N1 62a_100000210211_100015189358 [0,0,0,0,0,0|2,0,0]=2 134 B12R1.7 CCCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000210210 [0,0,0,0,0,0|2,0,0]=2 135 B12R1.7 CCCCSC[C@H]1COC(=O)N1 62a_100000210211_100015307671 [0,0,0,0,0,0|3,0,0]=3 136 B12R1.7 CCCCSC[C@H]1COC(=O)N1 62a_100015307671_100000210210 [0,0,0,0,0,0|3,0,0]=3 137 B12R1.7 CCCOCCN1CNC(=O)C1 2230a_200000708111_100011215938 [0,0,0,0,0,0|4,0,0]=4 138 B12R1.7 CCCSCCC1COS(=O)O1 62a_100000210303_100009840081 [0,0,0,0,0,0|3,0,0]=3 139 B12R1.7 CCOCCCN1CNC(=O)C1 2230a_200000708111_100012232248 [0,0,0,0,0,0|4,0,0]=4 140 B12R1.7 CCOCCNC1CNC(=O)C1 2230a_100000697751_100011215890 [0,0,0,0,0,0|4,0,0]=4 141 B12R1.7 CCOCCNC1COC(=O)O1 34a_102516460346_100000032252 [0,0,0,0,0,0|3,0,0]=3 142 B12R1.7 CCOCCOC1CCC(=O)C1 34a_100012614533_100000210147 [0,0,0,0,0,0|3,0,0]=3 143 B12R1.7 CCOCCOC1CNC(=O)C1 34a_100000690082_100000210147 [0,0,0,0,0,0|4,0,0]=4 144 B12R1.7 CCOCCOC1COC(=O)O1 34a_100000210136_100000032252 [0,0,0,0,0,0|3,0,0]=3 145 B12R1.7 CCOCCSC1COC(=O)O1 62a_100000210147_100000032252 [0,0,0,0,0,0|3,0,0]=3 146 B12R1.7 CCOCSCC1CNC(=O)O1 62a_100000181169_100000739092 [0,0,0,0,0,0|3,0,0]=3 147 B12R1.7 CCOCSCC1CNC(=O)O1 62a_100000739092_100000181169 [0,0,0,0,0,0|3,0,0]=3 148 B12R1.7 CCOCSCC1COC(=O)O1 62a_100000073702_100000739092 [0,0,0,0,0,0|3,0,0]=3 149 B12R1.7 CCOCSCC1COC(=O)O1 62a_100000739092_100000073702 [0,0,0,0,0,0|3,0,0]=3 150 B12R1.7 CCOCSC[C@@H]1CCC(=O)N1 62a_100000739092_100015189358 [0,0,0,0,0,0|3,0,0]=3 151 B12R1.7 CCOCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000739092 [0,0,0,0,0,0|3,0,0]=3 152 B12R1.7 CCOCSC[C@H]1COC(=O)N1 62a_100000739092_100015307671 [0,0,0,0,0,0|4,0,0]=4 153 B12R1.7 CCOCSC[C@H]1COC(=O)N1 62a_100015307671_100000739092 [0,0,0,0,0,0|4,0,0]=4 154 B12R1.7 CCSCCNC1CNC(=O)C1 2230a_100000697751_100000757381 [0,0,0,0,0,0|4,0,0]=4 155 B12R1.7 CCSCCOC1CCC(=O)C1 34a_100012614533_100000757381 [0,0,0,0,0,0|3,0,0]=3 156 B12R1.7 CCSCCOC1CNC(=O)C1 34a_100000690082_100000757381 [0,0,0,0,0,0|4,0,0]=4 157 B12R1.7 CCSCCOC1COC(=O)O1 34a_100000212035_100000032252 [0,0,0,0,0,0|3,0,0]=3 158 B12R1.7 CCSCCSC1COC(=O)O1 62a_100000757381_100000032252 [0,0,0,0,0,0|3,0,0]=3 159 B12R1.7 CNCCCOC1COC(=O)O1 34a_100000213112_100000032252 [0,0,0,0,0,0|3,0,0]=3 160 B12R1.7 COCCCCN1CNC(=O)C1 2230a_200000708111_100000730899 [0,0,0,0,0,0|4,0,0]=4 161 B12R1.7 COCCCNC1CNC(=O)C1 2230a_100000697751_100000740836 [0,0,0,0,0,0|4,0,0]=4 162 B12R1.7 COCCCNC1COC(=O)O1 34a_100150723488_100000032252 [0,0,0,0,0,0|3,0,0]=3 163 B12R1.7 COCCCOC1CCC(=O)C1 34a_100012614533_100000740836 [0,0,0,0,0,0|3,0,0]=3 164 B12R1.7 COCCCOC1CNC(=O)C1 34a_100000690082_100000740836 [0,0,0,0,0,0|4,0,0]=4 165 B12R1.7 COCCCOC1COC(=O)O1 34a_100000740835_100000032252 [0,0,0,0,0,0|3,0,0]=3 166 B12R1.7 COCCCSC1COC(=O)O1 62a_100000709357_100000032252 [0,0,0,0,0,0|3,0,0]=3 167 B12R1.7 COCCNCC1CNC(=O)C1 2230a_100016993742_100011201679 [0,0,0,0,0,0|4,0,0]=4 168 B12R1.7 COCCNCC1CNC(=O)C1 34a_100016993742_100011201679 [0,0,0,0,0,0|4,0,0]=4 169 B12R1.7 COCCNCC1CNC(=O)O1 2230a_100000209980_100000181169 [0,0,0,0,0,0|3,0,0]=3 170 B12R1.7 COCCNC[C@@H]1CCC(=O)N1 2230a_100000209980_100015189358 [0,0,0,0,0,0|3,0,0]=3 171 B12R1.7 COCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100011201679 [0,0,0,0,0,0|3,0,0]=3 172 B12R1.7 COCCNC[C@H]1CCC(=O)N1 34a_100015423886_100011201679 [0,0,0,0,0,0|3,0,0]=3 173 B12R1.7 COCCNC[C@H]1COC(=O)N1 2230a_100000209980_100015307671 [0,0,0,0,0,0|4,0,0]=4 174 B12R1.7 COCCOCC1CCC(=O)N1 34a_100000737831_100011201679 [0,0,0,0,0,0|3,0,0]=3 175 B12R1.7 COCCOCC1CNC(=O)C1 34a_100016041077_100011201679 [0,0,0,0,0,0|4,0,0]=4 176 B12R1.7 COCCOCC1CNC(=O)O1 34a_100000210237_100000181169 [0,0,0,0,0,0|3,0,0]=3 177 B12R1.7 COCCOCC1CNC(=O)O1 34a_100011315639_100011201679 [0,0,0,0,0,0|3,0,0]=3 178 B12R1.7 COCCOCC1COC(=O)O1 34a_100000210237_100000073702 [0,0,0,0,0,0|3,0,0]=3 179 B12R1.7 COCCOC[C@H]1COC(=O)N1 34a_100000210237_100015307671 [0,0,0,0,0,0|4,0,0]=4 180 B12R1.7 COCCSCC1CNC(=O)O1 62a_100000181169_100000233755 [0,0,0,0,0,0|3,0,0]=3 181 B12R1.7 COCCSCC1CNC(=O)O1 62a_100000233755_100000181169 [0,0,0,0,0,0|3,0,0]=3 182 B12R1.7 COCCSCC1COC(=O)O1 62a_100000073702_100000233755 [0,0,0,0,0,0|3,0,0]=3 183 B12R1.7 COCCSCC1COC(=O)O1 62a_100000233755_100000073702 [0,0,0,0,0,0|3,0,0]=3 184 B12R1.7 COCCSC[C@@H]1CCC(=O)N1 62a_100000233755_100015189358 [0,0,0,0,0,0|3,0,0]=3 185 B12R1.7 COCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000233755 [0,0,0,0,0,0|3,0,0]=3 186 B12R1.7 COCCSC[C@H]1COC(=O)N1 62a_100000233755_100015307671 [0,0,0,0,0,0|4,0,0]=4 187 B12R1.7 COCCSC[C@H]1COC(=O)N1 62a_100015307671_100000233755 [0,0,0,0,0,0|4,0,0]=4 188 B12R1.7 COCSCCC1COS(=O)O1 62a_100000766300_100009840081 [0,0,0,0,0,0|4,0,0]=4 189 B12R1.7 CSCCCOC1COC(=O)O1 34a_100000690336_100000032252 [0,0,0,0,0,0|3,0,0]=3 190 B12R1.7 CSCCNCC1CNC(=O)C1 2230a_100016993742_100000751147 [0,0,0,0,0,0|4,0,0]=4 191 B12R1.7 CSCCNCC1CNC(=O)C1 34a_100016993742_100000212216 [0,0,0,0,0,0|4,0,0]=4 192 B12R1.7 CSCCNCC1CNC(=O)O1 2230a_100020590264_100000181169 [0,0,0,0,0,0|3,0,0]=3 193 B12R1.7 CSCCNC[C@@H]1CCC(=O)N1 2230a_100020590264_100015189358 [0,0,0,0,0,0|3,0,0]=3 194 B12R1.7 CSCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000751147 [0,0,0,0,0,0|3,0,0]=3 195 B12R1.7 CSCCNC[C@H]1CCC(=O)N1 34a_100015423886_100000212216 [0,0,0,0,0,0|3,0,0]=3 196 B12R1.7 CSCCNC[C@H]1COC(=O)N1 2230a_100020590264_100015307671 [0,0,0,0,0,0|4,0,0]=4 197 B12R1.7 CSCCOCC1CCC(=O)N1 34a_100000737831_100000212216 [0,0,0,0,0,0|3,0,0]=3 198 B12R1.7 CSCCOCC1CNC(=O)C1 34a_100016041077_100000212216 [0,0,0,0,0,0|4,0,0]=4 199 B12R1.7 CSCCOCC1CNC(=O)O1 34a_100000230434_100000181169 [0,0,0,0,0,0|3,0,0]=3 200 B12R1.7 CSCCOCC1CNC(=O)O1 34a_100011315639_100000212216 [0,0,0,0,0,0|3,0,0]=3 201 B12R1.7 CSCCOCC1CNC(=O)O1 7a_100000230434_100000181169 [0,0,0,0,0,0|3,0,0]=3 202 B12R1.7 CSCCOCC1COC(=O)O1 34a_100000230434_100000073702 [0,0,0,0,0,0|3,0,0]=3 203 B12R1.7 CSCCOC[C@@H]1CCC(=O)N1 7a_100000230434_100015189358 [0,0,0,0,0,0|3,0,0]=3 204 B12R1.7 CSCCOC[C@H]1COC(=O)N1 34a_100000230434_100015307671 [0,0,0,0,0,0|4,0,0]=4 205 B12R1.7 CSCCOC[C@H]1COC(=O)N1 7a_100000230434_100015307671 [0,0,0,0,0,0|4,0,0]=4 206 B12R1.7 CSCCSCC1CNC(=O)O1 62a_100000181169_100000751147 [0,0,0,0,0,0|3,0,0]=3 207 B12R1.7 CSCCSCC1CNC(=O)O1 62a_100000212216_100000181169 [0,0,0,0,0,0|3,0,0]=3 208 B12R1.7 CSCCSCC1COC(=O)O1 62a_100000073702_100000751147 [0,0,0,0,0,0|3,0,0]=3 209 B12R1.7 CSCCSCC1COC(=O)O1 62a_100000212216_100000073702 [0,0,0,0,0,0|3,0,0]=3 210 B12R1.7 CSCCSC[C@@H]1CCC(=O)N1 62a_100000212216_100015189358 [0,0,0,0,0,0|3,0,0]=3 211 B12R1.7 CSCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000751147 [0,0,0,0,0,0|3,0,0]=3 212 B12R1.7 CSCCSC[C@H]1COC(=O)N1 62a_100000212216_100015307671 [0,0,0,0,0,0|4,0,0]=4 213 B12R1.7 CSCCSC[C@H]1COC(=O)N1 62a_100015307671_100000751147 [0,0,0,0,0,0|4,0,0]=4 214 B12R1.7 CSCSCCC1COS(=O)O1 62a_100011218213_100009840081 [0,0,0,0,0,0|4,0,0]=4 215 B12R1.7 N#CCCCSC1COC(=O)O1 62a_100000687738_100000032252 [0,0,0,0,0,0|3,0,1]=4 216 B12R1.7 N#CCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100011215226 [0,0,0,0,0,0|3,0,1]=4 217 B12R1.7 N#CCCSCC1CNC(=O)O1 62a_100000181169_100011215226 [0,0,0,0,0,0|3,0,1]=4 218 B12R1.7 N#CCCSCC1CNC(=O)O1 62a_100011215226_100000181169 [0,0,0,0,0,0|3,0,1]=4 219 B12R1.7 N#CCCSCC1COC(=O)O1 62a_100000073702_100011215226 [0,0,0,0,0,0|3,0,1]=4 220 B12R1.7 N#CCCSCC1COC(=O)O1 62a_100011215226_100000073702 [0,0,0,0,0,0|3,0,1]=4 221 B12R1.7 N#CCCSC[C@@H]1CCC(=O)N1 62a_100011215226_100015189358 [0,0,0,0,0,0|3,0,1]=4 222 B12R1.7 N#CCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100011215226 [0,0,0,0,0,0|3,0,1]=4 223 B12R1.7 NCCCCOC1COC(=O)O1 34a_100000750430_100000032252 [0,0,0,0,0,0|3,0,0]=3 224 B12R1.7 NCCCOCC1CNC(=O)O1 34a_100000182051_100000181169 [0,0,0,0,0,0|3,0,0]=3 225 B12R1.7 NCCCOCC1COC(=O)O1 34a_100000182051_100000073702 [0,0,0,0,0,0|3,0,0]=3 226 B12R1.7 NCCCOC[C@H]1COC(=O)N1 34a_100000182051_100015307671 [0,0,0,0,0,0|4,0,0]=4 227 B12R1.7 NOCCOCC1CNC(=O)O1 34a_100000700252_100000181169 [0,0,0,0,0,0|4,0,0]=4 228 B12R1.7 NOCCOCC1COC(=O)O1 34a_100000700252_100000073702 [0,0,0,0,0,0|4,0,0]=4 229 B12R1.7 O=C1CC(CN1)CNCCCF 2230a_100016993742_100011934791 [0,0,0,0,0,0|4,0,0]=4 230 B12R1.7 O=C1CC(CN1)CNCCCF 34a_100016993742_100011934791 [0,0,0,0,0,0|4,0,0]=4 231 B12R1.7 O=C1CC(CN1)CNCCCO 2230a_100016993742_100000230001 [0,0,0,0,0,0|4,0,0]=4 232 B12R1.7 O=C1CC(CN1)CNCCCO 34a_100016993742_100000230001 [0,0,0,0,0,0|4,0,0]=4 233 B12R1.7 O=C1CC(CN1)COCCCF 34a_100016041077_100011934791 [0,0,0,0,0,0|4,0,0]=4 234 B12R1.7 O=C1CC(CN1)COCCCO 34a_100016041077_100000230001 [0,0,0,0,0,0|4,0,0]=4 235 B12R1.7 O=C1CC(CN1)NCCCCF 2230a_100000697751_100000729493 [0,0,0,0,0,0|4,0,0]=4 236 B12R1.7 O=C1CC(CN1)NCCCCO 2230a_100000697751_100000210776 [0,0,0,0,0,0|4,0,0]=4 237 B12R1.7 O=C1CC(CN1)OCCCCF 34a_100000690082_100000729493 [0,0,0,0,0,0|4,0,0]=4 238 B12R1.7 O=C1CC(CN1)OCCCCO 34a_100000690082_100011216708 [0,0,0,0,0,0|4,0,0]=4 239 B12R1.7 O=C1CCC(C1)OCCCCF 34a_100012614533_100000729493 [0,0,0,0,0,0|3,0,0]=3 240 B12R1.7 O=C1CCC(C1)OCCCCO 34a_100012614533_100011216708 [0,0,0,0,0,0|3,0,0]=3 241 B12R1.7 O=C1CCC(N1)COCCCF 34a_100000737831_100011934791 [0,0,0,0,0,0|3,0,0]=3 242 B12R1.7 O=C1CCC(N1)COCCCO 34a_100000737831_100000230001 [0,0,0,0,0,0|3,0,0]=3 243 B12R1.7 O=C1CC[C@@H](N1)CNCCCF 2230a_100015423886_100011934791 [0,0,0,0,0,0|3,0,0]=3 244 B12R1.7 O=C1CC[C@@H](N1)CNCCCF 34a_100015423886_100011934791 [0,0,0,0,0,0|3,0,0]=3 245 B12R1.7 O=C1CC[C@@H](N1)CNCCCO 2230a_100015423886_100000230001 [0,0,0,0,0,0|3,0,0]=3 246 B12R1.7 O=C1CC[C@@H](N1)CNCCCO 34a_100015423886_100000230001 [0,0,0,0,0,0|3,0,0]=3 247 B12R1.7 O=C1CC[C@H](N1)CNCCCF 2230a_100015189416_100015189358 [0,0,0,0,0,0|3,0,0]=3 248 B12R1.7 O=C1CC[C@H](N1)CSCCCF 62a_100011934791_100015189358 [0,0,0,0,0,0|3,0,0]=3 249 B12R1.7 O=C1CC[C@H](N1)CSCCCF 62a_100015189358_100011934791 [0,0,0,0,0,0|3,0,0]=3 250 B12R1.7 O=C1CC[C@H](N1)CSCCCO 62a_100011215043_100015189358 [0,0,0,0,0,0|3,0,0]=3 251 B12R1.7 O=C1CC[C@H](N1)CSCCCO 62a_100015189358_100011215043 [0,0,0,0,0,0|3,0,0]=3 252 B12R1.7 O=C1CN(CN1)CCCCCF 2230a_200000708111_100000729378 [0,0,0,0,0,0|4,0,0]=4 253 B12R1.7 O=C1CN(CN1)CCCCCO 2230a_200000708111_100000746330 [0,0,0,0,0,0|4,0,0]=4 254 B12R1.7 O=C1NCC(O1)CNCCCF 2230a_100015189416_100000181169 [0,0,0,0,0,0|3,0,0]=3 255 B12R1.7 O=C1NCC(O1)CNCCCF 34a_100015189416_100000181169 [0,0,0,0,0,0|3,0,0]=3 256 B12R1.7 O=C1NCC(O1)COCCCBr 34a_100011217188_100000181169 [0,0,0,0,0,0|3,0,0]=3 257 B12R1.7 O=C1NCC(O1)COCCCCl 34a_100000230001_100000181169 [0,0,0,0,0,0|3,0,0]=3 258 B12R1.7 O=C1NCC(O1)COCCCF 34a_100000759539_100000181169 [0,0,0,0,0,0|3,0,0]=3 259 B12R1.7 O=C1NCC(O1)COCCCF 34a_100011315639_100011934791 [0,0,0,0,0,0|3,0,0]=3 260 B12R1.7 O=C1NCC(O1)COCCCO 34a_100011315639_100000230001 [0,0,0,0,0,0|3,0,0]=3 261 B12R1.7 O=C1NCC(O1)CSCCCF 62a_100000181169_100011934791 [0,0,0,0,0,0|3,0,0]=3 262 B12R1.7 O=C1NCC(O1)CSCCCF 62a_100011934791_100000181169 [0,0,0,0,0,0|3,0,0]=3 263 B12R1.7 O=C1NCC(O1)CSCCCO 62a_100000181169_100011215043 [0,0,0,0,0,0|3,0,0]=3 264 B12R1.7 O=C1NCC(O1)CSCCCO 62a_100011215043_100000181169 [0,0,0,0,0,0|3,0,0]=3 265 B12R1.7 O=C1N[C@H](CO1)CNCCCF 2230a_100015189416_100015307671 [0,0,0,0,0,0|4,0,0]=4 266 B12R1.7 O=C1N[C@H](CO1)CNCCCF 34a_100015189416_100015307671 [0,0,0,0,0,0|4,0,0]=4 267 B12R1.7 O=C1N[C@H](CO1)COCCCBr 34a_100011217188_100015307671 [0,0,0,0,0,0|4,0,0]=4 268 B12R1.7 O=C1N[C@H](CO1)COCCCCl 34a_100000230001_100015307671 [0,0,0,0,0,0|4,0,0]=4 269 B12R1.7 O=C1N[C@H](CO1)COCCCF 34a_100000759539_100015307671 [0,0,0,0,0,0|4,0,0]=4 270 B12R1.7 O=C1N[C@H](CO1)CSCCCF 62a_100011934791_100015307671 [0,0,0,0,0,0|4,0,0]=4 271 B12R1.7 O=C1N[C@H](CO1)CSCCCF 62a_100015307671_100011934791 [0,0,0,0,0,0|4,0,0]=4 272 B12R1.7 O=C1N[C@H](CO1)CSCCCO 62a_100011215043_100015307671 [0,0,0,0,0,0|4,0,0]=4 273 B12R1.7 O=C1N[C@H](CO1)CSCCCO 62a_100015307671_100011215043 [0,0,0,0,0,0|4,0,0]=4 274 B12R1.7 O=C1OCC(O1)CNCCCF 34a_100015189416_100000073702 [0,0,0,0,0,0|3,0,0]=3 275 B12R1.7 O=C1OCC(O1)COCCCBr 34a_100011217188_100000073702 [0,0,0,0,0,0|3,0,0]=3 276 B12R1.7 O=C1OCC(O1)COCCCCl 34a_100000230001_100000073702 [0,0,0,0,0,0|3,0,0]=3 277 B12R1.7 O=C1OCC(O1)COCCCF 34a_100000759539_100000073702 [0,0,0,0,0,0|3,0,0]=3 278 B12R1.7 O=C1OCC(O1)CSCCCF 62a_100000073702_100011934791 [0,0,0,0,0,0|3,0,0]=3 279 B12R1.7 O=C1OCC(O1)CSCCCF 62a_100011934791_100000073702 [0,0,0,0,0,0|3,0,0]=3 280 B12R1.7 O=C1OCC(O1)CSCCCO 62a_100000073702_100011215043 [0,0,0,0,0,0|3,0,0]=3 281 B12R1.7 O=C1OCC(O1)CSCCCO 62a_100011215043_100000073702 [0,0,0,0,0,0|3,0,0]=3 282 B12R1.7 O=C1OCC(O1)NCCCCO 34a_100000750430_100000032252 [0,0,0,0,0,0|3,0,0]=3 283 B12R1.7 O=C1OCC(O1)OCCCCBr 34a_100011216708_100000032252 [0,0,0,0,0,0|3,0,0]=3 284 B12R1.7 O=C1OCC(O1)OCCCCCl 34a_100000210776_100000032252 [0,0,0,0,0,0|3,0,0]=3 285 B12R1.7 O=C1OCC(O1)OCCCCF 34a_100011995726_100000032252 [0,0,0,0,0,0|3,0,0]=3 286 B12R1.7 O=C1OCC(O1)OCCCCI 34a_200012148704_100000032252 [0,0,0,0,0,0|3,0,0]=3 287 B12R1.7 O=C1OCC(O1)SCCCCF 62a_100000729493_100000032252 [0,0,0,0,0,0|3,0,0]=3 288 B12R1.7 O=C1OCC(O1)SCCCCO 62a_100000210776_100000032252 [0,0,0,0,0,0|3,0,0]=3 289 B12R1.7 O=CCCCSC1COC(=O)O1 62a_200011292268_100000032252 [0,0,0,0,0,0|3,0,1]=4 290 B12R1.7 O=S1OCC(O1)CCSCCF 62a_100011217306_100009840081 [0,0,0,0,0,0|4,0,0]=4 291 B12R1.7 O=S1OCC(O1)CCSCCO 62a_100000211926_100009840081 [0,0,0,0,0,0|4,0,0]=4 292 B11R1.4 CCCCCCN1CC=CC1 269982a_100015195280_100000210757 [1,0,0,0,0,0|2,0,1]=4 293 B11R1.4 CCCCCCN1CCCC1 2230a_100000188435_100000210314 [1,0,0,0,0,0|2,0,1]=4 294 B11R1.4 CCCCCCN1CCCC1 269982a_100000188435_100000210757 [1,0,0,0,0,0|2,0,1]=4 295 B11R1.4 CCCCCCN1CCSC1 2230a_100011215254_100000210314 [1,0,0,0,0,0|3,0,0]=4 296 B11R1.4 CCCCCCN1CCSC1 269982a_100011215254_100000210757 [1,0,0,0,0,0|3,0,0]=4 297 B11R1.4 CCCCCNC1CC=CC1 2230a_100015188752_100000210326 [1,0,0,0,0,0|2,0,1]=4 298 B11R1.4 CCCCCNC1CCCC1 2230a_100000209983_100000179811 [1,0,0,0,0,0|2,0,1]=4 299 B11R1.4 CCCCCNC1CCCC1 2230a_100000211070_100000210326 [1,0,0,0,0,0|2,0,1]=4 300 B11R1.4 CCCCCNC1CCCC1 270004a_100000209983_100000210133 [1,0,0,0,0,0|2,0,1]=4 301 B11R1.4 CCCCCNC1CCCC1 34a_100000211070_100000718602 [1,0,0,0,0,0|2,0,1]=4 302 B11R1.4 CCCCCNC1CCOC1 2230a_100000209983_100000731011 [1,0,0,0,0,0|3,0,0]=4 303 B11R1.4 CCCCCNC1CCOC1 270004a_100000209983_100000752484 [1,0,0,0,0,0|3,0,0]=4 304 B11R1.4 CCCCCNC1CCSC1 270004a_100000209983_100000212027 [1,0,0,0,0,0|3,0,0]=4 305 B11R1.4 CCCCCN[C@@H]1CCOC1 2230a_200015188469_100000210326 [1,0,0,0,0,0|3,0,0]=4 306 B11R1.4 CCCCCN[C@H]1CCOC1 2230a_100015188467_100000210326 [1,0,0,0,0,0|3,0,0]=4 307 B11R1.4 CCCCCN[C@H]1CCOC1 34a_100015188467_100000718602 [1,0,0,0,0,0|3,0,0]=4 308 B11R1.4 CCCCCOC1CCCC1 34a_100000210253_100000179811 [1,0,0,0,0,0|2,0,1]=4 309 B11R1.4 CCCCCOC1CCCC1 34a_100000210269_100000718602 [1,0,0,0,0,0|2,0,1]=4 310 B11R1.4 CCCCCOC1CCCC1 7a_100000210253_100000179811 [1,0,0,0,0,0|2,0,1]=4 311 B11R1.4 CCCCCOC1CCCC1 7a_100000210269_100000210326 [1,0,0,0,0,0|2,0,1]=4 312 B11R1.4 CCCCCOC1CCCO1 34a_100000085407_100000718602 [1,0,0,0,0,0|1,0,1]=3 313 B11R1.4 CCCCCOC1CCOC1 34a_100000210253_100000690089 [1,0,0,0,0,0|3,0,0]=4 314 B11R1.4 CCCCCOC1CCOC1 7a_100000210253_100000731011 [1,0,0,0,0,0|3,0,0]=4 315 B11R1.4 CCCCCOC1CCSC1 7a_100011232664_100000210326 [1,0,0,0,0,0|3,0,0]=4 316 B11R1.4 CCCCCO[C@H]1CCOC1 34a_100000717292_100000718602 [1,0,0,0,0,0|3,0,0]=4 317 B11R1.4 CCCCCSC1CCCC1 62a_100000210326_100000179811 [1,0,0,0,0,0|2,0,1]=4 318 B11R1.4 CCCCCSC1CCCC1 62a_100011217020_100000210326 [1,0,0,0,0,0|2,0,1]=4 319 B11R1.4 CCCCCSC1CCOC1 62a_100000210326_100000690089 [1,0,0,0,0,0|3,0,0]=4 320 B11R1.4 CCCCNCC1CCCC1 2230a_100000102301_100000740388 [1,0,0,0,0,0|2,0,1]=4 321 B11R1.4 CCCCNCC1CCCC1 2230a_100000737975_100000210211 [1,0,0,0,0,0|2,0,1]=4 322 B11R1.4 CCCCNCC1CCCC1 269862a_100000102301_100000746403 [1,0,0,0,0,0|2,0,1]=4 323 B11R1.4 CCCCNCC1CCCC1 34a_100000737975_100000210210 [1,0,0,0,0,0|2,0,1]=4 324 B11R1.4 CCCCNCC1CCCC1 7a_106832991798_100000740388 [1,0,0,0,0,0|2,0,1]=4 325 B11R1.4 CCCCNCC1CCCO1 2230a_100000102301_100000203698 [1,0,0,0,0,0|1,0,1]=3 326 B11R1.4 CCCCNCC1CCCO1 7a_106832991798_100000203698 [1,0,0,0,0,0|1,0,1]=3 327 B11R1.4 CCCCNCC1CCOC1 2230a_100000102301_100000702531 [1,0,0,0,0,0|3,0,0]=4 328 B11R1.4 CCCCNCC1CCOC1 2230a_100000737293_100000210211 [1,0,0,0,0,0|3,0,0]=4 329 B11R1.4 CCCCNCC1CCOC1 34a_100000737293_100000210210 [1,0,0,0,0,0|3,0,0]=4 330 B11R1.4 CCCCNCC1CCOC1 7a_106832991798_100000702531 [1,0,0,0,0,0|3,0,0]=4 331 B11R1.4 CCCCNCC1OCCO1 2230a_100000036311_100000210211 [1,0,0,0,0,0|2,0,1]=4 332 B11R1.4 CCCCNCC1OCCO1 2230a_100000102301_100000755774 [1,0,0,0,0,0|2,0,1]=4 333 B11R1.4 CCCCNCC1OCCO1 34a_100000036311_100000210210 [1,0,0,0,0,0|2,0,1]=4 334 B11R1.4 CCCCNCC1OCCO1 7a_106832991798_100000755774 [1,0,0,0,0,0|2,0,1]=4 335 B11R1.4 CCCCNC[C@@H]1CCCO1 2230a_100020590478_100000210211 [1,0,0,0,0,0|1,0,1]=3 336 B11R1.4 CCCCNC[C@@H]1CCCO1 34a_100020590478_100000210210 [1,0,0,0,0,0|1,0,1]=3 337 B11R1.4 CCCCOCC1CC=CC1 34a_100000688395_100000210210 [1,0,0,0,0,0|2,0,1]=4 338 B11R1.4 CCCCOCC1CCCC1 34a_100000210227_100000740388 [1,0,0,0,0,0|2,0,1]=4 339 B11R1.4 CCCCOCC1CCCC1 34a_100000742336_100000210210 [1,0,0,0,0,0|2,0,1]=4 340 B11R1.4 CCCCOCC1CCCC1 7a_100000210227_100000740388 [1,0,0,0,0,0|2,0,1]=4 341 B11R1.4 CCCCOCC1CCCC1 7a_100000742336_100000210211 [1,0,0,0,0,0|2,0,1]=4 342 B11R1.4 CCCCOCC1CCCO1 34a_100000210270_100000210210 [1,0,0,0,0,0|1,0,1]=3 343 B11R1.4 CCCCOCC1CCCO1 7a_100000210227_100000203698 [1,0,0,0,0,0|1,0,1]=3 344 B11R1.4 CCCCOCC1CCCO1 7a_100000210270_100000210211 [1,0,0,0,0,0|1,0,1]=3 345 B11R1.4 CCCCOCC1CCNC1 34a_100000748654_100000210210 [1,0,0,0,0,0|3,0,0]=4 346 B11R1.4 CCCCOCC1CCOC1 34a_100000210227_100011261433 [1,0,0,0,0,0|3,0,0]=4 347 B11R1.4 CCCCOCC1CCOC1 34a_100000740260_100000210210 [1,0,0,0,0,0|3,0,0]=4 348 B11R1.4 CCCCOCC1CCOC1 7a_100000210227_100000702531 [1,0,0,0,0,0|3,0,0]=4 349 B11R1.4 CCCCOCC1COCO1 34a_100011216627_100000210210 [1,0,0,0,0,0|2,0,1]=4 350 B11R1.4 CCCCOCC1OCCO1 34a_100000087154_100000210210 [1,0,0,0,0,0|2,0,1]=4 351 B11R1.4 CCCCOCC1OCCO1 34a_100000210227_100000755774 [1,0,0,0,0,0|2,0,1]=4 352 B11R1.4 CCCCOCC1OCCO1 7a_100000210227_100000755774 [1,0,0,0,0,0|2,0,1]=4 353 B11R1.4 CCCCOC[C@H]1CCCN1 34a_100000745186_100000210210 [1,0,0,0,0,0|2,0,1]=4 354 B11R1.4 CCCCSCC1CCCC1 62a_100000210211_100000740388 [1,0,0,0,0,0|2,0,1]=4 355 B11R1.4 CCCCSCC1CCCC1 62a_100000740388_100000210210 [1,0,0,0,0,0|2,0,1]=4 356 B11R1.4 CCCCSCC1CCCO1 62a_100000203698_100000210210 [1,0,0,0,0,0|1,0,1]=3 357 B11R1.4 CCCCSCC1CCCO1 62a_100000210211_100000203698 [1,0,0,0,0,0|1,0,1]=3 358 B11R1.4 CCCCSCC1CCOC1 62a_100000210211_100000702531 [1,0,0,0,0,0|3,0,0]=4 359 B11R1.4 CCCCSCC1CCOC1 62a_100000702531_100000210210 [1,0,0,0,0,0|3,0,0]=4 360 B11R1.4 CCCCSCC1OCCO1 62a_100000210211_100000755774 [1,0,0,0,0,0|2,0,1]=4 361 B11R1.4 CCCCSCC1OCCO1 62a_100000755774_100000210210 [1,0,0,0,0,0|2,0,1]=4 362 B11R1.4 CCCNCCC1CCCC1 2230a_100000739158_100000210303 [1,0,0,0,0,0|2,0,1]=4 363 B11R1.4 CCCNCCC1CCCC1 34a_100000739158_100000210303 [1,0,0,0,0,0|2,0,1]=4 364 B11R1.4 CCCNCCC1OCCO1 2230a_100000034215_100000210303 [1,0,0,0,0,0|2,0,1]=4 365 B11R1.4 CCCNCCC1OCCO1 34a_100000034215_100000210303 [1,0,0,0,0,0|2,0,1]=4 366 B11R1.4 CCCOCCC1CCCC1 34a_100000210258_100000760354 [1,0,0,0,0,0|2,0,1]=4 367 B11R1.4 CCCOCCC1CCCC1 34a_100000749090_100000210303 [1,0,0,0,0,0|2,0,1]=4 368 B11R1.4 CCCOCCC1CCCC1 7a_100000749090_100000210303 [1,0,0,0,0,0|2,0,1]=4 369 B11R1.4 CCCOCCC1CCNC1 34a_100016987287_100000210303 [1,0,0,0,0,0|3,0,0]=4 370 B11R1.4 CCCOCCC1CCOC1 34a_100011879284_100000210303 [1,0,0,0,0,0|3,0,0]=4 371 B11R1.4 CCCOCCC1OCCO1 34a_100000210258_100000740749 [1,0,0,0,0,0|2,0,1]=4 372 B11R1.4 CCCSCCC1CCCC1 62a_100000210303_100000760354 [1,0,0,0,0,0|2,0,1]=4 373 B11R1.4 CCCSCCC1CCCC1 62a_100000760354_100000210303 [1,0,0,0,0,0|2,0,1]=4 374 B11R1.4 CCCSCCC1OCCO1 62a_100000210303_100000740749 [1,0,0,0,0,0|2,0,1]=4 375 B11R1.4 CCNCCCC1CCCC1 2230a_100000736752_100000210202 [1,0,0,0,0,0|2,0,1]=4 376 B11R1.4 CCNCCCC1CCCC1 2230a_100015525214_100011713738 [1,0,0,0,0,0|2,0,1]=4 377 B11R1.4 CCNCCCC1CCCC1 34a_100000736752_100000210202 [1,0,0,0,0,0|2,0,1]=4 378 B11R1.4 CCNCCCC1OCCO1 2230a_100015525214_100000042513 [1,0,0,0,0,0|2,0,1]=4 379 B11R1.4 CCOCCCC1CCCC1 34a_100011215328_100000210202 [1,0,0,0,0,0|2,0,1]=4 380 B11R1.4 CCOCCCC1CCCC1 34a_100121572206_100011713738 [1,0,0,0,0,0|2,0,1]=4 381 B11R1.4 CCOCCCC1CCCC1 7a_100011215328_100000210202 [1,0,0,0,0,0|2,0,1]=4 382 B11R1.4 CCOCCCC1OCCO1 34a_100009871617_100000210202 [1,0,0,0,0,0|2,0,1]=4 383 B11R1.4 CCOCCCC1OCCO1 34a_100121572206_100009861162 [1,0,0,0,0,0|2,0,1]=4 384 B11R1.4 CCOCCCC1OCCO1 7a_100009871617_100000210202 [1,0,0,0,0,0|2,0,1]=4 385 B11R1.4 CCOCCOC1CCCO1 34a_100000085407_100000210147 [1,0,0,0,0,0|2,0,1]=4 386 B11R1.4 CCOCSCC1CCCO1 62a_100000203698_100000739092 [1,0,0,0,0,0|2,0,1]=4 387 B11R1.4 CCOCSCC1CCCO1 62a_100000739092_100000203698 [1,0,0,0,0,0|2,0,1]=4 388 B11R1.4 CCSCCCC1CCCC1 62a_100000210202_100011713738 [1,0,0,0,0,0|2,0,1]=4 389 B11R1.4 CCSCCCC1CCCC1 62a_100011713738_100000210202 [1,0,0,0,0,0|2,0,1]=4 390 B11R1.4 CCSCCCC1OCCO1 62a_100000210202_100000042513 [1,0,0,0,0,0|2,0,1]=4 391 B11R1.4 CCSCCOC1CCCO1 34a_100000085407_100000757381 [1,0,0,0,0,0|2,0,1]=4 392 B11R1.4 CNCCCCC1OCCO1 2230a_106832991635_100000034956 [1,0,0,0,0,0|2,0,1]=4 393 B11R1.4 CNCCCCC1OCCO1 34a_100102657272_200009813554 [1,0,0,0,0,0|2,0,1]=4 394 B11R1.4 CNCCCCC1OCCO1 7a_106832991635_100000034956 [1,0,0,0,0,0|2,0,1]=4 395 B11R1.4 COCCCCC1OCCO1 34a_100138415774_200009813554 [1,0,0,0,0,0|2,0,1]=4 396 B11R1.4 COCCCOC1CCCO1 34a_100000085407_100000740836 [1,0,0,0,0,0|2,0,1]=4 397 B11R1.4 COCCNCC1CCCO1 2230a_100000209980_100000203698 [1,0,0,0,0,0|2,0,1]=4 398 B11R1.4 COCCNC[C@@H]1CCCO1 2230a_100020590478_100011201679 [1,0,0,0,0,0|2,0,1]=4 399 B11R1.4 COCCNC[C@@H]1CCCO1 34a_100020590478_100011201679 [1,0,0,0,0,0|2,0,1]=4 400 B11R1.4 COCCOCC1CCCO1 34a_100000210270_100011201679 [1,0,0,0,0,0|2,0,1]=4 401 B11R1.4 COCCOCC1CCCO1 7a_100000210270_100000233755 [1,0,0,0,0,0|2,0,1]=4 402 B11R1.4 COCCSCC1CCCO1 62a_100000203698_100000233755 [1,0,0,0,0,0|2,0,1]=4 403 B11R1.4 COCCSCC1CCCO1 62a_100000233755_100000203698 [1,0,0,0,0,0|2,0,1]=4 404 B11R1.4 CSCCCCC1OCCO1 62a_200000210301_100000034956 [1,0,0,0,0,0|2,0,1]=4 405 B11R1.4 CSCCNCC1CCCO1 2230a_100020590264_100000203698 [1,0,0,0,0,0|2,0,1]=4 406 B11R1.4 CSCCNC[C@@H]1CCCO1 2230a_100020590478_100000751147 [1,0,0,0,0,0|2,0,1]=4 407 B11R1.4 CSCCNC[C@@H]1CCCO1 34a_100020590478_100000212216 [1,0,0,0,0,0|2,0,1]=4 408 B11R1.4 CSCCOCC1CCCO1 34a_100000210270_100000212216 [1,0,0,0,0,0|2,0,1]=4 409 B11R1.4 CSCCOCC1CCCO1 7a_100000210270_100000212216 [1,0,0,0,0,0|2,0,1]=4 410 B11R1.4 CSCCOCC1CCCO1 7a_100000230434_100000203698 [1,0,0,0,0,0|2,0,1]=4 411 B11R1.4 CSCCSCC1CCCO1 62a_100000203698_100000751147 [1,0,0,0,0,0|2,0,1]=4 412 B11R1.4 CSCCSCC1CCCO1 62a_100000212216_100000203698 [1,0,0,0,0,0|2,0,1]=4 413 B11R1.4 FCCCCOC1CCCO1 34a_100000085407_100000729493 [1,0,0,0,0,0|2,0,1]=4 414 B11R1.4 FCCCNCC1CCCO1 2230a_100015189416_100000203698 [1,0,0,0,0,0|2,0,1]=4 415 B11R1.4 FCCCNC[C@@H]1CCCO1 2230a_100020590478_100011934791 [1,0,0,0,0,0|2,0,1]=4 416 B11R1.4 FCCCNC[C@@H]1CCCO1 34a_100020590478_100011934791 [1,0,0,0,0,0|2,0,1]=4 417 B11R1.4 FCCCOCC1CCCO1 34a_100000210270_100011934791 [1,0,0,0,0,0|2,0,1]=4 418 B11R1.4 FCCCOCC1CCCO1 7a_100000210270_100011934791 [1,0,0,0,0,0|2,0,1]=4 419 B11R1.4 FCCCSCC1CCCO1 62a_100000203698_100011934791 [1,0,0,0,0,0|2,0,1]=4 420 B11R1.4 FCCCSCC1CCCO1 62a_100011934791_100000203698 [1,0,0,0,0,0|2,0,1]=4 421 B11R1.4 OCCCCOC1CCCO1 34a_100000085407_100011216708 [1,0,0,0,0,0|2,0,1]=4 422 B11R1.4 OCCCNC[C@@H]1CCCO1 2230a_100020590478_100000230001 [1,0,0,0,0,0|2,0,1]=4 423 B11R1.4 OCCCNC[C@@H]1CCCO1 34a_100020590478_100000230001 [1,0,0,0,0,0|2,0,1]=4 424 B11R1.4 OCCCOCC1CCCO1 34a_100000210270_100000230001 [1,0,0,0,0,0|2,0,1]=4 425 B11R1.4 OCCCOCC1CCCO1 7a_100000210270_100011215043 [1,0,0,0,0,0|2,0,1]=4 426 B11R1.4 OCCCSCC1CCCO1 62a_100000203698_100011215043 [1,0,0,0,0,0|2,0,1]=4 427 B11R1.4 OCCCSCC1CCCO1 62a_100011215043_100000203698 [1,0,0,0,0,0|2,0,1]=4 428 B11R1.4 [13CH3]SCCCCC1OCCO1 62a_200025704644_100000034956 [1,0,0,0,0,0|2,0,1]=4 429 B11R1.27 CCCCCN1CNC(=O)C1 2230a_200000708111_100000210326 [1,0,0,0,0,0|3,0,0]=4 430 B11R1.27 CCCCNC1CNC(=O)C1 2230a_100000697751_100000210211 [1,0,0,0,0,0|3,0,0]=4 431 B11R1.27 CCCCOC1CCC(=O)C1 34a_100012614533_100000210210 [1,0,0,0,0,0|2,0,0]=3 432 B11R1.27 CCCCOC1CNC(=O)C1 34a_100000690082_100000210210 [1,0,0,0,0,0|3,0,0]=4 433 B11R1.27 CCCCOC1COC(=O)O1 34a_100000210227_100000032252 [1,0,0,0,0,0|2,0,0]=3 434 B11R1.27 CCCCSC1COC(=O)O1 62a_100000210211_100000032252 [1,0,0,0,0,0|2,0,0]=3 435 B11R1.27 CCCNCC1CNC(=O)C1 2230a_100016993742_100000210303 [1,0,0,0,0,0|3,0,0]=4 436 B11R1.27 CCCNCC1CNC(=O)C1 34a_100016993742_100000210303 [1,0,0,0,0,0|3,0,0]=4 437 B11R1.27 CCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000210303 [1,0,0,0,0,0|2,0,0]=3 438 B11R1.27 CCCNC[C@H]1CCC(=O)N1 34a_100015423886_100000210303 [1,0,0,0,0,0|2,0,0]=3 439 B11R1.27 CCCOCC1CCC(=O)N1 34a_100000737831_100000210303 [1,0,0,0,0,0|2,0,0]=3 440 B11R1.27 CCCOCC1CNC(=O)C1 34a_100016041077_100000210303 [1,0,0,0,0,0|3,0,0]=4 441 B11R1.27 CCCOCC1CNC(=O)O1 34a_100000210258_100000181169 [1,0,0,0,0,0|2,0,0]=3 442 B11R1.27 CCCOCC1CNC(=O)O1 34a_100011315639_100000210303 [1,0,0,0,0,0|2,0,0]=3 443 B11R1.27 CCCOCC1COC(=O)O1 34a_100000210258_100000073702 [1,0,0,0,0,0|2,0,0]=3 444 B11R1.27 CCCOC[C@H]1COC(=O)N1 34a_100000210258_100015307671 [1,0,0,0,0,0|3,0,0]=4 445 B11R1.27 CCCSCC1CNC(=O)O1 62a_100000181169_100000210303 [1,0,0,0,0,0|2,0,0]=3 446 B11R1.27 CCCSCC1CNC(=O)O1 62a_100000210303_100000181169 [1,0,0,0,0,0|2,0,0]=3 447 B11R1.27 CCCSCC1COC(=O)O1 62a_100000073702_100000210303 [1,0,0,0,0,0|2,0,0]=3 448 B11R1.27 CCCSCC1COC(=O)O1 62a_100000210303_100000073702 [1,0,0,0,0,0|2,0,0]=3 449 B11R1.27 CCCSC[C@@H]1CCC(=O)N1 62a_100000210303_100015189358 [1,0,0,0,0,0|2,0,0]=3 450 B11R1.27 CCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000210303 [1,0,0,0,0,0|2,0,0]=3 451 B11R1.27 CCCSC[C@H]1COC(=O)N1 62a_100000210303_100015307671 [1,0,0,0,0,0|3,0,0]=4 452 B11R1.27 CCCSC[C@H]1COC(=O)N1 62a_100015307671_100000210303 [1,0,0,0,0,0|3,0,0]=4 453 B11R1.27 CCOCSC1COC(=O)O1 62a_100000739092_100000032252 [1,0,0,0,0,0|3,0,0]=4 454 B11R1.27 CCSCCC1COS(=O)O1 62a_100000210202_100009840081 [1,0,0,0,0,0|3,0,0]=4 455 B11R1.27 COCCOC1CCC(=O)C1 34a_100012614533_100011201679 [1,0,0,0,0,0|3,0,0]=4 456 B11R1.27 COCCOC1COC(=O)O1 34a_100000210237_100000032252 [1,0,0,0,0,0|3,0,0]=4 457 B11R1.27 COCCSC1COC(=O)O1 62a_100000233755_100000032252 [1,0,0,0,0,0|3,0,0]=4 458 B11R1.27 COCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000766300 [1,0,0,0,0,0|3,0,0]=4 459 B11R1.27 COCSCC1CNC(=O)O1 62a_100000181169_100000766300 [1,0,0,0,0,0|3,0,0]=4 460 B11R1.27 COCSCC1CNC(=O)O1 62a_100000766300_100000181169 [1,0,0,0,0,0|3,0,0]=4 461 B11R1.27 COCSCC1COC(=O)O1 62a_100000073702_100000766300 [1,0,0,0,0,0|3,0,0]=4 462 B11R1.27 COCSCC1COC(=O)O1 62a_100000766300_100000073702 [1,0,0,0,0,0|3,0,0]=4 463 B11R1.27 COCSC[C@@H]1CCC(=O)N1 62a_100000766300_100015189358 [1,0,0,0,0,0|3,0,0]=4 464 B11R1.27 COCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000766300 [1,0,0,0,0,0|3,0,0]=4 465 B11R1.27 CSCCOC1CCC(=O)C1 34a_100012614533_100000212216 [1,0,0,0,0,0|3,0,0]=4 466 B11R1.27 CSCCOC1COC(=O)O1 34a_100000230434_100000032252 [1,0,0,0,0,0|3,0,0]=4 467 B11R1.27 CSCCSC1COC(=O)O1 62a_100000212216_100000032252 [1,0,0,0,0,0|3,0,0]=4 468 B11R1.27 CSCNC[C@H]1CCC(=O)N1 2230a_100015423886_100011218213 [1,0,0,0,0,0|3,0,0]=4 469 B11R1.27 CSCNC[C@H]1CCC(=O)N1 34a_100015423886_100011218213 [1,0,0,0,0,0|3,0,0]=4 470 B11R1.27 CSCOCC1CCC(=O)N1 34a_100000737831_100011218213 [1,0,0,0,0,0|3,0,0]=4 471 B11R1.27 CSCOCC1CNC(=O)O1 34a_100011315639_100011218213 [1,0,0,0,0,0|3,0,0]=4 472 B11R1.27 CSCSCC1CNC(=O)O1 62a_100000181169_100011218213 [1,0,0,0,0,0|3,0,0]=4 473 B11R1.27 CSCSCC1CNC(=O)O1 62a_100011218213_100000181169 [1,0,0,0,0,0|3,0,0]=4 474 B11R1.27 CSCSCC1COC(=O)O1 62a_100000073702_100011218213 [1,0,0,0,0,0|3,0,0]=4 475 B11R1.27 CSCSCC1COC(=O)O1 62a_100011218213_100000073702 [1,0,0,0,0,0|3,0,0]=4 476 B11R1.27 CSCSC[C@@H]1CCC(=O)N1 62a_100011218213_100015189358 [1,0,0,0,0,0|3,0,0]=4 477 B11R1.27 CSCSC[C@@H]1CCC(=O)N1 62a_100015189358_100011218213 [1,0,0,0,0,0|3,0,0]=4 478 B11R1.27 NCCCOC1COC(=O)O1 34a_100000182051_100000032252 [1,0,0,0,0,0|3,0,0]=4 479 B11R1.27 NCCOCC1CNC(=O)O1 34a_100000210304_100000181169 [1,0,0,0,0,0|3,0,0]=4 480 B11R1.27 NCCOCC1COC(=O)O1 34a_100000210304_100000073702 [1,0,0,0,0,0|3,0,0]=4 481 B11R1.27 O=C1CCC(C1)OCCCF 34a_100012614533_100011934791 [1,0,0,0,0,0|3,0,0]=4 482 B11R1.27 O=C1CCC(C1)OCCCO 34a_100012614533_100000230001 [1,0,0,0,0,0|3,0,0]=4 483 B11R1.27 O=C1CCC(N1)COCCF 34a_100000737831_100011217306 [1,0,0,0,0,0|3,0,0]=4 484 B11R1.27 O=C1CCC(N1)COCCO 34a_100000737831_100000211926 [1,0,0,0,0,0|3,0,0]=4 485 B11R1.27 O=C1CC[C@@H](N1)CNCCF 2230a_100015423886_100011217306 [1,0,0,0,0,0|3,0,0]=4 486 B11R1.27 O=C1CC[C@@H](N1)CNCCF 34a_100015423886_100011217306 [1,0,0,0,0,0|3,0,0]=4 487 B11R1.27 O=C1CC[C@@H](N1)CNCCO 2230a_100015423886_100000211926 [1,0,0,0,0,0|3,0,0]=4 488 B11R1.27 O=C1CC[C@@H](N1)CNCCO 34a_100015423886_100000211926 [1,0,0,0,0,0|3,0,0]=4 489 B11R1.27 O=C1CC[C@H](N1)CNCCO 2230a_100016997473_100015189358 [1,0,0,0,0,0|3,0,0]=4 490 B11R1.27 O=C1CC[C@H](N1)CSCCF 62a_100011217306_100015189358 [1,0,0,0,0,0|3,0,0]=4 491 B11R1.27 O=C1CC[C@H](N1)CSCCF 62a_100015189358_100011217306 [1,0,0,0,0,0|3,0,0]=4 492 B11R1.27 O=C1CC[C@H](N1)CSCCO 62a_100000211926_100015189358 [1,0,0,0,0,0|3,0,0]=4 493 B11R1.27 O=C1CC[C@H](N1)CSCCO 62a_100015189358_100000211926 [1,0,0,0,0,0|3,0,0]=4 494 B11R1.27 O=C1NCC(O1)CNCCF 34a_100000724931_100000181169 [1,0,0,0,0,0|3,0,0]=4 495 B11R1.27 O=C1NCC(O1)CNCCO 2230a_100016997473_100000181169 [1,0,0,0,0,0|3,0,0]=4 496 B11R1.27 O=C1NCC(O1)CNCCO 34a_100016990907_100000181169 [1,0,0,0,0,0|3,0,0]=4 497 B11R1.27 O=C1NCC(O1)COCCBr 34a_100000211926_100000181169 [1,0,0,0,0,0|3,0,0]=4 498 B11R1.27 O=C1NCC(O1)COCCF 34a_100011315639_100011217306 [1,0,0,0,0,0|3,0,0]=4 499 B11R1.27 O=C1NCC(O1)COCCO 34a_100011315639_100000211926 [1,0,0,0,0,0|3,0,0]=4 500 B11R1.27 O=C1NCC(O1)CSCCF 62a_100000181169_100011217306 [1,0,0,0,0,0|3,0,0]=4 501 B11R1.27 O=C1NCC(O1)CSCCF 62a_100011217306_100000181169 [1,0,0,0,0,0|3,0,0]=4 502 B11R1.27 O=C1NCC(O1)CSCCO 62a_100000181169_100000211926 [1,0,0,0,0,0|3,0,0]=4 503 B11R1.27 O=C1NCC(O1)CSCCO 62a_100000211926_100000181169 [1,0,0,0,0,0|3,0,0]=4 504 B11R1.27 O=C1OCC(O1)CNCCF 34a_100000724931_100000073702 [1,0,0,0,0,0|3,0,0]=4 505 B11R1.27 O=C1OCC(O1)CNCCO 34a_100016990907_100000073702 [1,0,0,0,0,0|3,0,0]=4 506 B11R1.27 O=C1OCC(O1)COCCBr 34a_100000211926_100000073702 [1,0,0,0,0,0|3,0,0]=4 507 B11R1.27 O=C1OCC(O1)CSCCF 62a_100000073702_100011217306 [1,0,0,0,0,0|3,0,0]=4 508 B11R1.27 O=C1OCC(O1)CSCCF 62a_100011217306_100000073702 [1,0,0,0,0,0|3,0,0]=4 509 B11R1.27 O=C1OCC(O1)CSCCO 62a_100000073702_100000211926 [1,0,0,0,0,0|3,0,0]=4 510 B11R1.27 O=C1OCC(O1)CSCCO 62a_100000211926_100000073702 [1,0,0,0,0,0|3,0,0]=4 511 B11R1.27 O=C1OCC(O1)NCCCF 34a_100015189416_100000032252 [1,0,0,0,0,0|3,0,0]=4 512 B11R1.27 O=C1OCC(O1)OCCCBr 34a_100011217188_100000032252 [1,0,0,0,0,0|3,0,0]=4 513 B11R1.27 O=C1OCC(O1)OCCCCl 34a_100000230001_100000032252 [1,0,0,0,0,0|3,0,0]=4 514 B11R1.27 O=C1OCC(O1)OCCCF 34a_100000759539_100000032252 [1,0,0,0,0,0|3,0,0]=4 515 B11R1.27 O=C1OCC(O1)SCCCF 62a_100011934791_100000032252 [1,0,0,0,0,0|3,0,0]=4 516 B11R1.27 O=C1OCC(O1)SCCCO 62a_100011215043_100000032252 [1,0,0,0,0,0|3,0,0]=4 517 B13R1.23 C#CCCCC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_100000731252 [0,1,0,0,0,0|0,0,3]=4 518 B13R1.23 C=CCCCC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_100000757094 [0,1,0,0,0,0|0,0,3]=4 519 B13R1.23 CC/C=C\CC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_100103147603 [0,1,0,0,0,0|0,0,3]=4 520 B13R1.23 CCC#CCC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_100009813939 [0,1,0,0,0,0|0,0,3]=4 521 B13R1.23 CCCCCC(=O)C1CCC(=O)N1 1458a_100000210400_100000210326 [0,1,0,0,0,0|1,0,1]=3 522 B13R1.23 CCCCCC(=O)C1CNC(=O)C1 1458a_100000747279_100000210326 [0,1,0,0,0,0|2,0,1]=4 523 B13R1.23 CCCCCC(=O)C1CNC(=O)N1 1458a_100000033324_100000210326 [0,1,0,0,0,0|2,0,1]=4 524 B13R1.23 CCCCCC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_100000210326 [0,1,0,0,0,0|0,0,1]=2 525 B13R1.23 CCCCCC(=O)[C@@H]1CSC(=O)N1 1458a_100000735014_100000210326 [0,1,0,0,0,0|2,0,1]=4 526 B13R1.23 CCCCCC(C)N1CNC(=O)C1 2230a_200000708111_200011218191 [0,1,0,0,0,0|3,0,0]=4 527 B13R1.23 CCCCNC(=O)C1CCC(=O)N1 240690a_100000102301_100000210400 [0,1,0,0,0,0|2,0,1]=4 528 B13R1.23 CCCCNC(=O)[C@@H]1CCC(=O)O1 11a_100000102301_100009814974 [0,1,0,0,0,0|1,0,1]=3 529 B13R1.23 CCCCNC(=O)[C@@H]1CCC(=O)O1 1626a_100000102301_100009814974 [0,1,0,0,0,0|1,0,1]=3 530 B13R1.23 CCCCNC(=O)[C@@H]1CCC(=O)O1 240690a_100000102301_100009814974 [0,1,0,0,0,0|1,0,1]=3 531 B13R1.23 CCCCNC(=O)[C@@H]1CCC(=O)O1 527a_100000102301_100009814974 [0,1,0,0,0,0|1,0,1]=3 532 B13R1.23 CCCNNC(=O)[C@@H]1CCC(=O)O1 22a_100000740057_100009814974 [0,1,0,0,0,0|2,0,1]=4 533 B13R1.23 CCOCCC(=O)C1CCC(=O)N1 1458a_100000210400_100011215890 [0,1,0,0,0,0|2,0,1]=4 534 B13R1.23 CCOCCC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_100011215890 [0,1,0,0,0,0|1,0,1]=3 535 B13R1.23 CCSCCC(=O)C1CCC(=O)N1 1458a_100000210400_100000757381 [0,1,0,0,0,0|2,0,1]=4 536 B13R1.23 CCSCCC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_100000757381 [0,1,0,0,0,0|1,0,1]=3 537 B13R1.23 COCCCC(=O)C1CCC(=O)N1 1458a_100000210400_100000740836 [0,1,0,0,0,0|2,0,1]=4 538 B13R1.23 COCCCC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_100000740836 [0,1,0,0,0,0|1,0,1]=3 539 B13R1.23 COCCNC(=O)[C@@H]1CCC(=O)O1 1626a_100000209980_100009814974 [0,1,0,0,0,0|2,0,1]=4 540 B13R1.23 COCCNC(=O)[C@@H]1CCC(=O)O1 240690a_100000209980_100009814974 [0,1,0,0,0,0|2,0,1]=4 541 B13R1.23 COCCNC(=O)[C@@H]1CCC(=O)O1 527a_100000209980_100009814974 [0,1,0,0,0,0|2,0,1]=4 542 B13R1.23 CSCCNC(=O)[C@@H]1CCC(=O)O1 11a_100020590264_100009814974 [0,1,0,0,0,0|2,0,1]=4 543 B13R1.23 CSCCNC(=O)[C@@H]1CCC(=O)O1 1626a_100020590264_100009814974 [0,1,0,0,0,0|2,0,1]=4 544 B13R1.23 CSCCNC(=O)[C@@H]1CCC(=O)O1 240690a_100020590264_100009814974 [0,1,0,0,0,0|2,0,1]=4 545 B13R1.23 CSCCNC(=O)[C@@H]1CCC(=O)O1 527a_100020590264_100009814974 [0,1,0,0,0,0|2,0,1]=4 546 B13R1.23 N#CCCCC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_100000211468 [0,1,0,0,0,0|1,0,2]=4 547 B13R1.23 O=C1CCC(N1)C(=O)CCCCF 1458a_100000210400_100000729493 [0,1,0,0,0,0|2,0,1]=4 548 B13R1.23 O=C1CCC(N1)C(=O)CCCCO 1458a_100000210400_100000210776 [0,1,0,0,0,0|2,0,1]=4 549 B13R1.23 O=C1CC[C@H](O1)C(=O)CCCCF 1458a_100009814974_100000729493 [0,1,0,0,0,0|1,0,1]=3 550 B13R1.23 O=C1CC[C@H](O1)C(=O)CCCCO 1458a_100009814974_100000210776 [0,1,0,0,0,0|1,0,1]=3 551 B13R1.23 O=C1CC[C@H](O1)C(=O)NCCCF 11a_100015189416_100009814974 [0,1,0,0,0,0|2,0,1]=4 552 B13R1.23 O=C1CC[C@H](O1)C(=O)NCCCF 1626a_100015189416_100009814974 [0,1,0,0,0,0|2,0,1]=4 553 B13R1.23 O=C1CC[C@H](O1)C(=O)NCCCF 240690a_100015189416_100009814974 [0,1,0,0,0,0|2,0,1]=4 554 B13R1.23 O=C1CC[C@H](O1)C(=O)NCCCF 527a_100015189416_100009814974 [0,1,0,0,0,0|2,0,1]=4 555 B13R1.23 O=C1CC[C@H](O1)C(=O)NCCCO 240690a_100000182051_100009814974 [0,1,0,0,0,0|2,0,1]=4 556 B13R1.23 O=C1CC[C@H](O1)C(=O)NCCCO 527a_100000182051_100009814974 [0,1,0,0,0,0|2,0,1]=4 557 B13R1.27 C#CCCCCNC1COC(=O)O1 34a_100000706060_100000032252 [0,1,0,0,0,0|1,0,2]=4 558 B13R1.27 C#CCCCCOC1CCC(=O)C1 34a_100012614533_100010269958 [0,1,0,0,0,0|1,0,2]=4 559 B13R1.27 C#CCCCCOC1COC(=O)O1 34a_100000766709_100000032252 [0,1,0,0,0,0|1,0,2]=4 560 B13R1.27 C#CCCCCSC1COC(=O)O1 62a_100010269958_100000032252 [0,1,0,0,0,0|1,0,2]=4 561 B13R1.27 C#CCCCNCC1CNC(=O)O1 34a_100000718082_100000181169 [0,1,0,0,0,0|1,0,2]=4 562 B13R1.27 C#CCCCNCC1COC(=O)O1 34a_100000718082_100000073702 [0,1,0,0,0,0|1,0,2]=4 563 B13R1.27 C#CCCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000731252 [0,1,0,0,0,0|1,0,2]=4 564 B13R1.27 C#CCCCNC[C@H]1CCC(=O)N1 34a_100015423886_100000695029 [0,1,0,0,0,0|1,0,2]=4 565 B13R1.27 C#CCCCOCC1CCC(=O)N1 34a_100000737831_100000695029 [0,1,0,0,0,0|1,0,2]=4 566 B13R1.27 C#CCCCOCC1CNC(=O)O1 34a_100000215630_100000181169 [0,1,0,0,0,0|1,0,2]=4 567 B13R1.27 C#CCCCOCC1CNC(=O)O1 34a_100011315639_100000695029 [0,1,0,0,0,0|1,0,2]=4 568 B13R1.27 C#CCCCOCC1CNC(=O)O1 7a_100000215630_100000181169 [0,1,0,0,0,0|1,0,2]=4 569 B13R1.27 C#CCCCOCC1COC(=O)O1 34a_100000215630_100000073702 [0,1,0,0,0,0|1,0,2]=4 570 B13R1.27 C#CCCCOC[C@@H]1CCC(=O)N1 7a_100000215630_100015189358 [0,1,0,0,0,0|1,0,2]=4 571 B13R1.27 C#CCCCSCC1CNC(=O)O1 62a_100000181169_100011215417 [0,1,0,0,0,0|1,0,2]=4 572 B13R1.27 C#CCCCSCC1CNC(=O)O1 62a_100011215417_100000181169 [0,1,0,0,0,0|1,0,2]=4 573 B13R1.27 C#CCCCSCC1COC(=O)O1 62a_100000073702_100011215417 [0,1,0,0,0,0|1,0,2]=4 574 B13R1.27 C#CCCCSCC1COC(=O)O1 62a_100011215417_100000073702 [0,1,0,0,0,0|1,0,2]=4 575 B13R1.27 C#CCCCSC[C@@H]1CCC(=O)N1 62a_100011215417_100015189358 [0,1,0,0,0,0|1,0,2]=4 576 B13R1.27 C#CCCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100011215417 [0,1,0,0,0,0|1,0,2]=4 577 B13R1.27 C/C=C/CCOCC1CNC(=O)O1 34a_100016278192_100000181169 [0,1,0,0,0,0|1,0,2]=4 578 B13R1.27 C/C=C/CCOCC1COC(=O)O1 34a_100016278192_100000073702 [0,1,0,0,0,0|1,0,2]=4 579 B13R1.27 C=CCCCCNC1COC(=O)O1 34a_100000703577_100000032252 [0,1,0,0,0,0|1,0,2]=4 580 B13R1.27 C=CCCCCOC1CCC(=O)C1 34a_100012614533_100011215482 [0,1,0,0,0,0|1,0,2]=4 581 B13R1.27 C=CCCCCOC1COC(=O)O1 34a_100000766645_100000032252 [0,1,0,0,0,0|1,0,2]=4 582 B13R1.27 C=CCCCCSC1COC(=O)O1 62a_100011215482_100000032252 [0,1,0,0,0,0|1,0,2]=4 583 B13R1.27 C=CCCCNCC1CNC(=O)O1 2230a_100000700776_100000181169 [0,1,0,0,0,0|1,0,2]=4 584 B13R1.27 C=CCCCNCC1CNC(=O)O1 34a_100000700776_100000181169 [0,1,0,0,0,0|1,0,2]=4 585 B13R1.27 C=CCCCNCC1COC(=O)O1 34a_100000700776_100000073702 [0,1,0,0,0,0|1,0,2]=4 586 B13R1.27 C=CCCCNC[C@@H]1CCC(=O)N1 2230a_100000700776_100015189358 [0,1,0,0,0,0|1,0,2]=4 587 B13R1.27 C=CCCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100011713584 [0,1,0,0,0,0|1,0,2]=4 588 B13R1.27 C=CCCCNC[C@H]1CCC(=O)N1 34a_100015423886_100000757094 [0,1,0,0,0,0|1,0,2]=4 589 B13R1.27 C=CCCCOCC1CCC(=O)N1 34a_100000737831_100000757094 [0,1,0,0,0,0|1,0,2]=4 590 B13R1.27 C=CCCCOCC1CNC(=O)O1 34a_100000758997_100000181169 [0,1,0,0,0,0|1,0,2]=4 591 B13R1.27 C=CCCCOCC1CNC(=O)O1 34a_100011315639_100000757094 [0,1,0,0,0,0|1,0,2]=4 592 B13R1.27 C=CCCCOCC1CNC(=O)O1 7a_100000758997_100000181169 [0,1,0,0,0,0|1,0,2]=4 593 B13R1.27 C=CCCCOCC1COC(=O)O1 34a_100000758997_100000073702 [0,1,0,0,0,0|1,0,2]=4 594 B13R1.27 C=CCCCOC[C@@H]1CCC(=O)N1 7a_100000758997_100015189358 [0,1,0,0,0,0|1,0,2]=4 595 B13R1.27 C=CCCCSCC1CNC(=O)O1 62a_100000181169_100000757094 [0,1,0,0,0,0|1,0,2]=4 596 B13R1.27 C=CCCCSCC1CNC(=O)O1 62a_100011713584_100000181169 [0,1,0,0,0,0|1,0,2]=4 597 B13R1.27 C=CCCCSCC1COC(=O)O1 62a_100000073702_100000757094 [0,1,0,0,0,0|1,0,2]=4 598 B13R1.27 C=CCCCSCC1COC(=O)O1 62a_100011713584_100000073702 [0,1,0,0,0,0|1,0,2]=4 599 B13R1.27 C=CCCCSC[C@@H]1CCC(=O)N1 62a_100011713584_100015189358 [0,1,0,0,0,0|1,0,2]=4 600 B13R1.27 C=CCCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000757094 [0,1,0,0,0,0|1,0,2]=4 601 B13R1.27 CC#CCCOCC1CNC(=O)O1 34a_100000750427_100000181169 [0,1,0,0,0,0|1,0,2]=4 602 B13R1.27 CC#CCCOCC1COC(=O)O1 34a_100000750427_100000073702 [0,1,0,0,0,0|1,0,2]=4 603 B13R1.27 CC/C=C\CCOC1CCC(=O)C1 34a_100012614533_100015370543 [0,1,0,0,0,0|1,0,2]=4 604 B13R1.27 CC/C=C\CCOC1COC(=O)O1 34a_100016288707_100000032252 [0,1,0,0,0,0|1,0,2]=4 605 B13R1.27 CC/C=C\CCSC1COC(=O)O1 62a_100015370543_100000032252 [0,1,0,0,0,0|1,0,2]=4 606 B13R1.27 CC/C=C\CNC[C@H]1CCC(=O)N1 2230a_100015423886_100103147603 [0,1,0,0,0,0|1,0,2]=4 607 B13R1.27 CC/C=C\CNC[C@H]1CCC(=O)N1 34a_100015423886_100103147603 [0,1,0,0,0,0|1,0,2]=4 608 B13R1.27 CC/C=C\COCC1CCC(=O)N1 34a_100000737831_100103147603 [0,1,0,0,0,0|1,0,2]=4 609 B13R1.27 CC/C=C\COCC1CNC(=O)O1 34a_100011315639_100103147603 [0,1,0,0,0,0|1,0,2]=4 610 B13R1.27 CC/C=C\COCC1CNC(=O)O1 34a_100016268518_100000181169 [0,1,0,0,0,0|1,0,2]=4 611 B13R1.27 CC/C=C\COCC1COC(=O)O1 34a_100016268518_100000073702 [0,1,0,0,0,0|1,0,2]=4 612 B13R1.27 CC/C=C\CSCC1CNC(=O)O1 62a_100000181169_100103147603 [0,1,0,0,0,0|1,0,2]=4 613 B13R1.27 CC/C=C\CSCC1CNC(=O)O1 62a_100103147603_100000181169 [0,1,0,0,0,0|1,0,2]=4 614 B13R1.27 CC/C=C\CSCC1COC(=O)O1 62a_100000073702_100103147603 [0,1,0,0,0,0|1,0,2]=4 615 B13R1.27 CC/C=C\CSCC1COC(=O)O1 62a_100103147603_100000073702 [0,1,0,0,0,0|1,0,2]=4 616 B13R1.27 CC/C=C\CSC[C@@H]1CCC(=O)N1 62a_100015189358_100103147603 [0,1,0,0,0,0|1,0,2]=4 617 B13R1.27 CC/C=C\CSC[C@@H]1CCC(=O)N1 62a_100103147603_100015189358 [0,1,0,0,0,0|1,0,2]=4 618 B13R1.27 CC=CCCCOC1COC(=O)O1 34a_100020645299_100000032252 [0,1,0,0,0,0|1,0,2]=4 619 B13R1.27 CCC#CCCOC1COC(=O)O1 34a_100000036655_100000032252 [0,1,0,0,0,0|1,0,2]=4 620 B13R1.27 CCC#CCNC[C@H]1CCC(=O)N1 2230a_100015423886_100009813939 [0,1,0,0,0,0|1,0,2]=4 621 B13R1.27 CCC#CCNC[C@H]1CCC(=O)N1 34a_100015423886_100009813939 [0,1,0,0,0,0|1,0,2]=4 622 B13R1.27 CCC#CCOCC1CCC(=O)N1 34a_100000737831_100009813939 [0,1,0,0,0,0|1,0,2]=4 623 B13R1.27 CCC#CCOCC1CNC(=O)O1 34a_100000032950_100000181169 [0,1,0,0,0,0|1,0,2]=4 624 B13R1.27 CCC#CCOCC1CNC(=O)O1 34a_100011315639_100009813939 [0,1,0,0,0,0|1,0,2]=4 625 B13R1.27 CCC#CCOCC1COC(=O)O1 34a_100000032950_100000073702 [0,1,0,0,0,0|1,0,2]=4 626 B13R1.27 CCC#CCSCC1CNC(=O)O1 62a_100000181169_100009813939 [0,1,0,0,0,0|1,0,2]=4 627 B13R1.27 CCC#CCSCC1CNC(=O)O1 62a_100009813939_100000181169 [0,1,0,0,0,0|1,0,2]=4 628 B13R1.27 CCC#CCSCC1COC(=O)O1 62a_100000073702_100009813939 [0,1,0,0,0,0|1,0,2]=4 629 B13R1.27 CCC#CCSCC1COC(=O)O1 62a_100009813939_100000073702 [0,1,0,0,0,0|1,0,2]=4 630 B13R1.27 CCC#CCSC[C@@H]1CCC(=O)N1 62a_100009813939_100015189358 [0,1,0,0,0,0|1,0,2]=4 631 B13R1.27 CCC#CCSC[C@@H]1CCC(=O)N1 62a_100015189358_100009813939 [0,1,0,0,0,0|1,0,2]=4 632 B13R1.27 CCC/C=C/COC1COC(=O)O1 34a_100016278788_100000032252 [0,1,0,0,0,0|1,0,2]=4 633 B13R1.27 CCCC#CCOC1COC(=O)O1 34a_100000034806_100000032252 [0,1,0,0,0,0|1,0,2]=4 634 B13R1.27 CCCCCCCN1CNC(=O)C1 2230a_200000708111_100000210681 [0,1,0,0,0,0|3,0,0]=4 635 B13R1.27 CCCCCCNC1CCC(C1)C 270004a_100000210581_100011215218 [0,1,0,0,0,0|2,0,1]=4 636 B13R1.27 CCCCCCNC1CCC(C1)O 270004a_100000210581_100012614533 [0,1,0,0,0,0|1,0,2]=4 637 B13R1.27 CCCCCCNC1CNC(=O)C1 2230a_100000697751_100000210314 [0,1,0,0,0,0|2,0,0]=3 638 B13R1.27 CCCCCCN[C@H]1CC[C@H](C1)O 2230a_100015195300_100000210314 [0,1,0,0,0,0|1,0,2]=4 639 B13R1.27 CCCCCCOC1CCC(=O)C1 34a_100012614533_100000210314 [0,1,0,0,0,0|1,0,0]=2 640 B13R1.27 CCCCCCOC1CCC(C1)C 34a_100000698185_100000210314 [0,1,0,0,0,0|2,0,1]=4 641 B13R1.27 CCCCCCOC1CCN(C1)C 7a_100000210259_200012183744 [0,1,0,0,0,0|3,0,0]=4 642 B13R1.27 CCCCCCOC1CNC(=O)C1 34a_100000690082_100000210314 [0,1,0,0,0,0|2,0,0]=3 643 B13R1.27 CCCCCCOC1COC(=O)O1 34a_100000210259_100000032252 [0,1,0,0,0,0|1,0,0]=2 644 B13R1.27 CCCCCCSC1CCN(C1)C 62a_100000210314_200012183744 [0,1,0,0,0,0|3,0,0]=4 645 B13R1.27 CCCCCCSC1COC(=O)O1 62a_100000210314_100000032252 [0,1,0,0,0,0|1,0,0]=2 646 B13R1.27 CCCCCNCC1CNC(=O)C1 2230a_100016993742_100000210326 [0,1,0,0,0,0|2,0,0]=3 647 B13R1.27 CCCCCNCC1CNC(=O)C1 34a_100016993742_100000718602 [0,1,0,0,0,0|2,0,0]=3 648 B13R1.27 CCCCCNCC1CNC(=O)O1 2230a_100000209983_100000181169 [0,1,0,0,0,0|1,0,0]=2 649 B13R1.27 CCCCCNC[C@@H]1CCC(=O)N1 2230a_100000209983_100015189358 [0,1,0,0,0,0|1,0,0]=2 650 B13R1.27 CCCCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000210326 [0,1,0,0,0,0|1,0,0]=2 651 B13R1.27 CCCCCNC[C@H]1CCC(=O)N1 34a_100015423886_100000718602 [0,1,0,0,0,0|1,0,0]=2 652 B13R1.27 CCCCCNC[C@H]1COC(=O)N1 2230a_100000209983_100015307671 [0,1,0,0,0,0|2,0,0]=3 653 B13R1.27 CCCCCOCC1=CC(=O)OC1 34a_100000210253_100000716558 [0,1,0,0,0,0|2,0,1]=4 654 B13R1.27 CCCCCOCC1CCC(=O)N1 34a_100000737831_100000718602 [0,1,0,0,0,0|1,0,0]=2 655 B13R1.27 CCCCCOCC1CCN(C1)C 34a_100000210253_200000690779 [0,1,0,0,0,0|3,0,0]=4 656 B13R1.27 CCCCCOCC1CCN(C1)C 7a_100000210253_200000690779 [0,1,0,0,0,0|3,0,0]=4 657 B13R1.27 CCCCCOCC1CNC(=O)C1 34a_100016041077_100000718602 [0,1,0,0,0,0|2,0,0]=3 658 B13R1.27 CCCCCOCC1CNC(=O)O1 34a_100000210253_100000181169 [0,1,0,0,0,0|1,0,0]=2 659 B13R1.27 CCCCCOCC1CNC(=O)O1 34a_100011315639_100000718602 [0,1,0,0,0,0|1,0,0]=2 660 B13R1.27 CCCCCOCC1CNC(=O)O1 7a_100000210253_100000181169 [0,1,0,0,0,0|1,0,0]=2 661 B13R1.27 CCCCCOCC1COC(=O)O1 34a_100000210253_100000073702 [0,1,0,0,0,0|1,0,0]=2 662 B13R1.27 CCCCCOC[C@@H]1CCC(=O)N1 7a_100000210253_100015189358 [0,1,0,0,0,0|1,0,0]=2 663 B13R1.27 CCCCCOC[C@H]1COC(=O)N1 34a_100000210253_100015307671 [0,1,0,0,0,0|2,0,0]=3 664 B13R1.27 CCCCCOC[C@H]1COC(=O)N1 7a_100000210253_100015307671 [0,1,0,0,0,0|2,0,0]=3 665 B13R1.27 CCCCCSCC1=CC(=O)OC1 62a_100000210326_100000716558 [0,1,0,0,0,0|2,0,1]=4 666 B13R1.27 CCCCCSCC1=CC(=O)OC1 62a_100000716558_100000210326 [0,1,0,0,0,0|2,0,1]=4 667 B13R1.27 CCCCCSCC1CCN(C1)C 62a_100000210326_200000690779 [0,1,0,0,0,0|3,0,0]=4 668 B13R1.27 CCCCCSCC1CCN(C1)C 62a_200000690779_100000210326 [0,1,0,0,0,0|3,0,0]=4 669 B13R1.27 CCCCCSCC1CNC(=O)O1 62a_100000181169_100000210326 [0,1,0,0,0,0|1,0,0]=2 670 B13R1.27 CCCCCSCC1CNC(=O)O1 62a_100000210326_100000181169 [0,1,0,0,0,0|1,0,0]=2 671 B13R1.27 CCCCCSCC1COC(=O)O1 62a_100000073702_100000210326 [0,1,0,0,0,0|1,0,0]=2 672 B13R1.27 CCCCCSCC1COC(=O)O1 62a_100000210326_100000073702 [0,1,0,0,0,0|1,0,0]=2 673 B13R1.27 CCCCCSC[C@@H]1CCC(=O)N1 62a_100000210326_100015189358 [0,1,0,0,0,0|1,0,0]=2 674 B13R1.27 CCCCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000210326 [0,1,0,0,0,0|1,0,0]=2 675 B13R1.27 CCCCCSC[C@H]1COC(=O)N1 62a_100000210326_100015307671 [0,1,0,0,0,0|2,0,0]=3 676 B13R1.27 CCCCCSC[C@H]1COC(=O)N1 62a_100015307671_100000210326 [0,1,0,0,0,0|2,0,0]=3 677 B13R1.27 CCCCNCCC1COS(=O)O1 7a_106832991798_100009840081 [0,1,0,0,0,0|2,0,0]=3 678 B13R1.27 CCCCOCCC1COS(=O)O1 7a_100000210227_100009840081 [0,1,0,0,0,0|2,0,0]=3 679 B13R1.27 CCCCOCCN1CNC(=O)C1 2230a_200000708111_100000743108 [0,1,0,0,0,0|3,0,0]=4 680 B13R1.27 CCCCOCNC1CNC(=O)C1 2230a_100000697751_100011995733 [0,1,0,0,0,0|3,0,0]=4 681 B13R1.27 CCCCOCOC1CCC(=O)C1 34a_100012614533_100011995733 [0,1,0,0,0,0|2,0,0]=3 682 B13R1.27 CCCCOCOC1CNC(=O)C1 34a_100000690082_100011995733 [0,1,0,0,0,0|3,0,0]=4 683 B13R1.27 CCCCOCSC1COC(=O)O1 62a_100011995733_100000032252 [0,1,0,0,0,0|2,0,0]=3 684 B13R1.27 CCCCSCCC1COS(=O)O1 62a_100000210211_100009840081 [0,1,0,0,0,0|2,0,0]=3 685 B13R1.27 CCCOCCNC1CNC(=O)C1 2230a_100000697751_100011215938 [0,1,0,0,0,0|3,0,0]=4 686 B13R1.27 CCCOCCNC1COC(=O)O1 34a_100161115042_100000032252 [0,1,0,0,0,0|2,0,0]=3 687 B13R1.27 CCCOCCOC1CCC(=O)C1 34a_100012614533_100011215938 [0,1,0,0,0,0|2,0,0]=3 688 B13R1.27 CCCOCCOC1CNC(=O)C1 34a_100000690082_100011215938 [0,1,0,0,0,0|3,0,0]=4 689 B13R1.27 CCCOCCOC1COC(=O)O1 34a_100000752267_100000032252 [0,1,0,0,0,0|2,0,0]=3 690 B13R1.27 CCCOCCSC1COC(=O)O1 62a_100011215938_100000032252 [0,1,0,0,0,0|2,0,0]=3 691 B13R1.27 CCCSCCOC1COC(=O)O1 34a_200000230433_100000032252 [0,1,0,0,0,0|2,0,0]=3 692 B13R1.27 CCOCCCNC1CNC(=O)C1 2230a_100000697751_100012232248 [0,1,0,0,0,0|3,0,0]=4 693 B13R1.27 CCOCCCNC1COC(=O)O1 34a_100000210961_100000032252 [0,1,0,0,0,0|2,0,0]=3 694 B13R1.27 CCOCCCOC1CCC(=O)C1 34a_100012614533_100012232248 [0,1,0,0,0,0|2,0,0]=3 695 B13R1.27 CCOCCCOC1CNC(=O)C1 34a_100000690082_100012232248 [0,1,0,0,0,0|3,0,0]=4 696 B13R1.27 CCOCCCOC1COC(=O)O1 34a_100000757476_100000032252 [0,1,0,0,0,0|2,0,0]=3 697 B13R1.27 CCOCCCSC1COC(=O)O1 62a_100012232248_100000032252 [0,1,0,0,0,0|2,0,0]=3 698 B13R1.27 CCOCCNCC1CNC(=O)C1 2230a_100016993742_100011215890 [0,1,0,0,0,0|3,0,0]=4 699 B13R1.27 CCOCCNCC1CNC(=O)C1 34a_100016993742_100000210147 [0,1,0,0,0,0|3,0,0]=4 700 B13R1.27 CCOCCNCC1CNC(=O)O1 2230a_102516460346_100000181169 [0,1,0,0,0,0|2,0,0]=3 701 B13R1.27 CCOCCNCC1CNC(=O)O1 34a_102516460346_100000181169 [0,1,0,0,0,0|2,0,0]=3 702 B13R1.27 CCOCCNCC1COC(=O)O1 34a_102516460346_100000073702 [0,1,0,0,0,0|2,0,0]=3 703 B13R1.27 CCOCCNC[C@@H]1CCC(=O)N1 2230a_102516460346_100015189358 [0,1,0,0,0,0|2,0,0]=3 704 B13R1.27 CCOCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100011215890 [0,1,0,0,0,0|2,0,0]=3 705 B13R1.27 CCOCCNC[C@H]1CCC(=O)N1 34a_100015423886_100000210147 [0,1,0,0,0,0|2,0,0]=3 706 B13R1.27 CCOCCNC[C@H]1COC(=O)N1 2230a_102516460346_100015307671 [0,1,0,0,0,0|3,0,0]=4 707 B13R1.27 CCOCCNC[C@H]1COC(=O)N1 34a_102516460346_100015307671 [0,1,0,0,0,0|3,0,0]=4 708 B13R1.27 CCOCCOCC1CCC(=O)N1 34a_100000737831_100000210147 [0,1,0,0,0,0|2,0,0]=3 709 B13R1.27 CCOCCOCC1CNC(=O)C1 34a_100016041077_100000210147 [0,1,0,0,0,0|3,0,0]=4 710 B13R1.27 CCOCCOCC1CNC(=O)O1 34a_100000210136_100000181169 [0,1,0,0,0,0|2,0,0]=3 711 B13R1.27 CCOCCOCC1CNC(=O)O1 34a_100011315639_100000210147 [0,1,0,0,0,0|2,0,0]=3 712 B13R1.27 CCOCCOCC1CNC(=O)O1 7a_100000210136_100000181169 [0,1,0,0,0,0|2,0,0]=3 713 B13R1.27 CCOCCOCC1COC(=O)O1 34a_100000210136_100000073702 [0,1,0,0,0,0|2,0,0]=3 714 B13R1.27 CCOCCOC[C@@H]1CCC(=O)N1 7a_100000210136_100015189358 [0,1,0,0,0,0|2,0,0]=3 715 B13R1.27 CCOCCOC[C@H]1COC(=O)N1 34a_100000210136_100015307671 [0,1,0,0,0,0|3,0,0]=4 716 B13R1.27 CCOCCOC[C@H]1COC(=O)N1 7a_100000210136_100015307671 [0,1,0,0,0,0|3,0,0]=4 717 B13R1.27 CCOCCSCC1CNC(=O)O1 62a_100000181169_100011215890 [0,1,0,0,0,0|2,0,0]=3 718 B13R1.27 CCOCCSCC1CNC(=O)O1 62a_100000210147_100000181169 [0,1,0,0,0,0|2,0,0]=3 719 B13R1.27 CCOCCSCC1COC(=O)O1 62a_100000073702_100011215890 [0,1,0,0,0,0|2,0,0]=3 720 B13R1.27 CCOCCSCC1COC(=O)O1 62a_100000210147_100000073702 [0,1,0,0,0,0|2,0,0]=3 721 B13R1.27 CCOCCSC[C@@H]1CCC(=O)N1 62a_100000210147_100015189358 [0,1,0,0,0,0|2,0,0]=3 722 B13R1.27 CCOCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100011215890 [0,1,0,0,0,0|2,0,0]=3 723 B13R1.27 CCOCCSC[C@H]1COC(=O)N1 62a_100000210147_100015307671 [0,1,0,0,0,0|3,0,0]=4 724 B13R1.27 CCOCCSC[C@H]1COC(=O)N1 62a_100015307671_100011215890 [0,1,0,0,0,0|3,0,0]=4 725 B13R1.27 CCOCSCCC1COS(=O)O1 62a_100000739092_100009840081 [0,1,0,0,0,0|3,0,0]=4 726 B13R1.27 CCSCCCOC1COC(=O)O1 34a_100011216438_100000032252 [0,1,0,0,0,0|2,0,0]=3 727 B13R1.27 CCSCCNCC1CNC(=O)C1 2230a_100016993742_100000757381 [0,1,0,0,0,0|3,0,0]=4 728 B13R1.27 CCSCCNCC1CNC(=O)C1 34a_100016993742_100000757381 [0,1,0,0,0,0|3,0,0]=4 729 B13R1.27 CCSCCNCC1CNC(=O)O1 2230a_100000106463_100000181169 [0,1,0,0,0,0|2,0,0]=3 730 B13R1.27 CCSCCNC[C@@H]1CCC(=O)N1 2230a_100000106463_100015189358 [0,1,0,0,0,0|2,0,0]=3 731 B13R1.27 CCSCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000757381 [0,1,0,0,0,0|2,0,0]=3 732 B13R1.27 CCSCCNC[C@H]1CCC(=O)N1 34a_100015423886_100000757381 [0,1,0,0,0,0|2,0,0]=3 733 B13R1.27 CCSCCNC[C@H]1COC(=O)N1 2230a_100000106463_100015307671 [0,1,0,0,0,0|3,0,0]=4 734 B13R1.27 CCSCCOCC1CCC(=O)N1 34a_100000737831_100000757381 [0,1,0,0,0,0|2,0,0]=3 735 B13R1.27 CCSCCOCC1CNC(=O)C1 34a_100016041077_100000757381 [0,1,0,0,0,0|3,0,0]=4 736 B13R1.27 CCSCCOCC1CNC(=O)O1 34a_100000212035_100000181169 [0,1,0,0,0,0|2,0,0]=3 737 B13R1.27 CCSCCOCC1CNC(=O)O1 34a_100011315639_100000757381 [0,1,0,0,0,0|2,0,0]=3 738 B13R1.27 CCSCCOCC1CNC(=O)O1 7a_100000212035_100000181169 [0,1,0,0,0,0|2,0,0]=3 739 B13R1.27 CCSCCOCC1COC(=O)O1 34a_100000212035_100000073702 [0,1,0,0,0,0|2,0,0]=3 740 B13R1.27 CCSCCOC[C@@H]1CCC(=O)N1 7a_100000212035_100015189358 [0,1,0,0,0,0|2,0,0]=3 741 B13R1.27 CCSCCOC[C@H]1COC(=O)N1 34a_100000212035_100015307671 [0,1,0,0,0,0|3,0,0]=4 742 B13R1.27 CCSCCOC[C@H]1COC(=O)N1 7a_100000212035_100015307671 [0,1,0,0,0,0|3,0,0]=4 743 B13R1.27 CCSCCSCC1CNC(=O)O1 62a_100000181169_100000757381 [0,1,0,0,0,0|2,0,0]=3 744 B13R1.27 CCSCCSCC1CNC(=O)O1 62a_100000757381_100000181169 [0,1,0,0,0,0|2,0,0]=3 745 B13R1.27 CCSCCSCC1COC(=O)O1 62a_100000073702_100000757381 [0,1,0,0,0,0|2,0,0]=3 746 B13R1.27 CCSCCSCC1COC(=O)O1 62a_100000757381_100000073702 [0,1,0,0,0,0|2,0,0]=3 747 B13R1.27 CCSCCSC[C@@H]1CCC(=O)N1 62a_100000757381_100015189358 [0,1,0,0,0,0|2,0,0]=3 748 B13R1.27 CCSCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000757381 [0,1,0,0,0,0|2,0,0]=3 749 B13R1.27 CCSCCSC[C@H]1COC(=O)N1 62a_100000757381_100015307671 [0,1,0,0,0,0|3,0,0]=4 750 B13R1.27 CCSCCSC[C@H]1COC(=O)N1 62a_100015307671_100000757381 [0,1,0,0,0,0|3,0,0]=4 751 B13R1.27 CNCCCOCC1CNC(=O)O1 34a_100000213112_100000181169 [0,1,0,0,0,0|2,0,0]=3 752 B13R1.27 CNCCCOCC1COC(=O)O1 34a_100000213112_100000073702 [0,1,0,0,0,0|2,0,0]=3 753 B13R1.27 CNCCCOC[C@H]1COC(=O)N1 34a_100000213112_100015307671 [0,1,0,0,0,0|3,0,0]=4 754 B13R1.27 COCCCCNC1CNC(=O)C1 2230a_100000697751_100000730899 [0,1,0,0,0,0|3,0,0]=4 755 B13R1.27 COCCCCOC1CCC(=O)C1 34a_100012614533_100000755781 [0,1,0,0,0,0|2,0,0]=3 756 B13R1.27 COCCCCOC1CNC(=O)C1 34a_100000690082_100000755781 [0,1,0,0,0,0|3,0,0]=4 757 B13R1.27 COCCCCOC1COC(=O)O1 34a_100000740925_100000032252 [0,1,0,0,0,0|2,0,0]=3 758 B13R1.27 COCCCCSC1COC(=O)O1 62a_100000730899_100000032252 [0,1,0,0,0,0|2,0,0]=3 759 B13R1.27 COCCCNCC1CNC(=O)C1 2230a_100016993742_100000740836 [0,1,0,0,0,0|3,0,0]=4 760 B13R1.27 COCCCNCC1CNC(=O)C1 34a_100016993742_100000740836 [0,1,0,0,0,0|3,0,0]=4 761 B13R1.27 COCCCNCC1CNC(=O)O1 34a_100150723488_100000181169 [0,1,0,0,0,0|2,0,0]=3 762 B13R1.27 COCCCNCC1COC(=O)O1 34a_100150723488_100000073702 [0,1,0,0,0,0|2,0,0]=3 763 B13R1.27 COCCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000740836 [0,1,0,0,0,0|2,0,0]=3 764 B13R1.27 COCCCNC[C@H]1CCC(=O)N1 34a_100015423886_100000740836 [0,1,0,0,0,0|2,0,0]=3 765 B13R1.27 COCCCNC[C@H]1COC(=O)N1 34a_100150723488_100015307671 [0,1,0,0,0,0|3,0,0]=4 766 B13R1.27 COCCCOCC1CCC(=O)N1 34a_100000737831_100000740836 [0,1,0,0,0,0|2,0,0]=3 767 B13R1.27 COCCCOCC1CNC(=O)C1 34a_100016041077_100000740836 [0,1,0,0,0,0|3,0,0]=4 768 B13R1.27 COCCCOCC1CNC(=O)O1 34a_100000740835_100000181169 [0,1,0,0,0,0|2,0,0]=3 769 B13R1.27 COCCCOCC1CNC(=O)O1 34a_100011315639_100000740836 [0,1,0,0,0,0|2,0,0]=3 770 B13R1.27 COCCCOCC1COC(=O)O1 34a_100000740835_100000073702 [0,1,0,0,0,0|2,0,0]=3 771 B13R1.27 COCCCOC[C@H]1COC(=O)N1 34a_100000740835_100015307671 [0,1,0,0,0,0|3,0,0]=4 772 B13R1.27 COCCCSCC1CNC(=O)O1 62a_100000181169_100000709357 [0,1,0,0,0,0|2,0,0]=3 773 B13R1.27 COCCCSCC1CNC(=O)O1 62a_100000709357_100000181169 [0,1,0,0,0,0|2,0,0]=3 774 B13R1.27 COCCCSCC1COC(=O)O1 62a_100000073702_100000709357 [0,1,0,0,0,0|2,0,0]=3 775 B13R1.27 COCCCSCC1COC(=O)O1 62a_100000709357_100000073702 [0,1,0,0,0,0|2,0,0]=3 776 B13R1.27 COCCCSC[C@@H]1CCC(=O)N1 62a_100000709357_100015189358 [0,1,0,0,0,0|2,0,0]=3 777 B13R1.27 COCCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000709357 [0,1,0,0,0,0|2,0,0]=3 778 B13R1.27 COCCCSC[C@H]1COC(=O)N1 62a_100000709357_100015307671 [0,1,0,0,0,0|3,0,0]=4 779 B13R1.27 COCCCSC[C@H]1COC(=O)N1 62a_100015307671_100000709357 [0,1,0,0,0,0|3,0,0]=4 780 B13R1.27 COCCOCSC1COC(=O)O1 62a_100000231047_100000032252 [0,1,0,0,0,0|3,0,0]=4 781 B13R1.27 COCCSCCC1COS(=O)O1 62a_100000233755_100009840081 [0,1,0,0,0,0|3,0,0]=4 782 B13R1.27 CSCCCCOC1COC(=O)O1 34a_100011217163_100000032252 [0,1,0,0,0,0|2,0,0]=3 783 B13R1.27 CSCCCNCC1CNC(=O)O1 2230a_100000749238_100000181169 [0,1,0,0,0,0|2,0,0]=3 784 B13R1.27 CSCCCNC[C@@H]1CCC(=O)N1 2230a_100000749238_100015189358 [0,1,0,0,0,0|2,0,0]=3 785 B13R1.27 CSCCCNC[C@H]1COC(=O)N1 2230a_100000749238_100015307671 [0,1,0,0,0,0|3,0,0]=4 786 B13R1.27 CSCCCOCC1CNC(=O)O1 34a_100000690336_100000181169 [0,1,0,0,0,0|2,0,0]=3 787 B13R1.27 CSCCCOCC1CNC(=O)O1 7a_100000690336_100000181169 [0,1,0,0,0,0|2,0,0]=3 788 B13R1.27 CSCCCOCC1COC(=O)O1 34a_100000690336_100000073702 [0,1,0,0,0,0|2,0,0]=3 789 B13R1.27 CSCCCOC[C@@H]1CCC(=O)N1 7a_100000690336_100015189358 [0,1,0,0,0,0|2,0,0]=3 790 B13R1.27 CSCCCOC[C@H]1COC(=O)N1 34a_100000690336_100015307671 [0,1,0,0,0,0|3,0,0]=4 791 B13R1.27 CSCCCOC[C@H]1COC(=O)N1 7a_100000690336_100015307671 [0,1,0,0,0,0|3,0,0]=4 792 B13R1.27 CSCCOCCC1COS(=O)O1 7a_100000230434_100009840081 [0,1,0,0,0,0|3,0,0]=4 793 B13R1.27 CSCCSCCC1COS(=O)O1 62a_100000212216_100009840081 [0,1,0,0,0,0|3,0,0]=4 794 B13R1.27 N#CCCCCSC1COC(=O)O1 62a_100011219923_100000032252 [0,1,0,0,0,0|2,0,1]=4 795 B13R1.27 N#CCCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000687738 [0,1,0,0,0,0|2,0,1]=4 796 B13R1.27 N#CCCCSCC1CNC(=O)O1 62a_100000181169_100000687738 [0,1,0,0,0,0|2,0,1]=4 797 B13R1.27 N#CCCCSCC1CNC(=O)O1 62a_100000687738_100000181169 [0,1,0,0,0,0|2,0,1]=4 798 B13R1.27 N#CCCCSCC1COC(=O)O1 62a_100000073702_100000687738 [0,1,0,0,0,0|2,0,1]=4 799 B13R1.27 N#CCCCSCC1COC(=O)O1 62a_100000687738_100000073702 [0,1,0,0,0,0|2,0,1]=4 800 B13R1.27 N#CCCCSC[C@@H]1CCC(=O)N1 62a_100000687738_100015189358 [0,1,0,0,0,0|2,0,1]=4 801 B13R1.27 N#CCCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000687738 [0,1,0,0,0,0|2,0,1]=4 802 B13R1.27 NCCCCCOC1COC(=O)O1 34a_100000762737_100000032252 [0,1,0,0,0,0|2,0,0]=3 803 B13R1.27 NCCCCOCC1CNC(=O)O1 34a_100000750430_100000181169 [0,1,0,0,0,0|2,0,0]=3 804 B13R1.27 NCCCCOCC1COC(=O)O1 34a_100000750430_100000073702 [0,1,0,0,0,0|2,0,0]=3 805 B13R1.27 NCCCCOC[C@H]1COC(=O)N1 34a_100000750430_100015307671 [0,1,0,0,0,0|3,0,0]=4 806 B13R1.27 NCCOCCOC1COC(=O)O1 34a_100000211614_100000032252 [0,1,0,0,0,0|3,0,0]=4 807 B13R1.27 O=C1CC(CN1)CNCCCCF 2230a_100016993742_100000729493 [0,1,0,0,0,0|3,0,0]=4 808 B13R1.27 O=C1CC(CN1)CNCCCCF 34a_100016993742_100000729493 [0,1,0,0,0,0|3,0,0]=4 809 B13R1.27 O=C1CC(CN1)CNCCCCO 2230a_100016993742_100000210776 [0,1,0,0,0,0|3,0,0]=4 810 B13R1.27 O=C1CC(CN1)CNCCCCO 34a_100016993742_100011216708 [0,1,0,0,0,0|3,0,0]=4 811 B13R1.27 O=C1CC(CN1)COCCCCF 34a_100016041077_100000729493 [0,1,0,0,0,0|3,0,0]=4 812 B13R1.27 O=C1CC(CN1)COCCCCO 34a_100016041077_100011216708 [0,1,0,0,0,0|3,0,0]=4 813 B13R1.27 O=C1CC(CN1)NCCCCCF 2230a_100000697751_100000729378 [0,1,0,0,0,0|3,0,0]=4 814 B13R1.27 O=C1CC(CN1)NCCCCCO 2230a_100000697751_100000746330 [0,1,0,0,0,0|3,0,0]=4 815 B13R1.27 O=C1CC(CN1)OCCCCCF 34a_100000690082_100000729378 [0,1,0,0,0,0|3,0,0]=4 816 B13R1.27 O=C1CC(CN1)OCCCCCO 34a_100000690082_100000746330 [0,1,0,0,0,0|3,0,0]=4 817 B13R1.27 O=C1CCC(C1)OCCCCCF 34a_100012614533_100000729378 [0,1,0,0,0,0|2,0,0]=3 818 B13R1.27 O=C1CCC(C1)OCCCCCO 34a_100012614533_100000746330 [0,1,0,0,0,0|2,0,0]=3 819 B13R1.27 O=C1CCC(C1)OCCOCCO 34a_100012614533_100000692535 [0,1,0,0,0,0|3,0,0]=4 820 B13R1.27 O=C1CCC(N1)COCCCCF 34a_100000737831_100000729493 [0,1,0,0,0,0|2,0,0]=3 821 B13R1.27 O=C1CCC(N1)COCCCCO 34a_100000737831_100011216708 [0,1,0,0,0,0|2,0,0]=3 822 B13R1.27 O=C1CC[C@@H](N1)CNCCCCF 2230a_100015423886_100000729493 [0,1,0,0,0,0|2,0,0]=3 823 B13R1.27 O=C1CC[C@@H](N1)CNCCCCF 34a_100015423886_100000729493 [0,1,0,0,0,0|2,0,0]=3 824 B13R1.27 O=C1CC[C@@H](N1)CNCCCCO 2230a_100015423886_100000210776 [0,1,0,0,0,0|2,0,0]=3 825 B13R1.27 O=C1CC[C@@H](N1)CNCCCCO 34a_100015423886_100011216708 [0,1,0,0,0,0|2,0,0]=3 826 B13R1.27 O=C1CC[C@H](N1)CNCCCCO 2230a_100000750430_100015189358 [0,1,0,0,0,0|2,0,0]=3 827 B13R1.27 O=C1CC[C@H](N1)COCCCCCl 7a_100000210776_100015189358 [0,1,0,0,0,0|2,0,0]=3 828 B13R1.27 O=C1CC[C@H](N1)COCCCCF 7a_100011995726_100015189358 [0,1,0,0,0,0|2,0,0]=3 829 B13R1.27 O=C1CC[C@H](N1)CSCCCCF 62a_100000729493_100015189358 [0,1,0,0,0,0|2,0,0]=3 830 B13R1.27 O=C1CC[C@H](N1)CSCCCCF 62a_100015189358_100000729493 [0,1,0,0,0,0|2,0,0]=3 831 B13R1.27 O=C1CC[C@H](N1)CSCCCCO 62a_100000210776_100015189358 [0,1,0,0,0,0|2,0,0]=3 832 B13R1.27 O=C1CC[C@H](N1)CSCCCCO 62a_100015189358_100000210776 [0,1,0,0,0,0|2,0,0]=3 833 B13R1.27 O=C1CN(CN1)CCCCCCF 2230a_200000708111_100015922095 [0,1,0,0,0,0|3,0,0]=4 834 B13R1.27 O=C1CN(CN1)CCCCCCO 2230a_200000708111_100000766143 [0,1,0,0,0,0|3,0,0]=4 835 B13R1.27 O=C1NCC(O1)CNCCCCO 2230a_100000750430_100000181169 [0,1,0,0,0,0|2,0,0]=3 836 B13R1.27 O=C1NCC(O1)CNCCCCO 34a_100000750430_100000181169 [0,1,0,0,0,0|2,0,0]=3 837 B13R1.27 O=C1NCC(O1)COCCCCBr 34a_100011216708_100000181169 [0,1,0,0,0,0|2,0,0]=3 838 B13R1.27 O=C1NCC(O1)COCCCCCl 34a_100000210776_100000181169 [0,1,0,0,0,0|2,0,0]=3 839 B13R1.27 O=C1NCC(O1)COCCCCCl 7a_100000210776_100000181169 [0,1,0,0,0,0|2,0,0]=3 840 B13R1.27 O=C1NCC(O1)COCCCCF 34a_100011315639_100000729493 [0,1,0,0,0,0|2,0,0]=3 841 B13R1.27 O=C1NCC(O1)COCCCCF 34a_100011995726_100000181169 [0,1,0,0,0,0|2,0,0]=3 842 B13R1.27 O=C1NCC(O1)COCCCCF 7a_100011995726_100000181169 [0,1,0,0,0,0|2,0,0]=3 843 B13R1.27 O=C1NCC(O1)COCCCCI 34a_200012148704_100000181169 [0,1,0,0,0,0|2,0,0]=3 844 B13R1.27 O=C1NCC(O1)COCCCCO 34a_100011315639_100011216708 [0,1,0,0,0,0|2,0,0]=3 845 B13R1.27 O=C1NCC(O1)CSCCCCF 62a_100000181169_100000729493 [0,1,0,0,0,0|2,0,0]=3 846 B13R1.27 O=C1NCC(O1)CSCCCCF 62a_100000729493_100000181169 [0,1,0,0,0,0|2,0,0]=3 847 B13R1.27 O=C1NCC(O1)CSCCCCO 62a_100000181169_100000210776 [0,1,0,0,0,0|2,0,0]=3 848 B13R1.27 O=C1NCC(O1)CSCCCCO 62a_100000210776_100000181169 [0,1,0,0,0,0|2,0,0]=3 849 B13R1.27 O=C1N[C@H](CO1)CNCCCCO 2230a_100000750430_100015307671 [0,1,0,0,0,0|3,0,0]=4 850 B13R1.27 O=C1N[C@H](CO1)CNCCCCO 34a_100000750430_100015307671 [0,1,0,0,0,0|3,0,0]=4 851 B13R1.27 O=C1N[C@H](CO1)COCCCCBr 34a_100011216708_100015307671 [0,1,0,0,0,0|3,0,0]=4 852 B13R1.27 O=C1N[C@H](CO1)COCCCCCl 34a_100000210776_100015307671 [0,1,0,0,0,0|3,0,0]=4 853 B13R1.27 O=C1N[C@H](CO1)COCCCCCl 7a_100000210776_100015307671 [0,1,0,0,0,0|3,0,0]=4 854 B13R1.27 O=C1N[C@H](CO1)COCCCCF 34a_100011995726_100015307671 [0,1,0,0,0,0|3,0,0]=4 855 B13R1.27 O=C1N[C@H](CO1)COCCCCF 7a_100011995726_100015307671 [0,1,0,0,0,0|3,0,0]=4 856 B13R1.27 O=C1N[C@H](CO1)COCCCCI 34a_200012148704_100015307671 [0,1,0,0,0,0|3,0,0]=4 857 B13R1.27 O=C1N[C@H](CO1)CSCCCCF 62a_100000729493_100015307671 [0,1,0,0,0,0|3,0,0]=4 858 B13R1.27 O=C1N[C@H](CO1)CSCCCCF 62a_100015307671_100000729493 [0,1,0,0,0,0|3,0,0]=4 859 B13R1.27 O=C1N[C@H](CO1)CSCCCCO 62a_100000210776_100015307671 [0,1,0,0,0,0|3,0,0]=4 860 B13R1.27 O=C1N[C@H](CO1)CSCCCCO 62a_100015307671_100000210776 [0,1,0,0,0,0|3,0,0]=4 861 B13R1.27 O=C1OCC(O1)CNCCCCO 34a_100000750430_100000073702 [0,1,0,0,0,0|2,0,0]=3 862 B13R1.27 O=C1OCC(O1)COCCCCBr 34a_100011216708_100000073702 [0,1,0,0,0,0|2,0,0]=3 863 B13R1.27 O=C1OCC(O1)COCCCCCl 34a_100000210776_100000073702 [0,1,0,0,0,0|2,0,0]=3 864 B13R1.27 O=C1OCC(O1)COCCCCF 34a_100011995726_100000073702 [0,1,0,0,0,0|2,0,0]=3 865 B13R1.27 O=C1OCC(O1)COCCCCI 34a_200012148704_100000073702 [0,1,0,0,0,0|2,0,0]=3 866 B13R1.27 O=C1OCC(O1)CSCCCCF 62a_100000073702_100000729493 [0,1,0,0,0,0|2,0,0]=3 867 B13R1.27 O=C1OCC(O1)CSCCCCF 62a_100000729493_100000073702 [0,1,0,0,0,0|2,0,0]=3 868 B13R1.27 O=C1OCC(O1)CSCCCCO 62a_100000073702_100000210776 [0,1,0,0,0,0|2,0,0]=3 869 B13R1.27 O=C1OCC(O1)CSCCCCO 62a_100000210776_100000073702 [0,1,0,0,0,0|2,0,0]=3 870 B13R1.27 O=C1OCC(O1)NCCCCCO 34a_100000762737_100000032252 [0,1,0,0,0,0|2,0,0]=3 871 B13R1.27 O=C1OCC(O1)NCCOCCO 34a_100000211614_100000032252 [0,1,0,0,0,0|3,0,0]=4 872 B13R1.27 O=C1OCC(O1)OCCCCCBr 34a_100000746331_100000032252 [0,1,0,0,0,0|2,0,0]=3 873 B13R1.27 O=C1OCC(O1)OCCCCCCl 34a_100000746330_100000032252 [0,1,0,0,0,0|2,0,0]=3 874 B13R1.27 O=C1OCC(O1)OCCCCCI 34a_200012148887_100000032252 [0,1,0,0,0,0|2,0,0]=3 875 B13R1.27 O=C1OCC(O1)OCCOCCBr 34a_100000692535_100000032252 [0,1,0,0,0,0|3,0,0]=4 876 B13R1.27 O=C1OCC(O1)OCCOCCCl 34a_100011215305_100000032252 [0,1,0,0,0,0|3,0,0]=4 877 B13R1.27 O=C1OCC(O1)OCCOCCF 34a_200015357709_100000032252 [0,1,0,0,0,0|3,0,0]=4 878 B13R1.27 O=C1OCC(O1)OCCOCCI 34a_100012149058_100000032252 [0,1,0,0,0,0|3,0,0]=4 879 B13R1.27 O=C1OCC(O1)SCCCCCF 62a_100000729378_100000032252 [0,1,0,0,0,0|2,0,0]=3 880 B13R1.27 O=C1OCC(O1)SCCCCCO 62a_100000746330_100000032252 [0,1,0,0,0,0|2,0,0]=3 881 B13R1.27 O=C1OCC(O1)SCCOCCO 62a_100011215305_100000032252 [0,1,0,0,0,0|3,0,0]=4 882 B13R1.27 O=CCCCCSC1COC(=O)O1 62a_100000139335_100000032252 [0,1,0,0,0,0|2,0,1]=4 883 B13R1.27 O=CCCCNC[C@H]1CCC(=O)N1 2230a_100015423886_200011292268 [0,1,0,0,0,0|2,0,1]=4 884 B13R1.27 O=CCCCSCC1CNC(=O)O1 62a_100000181169_200011292268 [0,1,0,0,0,0|2,0,1]=4 885 B13R1.27 O=CCCCSCC1CNC(=O)O1 62a_200011292268_100000181169 [0,1,0,0,0,0|2,0,1]=4 886 B13R1.27 O=CCCCSCC1COC(=O)O1 62a_100000073702_200011292268 [0,1,0,0,0,0|2,0,1]=4 887 B13R1.27 O=CCCCSCC1COC(=O)O1 62a_200011292268_100000073702 [0,1,0,0,0,0|2,0,1]=4 888 B13R1.27 O=CCCCSC[C@@H]1CCC(=O)N1 62a_100015189358_200011292268 [0,1,0,0,0,0|2,0,1]=4 889 B13R1.27 O=CCCCSC[C@@H]1CCC(=O)N1 62a_200011292268_100015189358 [0,1,0,0,0,0|2,0,1]=4 890 B13R1.27 O=S1OCC(O1)CCSCCCF 62a_100011934791_100009840081 [0,1,0,0,0,0|3,0,0]=4 891 B13R1.27 O=S1OCC(O1)CCSCCCO 62a_100011215043_100009840081 [0,1,0,0,0,0|3,0,0]=4 892 B13R1.41 CC(CCBr)OCC1CNC(=O)O1 34a_100012276601_100000181169 [0,1,0,0,0,0|3,0,0]=4 893 B13R1.41 CC(CCBr)OCC1COC(=O)O1 34a_100012276601_100000073702 [0,1,0,0,0,0|3,0,0]=4 894 B13R1.41 CC(CCN)COC1COC(=O)O1 34a_106354213184_100000032252 [0,1,0,0,0,0|3,0,0]=4 895 B13R1.41 CC(CCO)NC[C@H]1CCC(=O)N1 2230a_100015423886_100009893172 [0,1,0,0,0,0|3,0,0]=4 896 B13R1.41 CC(CCO)NC[C@H]1CCC(=O)N1 34a_100015423886_100009893172 [0,1,0,0,0,0|3,0,0]=4 897 B13R1.41 CC(CCO)OCC1CCC(=O)N1 34a_100000737831_100009893172 [0,1,0,0,0,0|3,0,0]=4 898 B13R1.41 CC(CCO)OCC1CNC(=O)O1 34a_100011315639_100009893172 [0,1,0,0,0,0|3,0,0]=4 899 B13R1.41 CC(CCO)SCC1CNC(=O)O1 62a_100000181169_100009893172 [0,1,0,0,0,0|3,0,0]=4 900 B13R1.41 CC(CCO)SCC1CNC(=O)O1 62a_100009893172_100000181169 [0,1,0,0,0,0|3,0,0]=4 901 B13R1.41 CC(CCO)SCC1COC(=O)O1 62a_100000073702_100009893172 [0,1,0,0,0,0|3,0,0]=4 902 B13R1.41 CC(CCO)SCC1COC(=O)O1 62a_100009893172_100000073702 [0,1,0,0,0,0|3,0,0]=4 903 B13R1.41 CC(CCO)SC[C@@H]1CCC(=O)N1 62a_100009893172_100015189358 [0,1,0,0,0,0|3,0,0]=4 904 B13R1.41 CC(CCO)SC[C@@H]1CCC(=O)N1 62a_100015189358_100009893172 [0,1,0,0,0,0|3,0,0]=4 905 B13R1.41 CCCC(=O)CCC1COS(=O)O1 1458a_100000211992_100009840081 [0,1,0,0,0,0|2,0,1]=4 906 B13R1.41 CCCC(=O)CSC1COC(=O)O1 62a_100000747444_100000032252 [0,1,0,0,0,0|2,0,1]=4 907 B13R1.41 CCCC(=O)NC[C@H]1CCC(=O)N1 11a_100015423886_100000211992 [0,1,0,0,0,0|2,0,1]=4 908 B13R1.41 CCCC(=O)NC[C@H]1CCC(=O)N1 1626a_100015423886_100000211992 [0,1,0,0,0,0|2,0,1]=4 909 B13R1.41 CCCC(=O)NC[C@H]1CCC(=O)N1 240690a_100015423886_100000211992 [0,1,0,0,0,0|2,0,1]=4 910 B13R1.41 CCCC(=O)NC[C@H]1CCC(=O)N1 527a_100015423886_100000211992 [0,1,0,0,0,0|2,0,1]=4 911 B13R1.41 CCCC(C)CNC1CNC(=O)C1 2230a_100000697751_100011216630 [0,1,0,0,0,0|3,0,0]=4 912 B13R1.41 CCCC(C)COC1CCC(=O)C1 34a_100012614533_100011216630 [0,1,0,0,0,0|2,0,0]=3 913 B13R1.41 CCCC(C)COC1CNC(=O)C1 34a_100000690082_100011216630 [0,1,0,0,0,0|3,0,0]=4 914 B13R1.41 CCCC(C)COC1COC(=O)O1 34a_100000688023_100000032252 [0,1,0,0,0,0|2,0,0]=3 915 B13R1.41 CCCC(C)CSC1COC(=O)O1 62a_100011216630_100000032252 [0,1,0,0,0,0|2,0,0]=3 916 B13R1.41 CCCC(C)NCC1CNC(=O)C1 2230a_100016993742_100000766640 [0,1,0,0,0,0|3,0,0]=4 917 B13R1.41 CCCC(C)NCC1CNC(=O)C1 34a_100016993742_100000766640 [0,1,0,0,0,0|3,0,0]=4 918 B13R1.41 CCCC(C)NCC1CNC(=O)O1 2230a_100000741246_100000181169 [0,1,0,0,0,0|2,0,0]=3 919 B13R1.41 CCCC(C)NC[C@@H]1CCC(=O)N1 2230a_100000741246_100015189358 [0,1,0,0,0,0|2,0,0]=3 920 B13R1.41 CCCC(C)NC[C@H]1CCC(=O)N1 2230a_100015423886_100000766640 [0,1,0,0,0,0|2,0,0]=3 921 B13R1.41 CCCC(C)NC[C@H]1CCC(=O)N1 270004a_100015423886_100000211909 [0,1,0,0,0,0|2,0,0]=3 922 B13R1.41 CCCC(C)NC[C@H]1CCC(=O)N1 34a_100015423886_100000766640 [0,1,0,0,0,0|2,0,0]=3 923 B13R1.41 CCCC(C)NC[C@H]1COC(=O)N1 2230a_100000741246_100015307671 [0,1,0,0,0,0|3,0,0]=4 924 B13R1.41 CCCC(C)OCC1CCC(=O)N1 34a_100000737831_100000766640 [0,1,0,0,0,0|2,0,0]=3 925 B13R1.41 CCCC(C)OCC1CNC(=O)C1 34a_100016041077_100000766640 [0,1,0,0,0,0|3,0,0]=4 926 B13R1.41 CCCC(C)OCC1CNC(=O)O1 34a_100000764384_100000181169 [0,1,0,0,0,0|2,0,0]=3 927 B13R1.41 CCCC(C)OCC1CNC(=O)O1 34a_100011315639_100000766640 [0,1,0,0,0,0|2,0,0]=3 928 B13R1.41 CCCC(C)OCC1CNC(=O)O1 7a_100000764384_100000181169 [0,1,0,0,0,0|2,0,0]=3 929 B13R1.41 CCCC(C)OCC1COC(=O)O1 34a_100000764384_100000073702 [0,1,0,0,0,0|2,0,0]=3 930 B13R1.41 CCCC(C)OC[C@@H]1CCC(=O)N1 7a_100000764384_100015189358 [0,1,0,0,0,0|2,0,0]=3 931 B13R1.41 CCCC(C)OC[C@H]1COC(=O)N1 34a_100000764384_100015307671 [0,1,0,0,0,0|3,0,0]=4 932 B13R1.41 CCCC(C)OC[C@H]1COC(=O)N1 7a_100000764384_100015307671 [0,1,0,0,0,0|3,0,0]=4 933 B13R1.41 CCCC(C)SCC1CNC(=O)O1 62a_100000181169_100000766640 [0,1,0,0,0,0|2,0,0]=3 934 B13R1.41 CCCC(C)SCC1CNC(=O)O1 62a_100000766640_100000181169 [0,1,0,0,0,0|2,0,0]=3 935 B13R1.41 CCCC(C)SCC1COC(=O)O1 62a_100000073702_100000766640 [0,1,0,0,0,0|2,0,0]=3 936 B13R1.41 CCCC(C)SCC1COC(=O)O1 62a_100000766640_100000073702 [0,1,0,0,0,0|2,0,0]=3 937 B13R1.41 CCCC(C)SC[C@@H]1CCC(=O)N1 62a_100000766640_100015189358 [0,1,0,0,0,0|2,0,0]=3 938 B13R1.41 CCCC(C)SC[C@@H]1CCC(=O)N1 62a_100015189358_100000766640 [0,1,0,0,0,0|2,0,0]=3 939 B13R1.41 CCCC(C)SC[C@H]1COC(=O)N1 62a_100000766640_100015307671 [0,1,0,0,0,0|3,0,0]=4 940 B13R1.41 CCCC(C)SC[C@H]1COC(=O)N1 62a_100015307671_100000766640 [0,1,0,0,0,0|3,0,0]=4 941 B13R1.41 CCCN(C)CCC1COS(=O)O1 269982a_100000747261_100009840081 [0,1,0,0,0,0|3,0,0]=4 942 B13R1.41 CCC[C@H](N)COC1COC(=O)O1 34a_100000732646_100000032252 [0,1,0,0,0,0|2,0,0]=3 943 B13R1.41 COCC(C)NC[C@H]1CCC(=O)N1 2230a_100015423886_100000765312 [0,1,0,0,0,0|3,0,0]=4 944 B13R1.41 COCC(C)NC[C@H]1CCC(=O)N1 270004a_100015423886_100000749346 [0,1,0,0,0,0|3,0,0]=4 945 B13R1.41 COCC(C)NC[C@H]1CCC(=O)N1 34a_100015423886_100000765312 [0,1,0,0,0,0|3,0,0]=4 946 B13R1.41 COCC(C)OCC1CCC(=O)N1 34a_100000737831_100000765312 [0,1,0,0,0,0|3,0,0]=4 947 B13R1.41 COCC(C)OCC1CNC(=O)O1 34a_100011315639_100000765312 [0,1,0,0,0,0|3,0,0]=4 948 B13R1.41 COCC(C)SCC1CNC(=O)O1 62a_100000181169_100000765312 [0,1,0,0,0,0|3,0,0]=4 949 B13R1.41 COCC(C)SCC1CNC(=O)O1 62a_100000765312_100000181169 [0,1,0,0,0,0|3,0,0]=4 950 B13R1.41 COCC(C)SCC1COC(=O)O1 62a_100000073702_100000765312 [0,1,0,0,0,0|3,0,0]=4 951 B13R1.41 COCC(C)SCC1COC(=O)O1 62a_100000765312_100000073702 [0,1,0,0,0,0|3,0,0]=4 952 B13R1.41 COCC(C)SC[C@@H]1CCC(=O)N1 62a_100000765312_100015189358 [0,1,0,0,0,0|3,0,0]=4 953 B13R1.41 COCC(C)SC[C@@H]1CCC(=O)N1 62a_100015189358_100000765312 [0,1,0,0,0,0|3,0,0]=4 954 B13R1.41 COCC(N)COC1COC(=O)O1 34a_100000724102_100000032252 [0,1,0,0,0,0|3,0,0]=4 955 B13R1.41 COCC(O)CNC1COC(=O)O1 34a_100000756049_100000032252 [0,1,0,0,0,0|3,0,0]=4 956 B13R1.41 COCC(O)COC1CCC(=O)C1 34a_100012614533_100011215053 [0,1,0,0,0,0|3,0,0]=4 957 B13R1.41 COCC(O)CSC1COC(=O)O1 62a_100011215053_100000032252 [0,1,0,0,0,0|3,0,0]=4 958 B13R1.41 COC[C@@H](C)NCC1CNC(=O)O1 2230a_100000764878_100000181169 [0,1,0,0,0,0|3,0,0]=4 959 B13R1.41 COC[C@@H](C)NC[C@@H]1CCC(=O)N1 2230a_100000764878_100015189358 [0,1,0,0,0,0|3,0,0]=4 960 B13R1.41 COC[C@@H](C)OCC1CNC(=O)O1 34a_100011934205_100000181169 [0,1,0,0,0,0|3,0,0]=4 961 B13R1.41 COC[C@@H](C)OCC1COC(=O)O1 34a_100011934205_100000073702 [0,1,0,0,0,0|3,0,0]=4 962 B13R1.41 CSCC(C)NC[C@H]1CCC(=O)N1 270004a_100015423886_100011216314 [0,1,0,0,0,0|3,0,0]=4 963 B13R1.41 C[C@H](CCO)NCC1CNC(=O)O1 2230a_100000706166_100000181169 [0,1,0,0,0,0|3,0,0]=4 964 B13R1.41 C[C@H](CCO)NCC1CNC(=O)O1 34a_100000706166_100000181169 [0,1,0,0,0,0|3,0,0]=4 965 B13R1.41 C[C@H](CCO)NCC1COC(=O)O1 34a_100000706166_100000073702 [0,1,0,0,0,0|3,0,0]=4 966 B13R1.41 C[C@H](CCO)NC[C@@H]1CCC(=O)N1 2230a_100000706166_100015189358 [0,1,0,0,0,0|3,0,0]=4 967 B13R1.43 CC(CCCCl)OC1COC(=O)O1 34a_200000718107_100000032252 [0,1,0,0,0,0|3,0,0]=4 968 B13R1.43 CCCCC(=O)CC1CCC(=O)N1 1458a_100000026770_100000210211 [0,1,0,0,0,0|1,0,1]=3 969 B13R1.43 CCCCC(=O)CC1CNC(=O)O1 1458a_100000210183_100000181169 [0,1,0,0,0,0|1,0,1]=3 970 B13R1.43 CCCCC(=O)CC1COC(=O)O1 1458a_100000210183_100000073702 [0,1,0,0,0,0|1,0,1]=3 971 B13R1.43 CCCCC(=O)C[C@@H]1CCC(=O)N1 1458a_100000210183_100015189358 [0,1,0,0,0,0|1,0,1]=3 972 B13R1.43 CCCCC(=O)C[C@H]1COC(=O)N1 1458a_100000210183_100015307671 [0,1,0,0,0,0|2,0,1]=4 973 B13R1.43 CCCCC(C)NC1CNC(=O)C1 2230a_100000697751_200011215066 [0,1,0,0,0,0|3,0,0]=4 974 B13R1.43 CCCCC(C)OC1CCC(=O)C1 34a_100012614533_200011215066 [0,1,0,0,0,0|2,0,0]=3 975 B13R1.43 CCCCC(C)OC1CNC(=O)C1 34a_100000690082_200011215066 [0,1,0,0,0,0|3,0,0]=4 976 B13R1.43 CCCCC(C)OC1COC(=O)O1 34a_100000687866_100000032252 [0,1,0,0,0,0|2,0,0]=3 977 B13R1.43 CCCCC(C)SC1COC(=O)O1 62a_200011215066_100000032252 [0,1,0,0,0,0|2,0,0]=3 978 B13R1.43 CCCCN(C)CC1CNC(=O)O1 2230a_100000207549_100000181169 [0,1,0,0,0,0|2,0,0]=3 979 B13R1.43 CCCCN(C)CC1CNC(=O)O1 269982a_100000207549_100000181169 [0,1,0,0,0,0|2,0,0]=3 980 B13R1.43 CCCCN(C)CC1COC(=O)O1 269982a_100000207549_100000073702 [0,1,0,0,0,0|2,0,0]=3 981 B13R1.43 CCCCN(C)C[C@@H]1CCC(=O)N1 2230a_100000207549_100015189358 [0,1,0,0,0,0|2,0,0]=3 982 B13R1.43 CCCCN(C)C[C@@H]1CCC(=O)N1 269982a_100000207549_100015189358 [0,1,0,0,0,0|2,0,0]=3 983 B13R1.43 CCCCN(C)C[C@H]1COC(=O)N1 2230a_100000207549_100015307671 [0,1,0,0,0,0|3,0,0]=4 984 B13R1.43 CCCCN(C)C[C@H]1COC(=O)N1 269982a_100000207549_100015307671 [0,1,0,0,0,0|3,0,0]=4 985 B13R1.43 CCCNC(=O)CC1CCC(=O)N1 1626a_100020643023_100000026770 [0,1,0,0,0,0|2,0,1]=4 986 B13R1.43 CCCNC(=O)CC1CCC(=O)N1 240690a_100020643023_100000026770 [0,1,0,0,0,0|2,0,1]=4 987 B13R1.43 CCOCC(=O)CC1CNC(=O)O1 1458a_100000211967_100000181169 [0,1,0,0,0,0|2,0,1]=4 988 B13R1.43 CCOCC(=O)CC1COC(=O)O1 1458a_100000211967_100000073702 [0,1,0,0,0,0|2,0,1]=4 989 B13R1.43 CCOCC(=O)C[C@@H]1CCC(=O)N1 1458a_100000211967_100015189358 [0,1,0,0,0,0|2,0,1]=4 990 B13R1.43 CCOCC(C)OC1COC(=O)O1 34a_100000718985_100000032252 [0,1,0,0,0,0|3,0,0]=4 991 B13R1.43 CCSCC(=O)CC1CNC(=O)O1 1458a_100000230394_100000181169 [0,1,0,0,0,0|2,0,1]=4 992 B13R1.43 CCSCC(=O)CC1COC(=O)O1 1458a_100000230394_100000073702 [0,1,0,0,0,0|2,0,1]=4 993 B13R1.43 CCSCC(=O)C[C@@H]1CCC(=O)N1 1458a_100000230394_100015189358 [0,1,0,0,0,0|2,0,1]=4 994 B13R1.43 CN(CCCO)CC1CNC(=O)O1 2230a_100000213112_100000181169 [0,1,0,0,0,0|3,0,0]=4 995 B13R1.43 CN(CCCO)CC1CNC(=O)O1 269982a_100000213112_100000181169 [0,1,0,0,0,0|3,0,0]=4 996 B13R1.43 CN(CCCO)CC1COC(=O)O1 269982a_100000213112_100000073702 [0,1,0,0,0,0|3,0,0]=4 997 B13R1.43 CN(CCCO)C[C@@H]1CCC(=O)N1 2230a_100000213112_100015189358 [0,1,0,0,0,0|3,0,0]=4 998 B13R1.43 CN(CCCO)C[C@@H]1CCC(=O)N1 269982a_100000213112_100015189358 [0,1,0,0,0,0|3,0,0]=4 999 B13R1.43 COCCC(=O)CC1CCC(=O)N1 1458a_100000026770_100000233755 [0,1,0,0,0,0|2,0,1]=4 1000 B13R1.43 COCCC(=O)CC1CNC(=O)O1 1458a_100000749529_100000181169 [0,1,0,0,0,0|2,0,1]=4 1001 B13R1.43 COCCC(=O)CC1COC(=O)O1 1458a_100000749529_100000073702 [0,1,0,0,0,0|2,0,1]=4 1002 B13R1.43 COCCC(=O)C[C@@H]1CCC(=O)N1 1458a_100000749529_100015189358 [0,1,0,0,0,0|2,0,1]=4 1003 B13R1.43 COCCN(C)CC1CNC(=O)O1 2230a_100000743101_100000181169 [0,1,0,0,0,0|3,0,0]=4 1004 B13R1.43 COCCN(C)CC1CNC(=O)O1 269982a_100000743101_100000181169 [0,1,0,0,0,0|3,0,0]=4 1005 B13R1.43 COCCN(C)CC1COC(=O)O1 269982a_100000743101_100000073702 [0,1,0,0,0,0|3,0,0]=4 1006 B13R1.43 COCCN(C)C[C@@H]1CCC(=O)N1 2230a_100000743101_100015189358 [0,1,0,0,0,0|3,0,0]=4 1007 B13R1.43 COCCN(C)C[C@@H]1CCC(=O)N1 269982a_100000743101_100015189358 [0,1,0,0,0,0|3,0,0]=4 1008 B13R1.43 CSCCC(=O)CC1CCC(=O)N1 1458a_100000026770_100000751147 [0,1,0,0,0,0|2,0,1]=4 1009 B13R1.43 CSCCC(=O)CC1CNC(=O)O1 1458a_100000174002_100000181169 [0,1,0,0,0,0|2,0,1]=4 1010 B13R1.43 CSCCC(=O)CC1COC(=O)O1 1458a_100000174002_100000073702 [0,1,0,0,0,0|2,0,1]=4 1011 B13R1.43 CSCCC(=O)C[C@@H]1CCC(=O)N1 1458a_100000174002_100015189358 [0,1,0,0,0,0|2,0,1]=4 1012 B13R1.43 CSCCN(C)CC1CNC(=O)O1 2230a_100000686725_100000181169 [0,1,0,0,0,0|3,0,0]=4 1013 B13R1.43 CSCCN(C)CC1CNC(=O)O1 269982a_100000686725_100000181169 [0,1,0,0,0,0|3,0,0]=4 1014 B13R1.43 CSCCN(C)CC1COC(=O)O1 269982a_100000686725_100000073702 [0,1,0,0,0,0|3,0,0]=4 1015 B13R1.43 CSCCN(C)C[C@@H]1CCC(=O)N1 2230a_100000686725_100015189358 [0,1,0,0,0,0|3,0,0]=4 1016 B13R1.43 CSCCN(C)C[C@@H]1CCC(=O)N1 269982a_100000686725_100015189358 [0,1,0,0,0,0|3,0,0]=4 1017 B13R1.43 O=C(CCCF)CC1CCC(=O)N1 1458a_100000026770_100011934791 [0,1,0,0,0,0|2,0,1]=4 1018 B13R1.43 O=C(CCCO)CC1CCC(=O)N1 1458a_100000026770_100011215043 [0,1,0,0,0,0|2,0,1]=4 1019 B13R1.128 C=C(C)CCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000730704 [0,1,0,0,0,0|2,0,1]=4 1020 B13R1.128 C=C(C)CCNC[C@H]1CCC(=O)N1 34a_100015423886_100000730704 [0,1,0,0,0,0|2,0,1]=4 1021 B13R1.128 C=C(C)CCOCC1CCC(=O)N1 34a_100000737831_100000730704 [0,1,0,0,0,0|2,0,1]=4 1022 B13R1.128 C=C(C)CCOCC1CNC(=O)O1 34a_100000764851_100000181169 [0,1,0,0,0,0|2,0,1]=4 1023 B13R1.128 C=C(C)CCOCC1CNC(=O)O1 34a_100011315639_100000730704 [0,1,0,0,0,0|2,0,1]=4 1024 B13R1.128 C=C(C)CCOCC1COC(=O)O1 34a_100000764851_100000073702 [0,1,0,0,0,0|2,0,1]=4 1025 B13R1.128 C=C(C)CCSCC1CNC(=O)O1 62a_100000181169_100000730704 [0,1,0,0,0,0|2,0,1]=4 1026 B13R1.128 C=C(C)CCSCC1CNC(=O)O1 62a_100000730704_100000181169 [0,1,0,0,0,0|2,0,1]=4 1027 B13R1.128 C=C(C)CCSCC1COC(=O)O1 62a_100000073702_100000730704 [0,1,0,0,0,0|2,0,1]=4 1028 B13R1.128 C=C(C)CCSCC1COC(=O)O1 62a_100000730704_100000073702 [0,1,0,0,0,0|2,0,1]=4 1029 B13R1.128 C=C(C)CCSC[C@@H]1CCC(=O)N1 62a_100000730704_100015189358 [0,1,0,0,0,0|2,0,1]=4 1030 B13R1.128 C=C(C)CCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000730704 [0,1,0,0,0,0|2,0,1]=4 1031 B13R1.128 CC(=O)CCCOC1CCC(=O)C1 34a_100012614533_100000685027 [0,1,0,0,0,0|2,0,1]=4 1032 B13R1.128 CC(=O)CCCOC1COC(=O)O1 34a_100000759063_100000032252 [0,1,0,0,0,0|2,0,1]=4 1033 B13R1.128 CC(=O)CCCSC1COC(=O)O1 62a_100011215641_100000032252 [0,1,0,0,0,0|2,0,1]=4 1034 B13R1.128 CC(=O)CCOCC1CNC(=O)O1 34a_100000759926_100000181169 [0,1,0,0,0,0|2,0,1]=4 1035 B13R1.128 CC(=O)CCOCC1CNC(=O)O1 7a_100000759926_100000181169 [0,1,0,0,0,0|2,0,1]=4 1036 B13R1.128 CC(=O)CCOCC1COC(=O)O1 34a_100000759926_100000073702 [0,1,0,0,0,0|2,0,1]=4 1037 B13R1.128 CC(=O)CCOC[C@@H]1CCC(=O)N1 7a_100000759926_100015189358 [0,1,0,0,0,0|2,0,1]=4 1038 B13R1.128 CC(=O)CCSCC1CNC(=O)O1 62a_100000053229_100000181169 [0,1,0,0,0,0|2,0,1]=4 1039 B13R1.128 CC(=O)CCSCC1CNC(=O)O1 62a_100000181169_100000053229 [0,1,0,0,0,0|2,0,1]=4 1040 B13R1.128 CC(=O)CCSCC1COC(=O)O1 62a_100000053229_100000073702 [0,1,0,0,0,0|2,0,1]=4 1041 B13R1.128 CC(=O)CCSCC1COC(=O)O1 62a_100000073702_100000053229 [0,1,0,0,0,0|2,0,1]=4 1042 B13R1.128 CC(=O)CCSC[C@@H]1CCC(=O)N1 62a_100000053229_100015189358 [0,1,0,0,0,0|2,0,1]=4 1043 B13R1.128 CC(=O)CCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000053229 [0,1,0,0,0,0|2,0,1]=4 1044 B13R1.128 CC(Br)CCOCC1CNC(=O)O1 34a_100009893172_100000181169 [0,1,0,0,0,0|2,0,0]=3 1045 B13R1.128 CC(Br)CCOCC1COC(=O)O1 34a_100009893172_100000073702 [0,1,0,0,0,0|2,0,0]=3 1046 B13R1.128 CC(Br)CCOC[C@H]1COC(=O)N1 34a_100009893172_100015307671 [0,1,0,0,0,0|3,0,0]=4 1047 B13R1.128 CC(C)CCCCN1CNC(=O)C1 2230a_200000708111_100011216152 [0,1,0,0,0,0|3,0,0]=4 1048 B13R1.128 CC(C)CCCNC1CNC(=O)C1 2230a_100000697751_100011214892 [0,1,0,0,0,0|3,0,0]=4 1049 B13R1.128 CC(C)CCCNC1COC(=O)O1 34a_200000737386_100000032252 [0,1,0,0,0,0|2,0,0]=3 1050 B13R1.128 CC(C)CCCOC1CCC(=O)C1 34a_100012614533_100011214892 [0,1,0,0,0,0|2,0,0]=3 1051 B13R1.128 CC(C)CCCOC1CNC(=O)C1 34a_100000690082_100011214892 [0,1,0,0,0,0|3,0,0]=4 1052 B13R1.128 CC(C)CCCOC1COC(=O)O1 34a_100000210774_100000032252 [0,1,0,0,0,0|2,0,0]=3 1053 B13R1.128 CC(C)CCCSC1COC(=O)O1 62a_100011214892_100000032252 [0,1,0,0,0,0|2,0,0]=3 1054 B13R1.128 CC(C)CCNCC1CNC(=O)C1 2230a_100016993742_100000210312 [0,1,0,0,0,0|3,0,0]=4 1055 B13R1.128 CC(C)CCNCC1CNC(=O)C1 269862a_100016993742_100000185833 [0,1,0,0,0,0|3,0,0]=4 1056 B13R1.128 CC(C)CCNCC1CNC(=O)C1 34a_100016993742_100000210312 [0,1,0,0,0,0|3,0,0]=4 1057 B13R1.128 CC(C)CCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000210312 [0,1,0,0,0,0|2,0,0]=3 1058 B13R1.128 CC(C)CCNC[C@H]1CCC(=O)N1 269862a_100015423886_100000185833 [0,1,0,0,0,0|2,0,0]=3 1059 B13R1.128 CC(C)CCNC[C@H]1CCC(=O)N1 34a_100015423886_100000210312 [0,1,0,0,0,0|2,0,0]=3 1060 B13R1.128 CC(C)CCOCC1CCC(=O)N1 34a_100000737831_100000210312 [0,1,0,0,0,0|2,0,0]=3 1061 B13R1.128 CC(C)CCOCC1CNC(=O)C1 34a_100016041077_100000210312 [0,1,0,0,0,0|3,0,0]=4 1062 B13R1.128 CC(C)CCOCC1CNC(=O)O1 34a_100000210254_100000181169 [0,1,0,0,0,0|2,0,0]=3 1063 B13R1.128 CC(C)CCOCC1CNC(=O)O1 34a_100011315639_100000210312 [0,1,0,0,0,0|2,0,0]=3 1064 B13R1.128 CC(C)CCOCC1CNC(=O)O1 7a_100000210254_100000181169 [0,1,0,0,0,0|2,0,0]=3 1065 B13R1.128 CC(C)CCOCC1COC(=O)O1 34a_100000210254_100000073702 [0,1,0,0,0,0|2,0,0]=3 1066 B13R1.128 CC(C)CCOC[C@@H]1CCC(=O)N1 7a_100000210254_100015189358 [0,1,0,0,0,0|2,0,0]=3 1067 B13R1.128 CC(C)CCOC[C@H]1COC(=O)N1 34a_100000210254_100015307671 [0,1,0,0,0,0|3,0,0]=4 1068 B13R1.128 CC(C)CCOC[C@H]1COC(=O)N1 7a_100000210254_100015307671 [0,1,0,0,0,0|3,0,0]=4 1069 B13R1.128 CC(C)CCSCC1CNC(=O)O1 62a_100000181169_100000210312 [0,1,0,0,0,0|2,0,0]=3 1070 B13R1.128 CC(C)CCSCC1CNC(=O)O1 62a_100000210312_100000181169 [0,1,0,0,0,0|2,0,0]=3 1071 B13R1.128 CC(C)CCSCC1COC(=O)O1 62a_100000073702_100000210312 [0,1,0,0,0,0|2,0,0]=3 1072 B13R1.128 CC(C)CCSCC1COC(=O)O1 62a_100000210312_100000073702 [0,1,0,0,0,0|2,0,0]=3 1073 B13R1.128 CC(C)CCSC[C@@H]1CCC(=O)N1 62a_100000210312_100015189358 [0,1,0,0,0,0|2,0,0]=3 1074 B13R1.128 CC(C)CCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000210312 [0,1,0,0,0,0|2,0,0]=3 1075 B13R1.128 CC(C)CCSC[C@H]1COC(=O)N1 62a_100000210312_100015307671 [0,1,0,0,0,0|3,0,0]=4 1076 B13R1.128 CC(C)CCSC[C@H]1COC(=O)N1 62a_100015307671_100000210312 [0,1,0,0,0,0|3,0,0]=4 1077 B13R1.128 CC(C)CSCCC1COS(=O)O1 62a_100000210624_100009840081 [0,1,0,0,0,0|3,0,0]=4 1078 B13R1.128 CC(C)NCCOC1COC(=O)O1 34a_100000224655_100000032252 [0,1,0,0,0,0|3,0,0]=4 1079 B13R1.128 CC(C)OCCNC1COC(=O)O1 34a_100000701111_100000032252 [0,1,0,0,0,0|3,0,0]=4 1080 B13R1.128 CC(C)OCCOC1CCC(=O)C1 34a_100012614533_100000211751 [0,1,0,0,0,0|3,0,0]=4 1081 B13R1.128 CC(C)OCCOC1COC(=O)O1 34a_100000211219_100000032252 [0,1,0,0,0,0|3,0,0]=4 1082 B13R1.128 CC(C)OCCSC1COC(=O)O1 62a_100000211751_100000032252 [0,1,0,0,0,0|3,0,0]=4 1083 B13R1.128 CC(C)OCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000709892 [0,1,0,0,0,0|3,0,0]=4 1084 B13R1.128 CC(C)OCNC[C@H]1CCC(=O)N1 34a_100015423886_100000709892 [0,1,0,0,0,0|3,0,0]=4 1085 B13R1.128 CC(C)OCOCC1CCC(=O)N1 34a_100000737831_100000709892 [0,1,0,0,0,0|3,0,0]=4 1086 B13R1.128 CC(C)OCOCC1CNC(=O)O1 34a_100011315639_100000709892 [0,1,0,0,0,0|3,0,0]=4 1087 B13R1.128 CC(C)OCSCC1CNC(=O)O1 62a_100000181169_100000709892 [0,1,0,0,0,0|3,0,0]=4 1088 B13R1.128 CC(C)OCSCC1CNC(=O)O1 62a_100000709892_100000181169 [0,1,0,0,0,0|3,0,0]=4 1089 B13R1.128 CC(C)OCSCC1COC(=O)O1 62a_100000073702_100000709892 [0,1,0,0,0,0|3,0,0]=4 1090 B13R1.128 CC(C)OCSCC1COC(=O)O1 62a_100000709892_100000073702 [0,1,0,0,0,0|3,0,0]=4 1091 B13R1.128 CC(C)OCSC[C@@H]1CCC(=O)N1 62a_100000709892_100015189358 [0,1,0,0,0,0|3,0,0]=4 1092 B13R1.128 CC(C)OCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000709892 [0,1,0,0,0,0|3,0,0]=4 1093 B13R1.128 CC(C)SCCNC1COC(=O)O1 34a_100000731138_100000032252 [0,1,0,0,0,0|3,0,0]=4 1094 B13R1.128 CC(C)SCCOC1CCC(=O)C1 34a_100012614533_100000730970 [0,1,0,0,0,0|3,0,0]=4 1095 B13R1.128 CC(C)SCCOC1COC(=O)O1 34a_200011212901_100000032252 [0,1,0,0,0,0|3,0,0]=4 1096 B13R1.128 CC(C)SCCSC1COC(=O)O1 62a_100000730970_100000032252 [0,1,0,0,0,0|3,0,0]=4 1097 B13R1.128 CC(O)CCCNC1CNC(=O)C1 2230a_100000697751_200000718107 [0,1,0,0,0,0|3,0,0]=4 1098 B13R1.128 CC(O)CCCOC1CCC(=O)C1 34a_100012614533_200000718107 [0,1,0,0,0,0|2,0,0]=3 1099 B13R1.128 CC(O)CCCOC1CNC(=O)C1 34a_100000690082_200000718107 [0,1,0,0,0,0|3,0,0]=4 1100 B13R1.128 CC(O)CCCSC1COC(=O)O1 62a_200000718107_100000032252 [0,1,0,0,0,0|2,0,0]=3 1101 B13R1.128 CC(O)CCNCC1CNC(=O)C1 2230a_100016993742_100012276601 [0,1,0,0,0,0|3,0,0]=4 1102 B13R1.128 CC(O)CCNCC1CNC(=O)C1 34a_100016993742_100012276601 [0,1,0,0,0,0|3,0,0]=4 1103 B13R1.128 CC(O)CCNCC1CNC(=O)O1 2230a_200000755665_100000181169 [0,1,0,0,0,0|2,0,0]=3 1104 B13R1.128 CC(O)CCNC[C@@H]1CCC(=O)N1 2230a_200000755665_100015189358 [0,1,0,0,0,0|2,0,0]=3 1105 B13R1.128 CC(O)CCNC[C@H]1CCC(=O)N1 2230a_100015423886_100012276601 [0,1,0,0,0,0|2,0,0]=3 1106 B13R1.128 CC(O)CCNC[C@H]1CCC(=O)N1 34a_100015423886_100012276601 [0,1,0,0,0,0|2,0,0]=3 1107 B13R1.128 CC(O)CCNC[C@H]1COC(=O)N1 2230a_200000755665_100015307671 [0,1,0,0,0,0|3,0,0]=4 1108 B13R1.128 CC(O)CCOCC1CCC(=O)N1 34a_100000737831_100012276601 [0,1,0,0,0,0|2,0,0]=3 1109 B13R1.128 CC(O)CCOCC1CNC(=O)C1 34a_100016041077_100012276601 [0,1,0,0,0,0|3,0,0]=4 1110 B13R1.128 CC(O)CCOCC1CNC(=O)O1 34a_100011315639_100012276601 [0,1,0,0,0,0|2,0,0]=3 1111 B13R1.128 CC(O)CCSCC1CNC(=O)O1 62a_100000181169_100012276601 [0,1,0,0,0,0|2,0,0]=3 1112 B13R1.128 CC(O)CCSCC1CNC(=O)O1 62a_100012276601_100000181169 [0,1,0,0,0,0|2,0,0]=3 1113 B13R1.128 CC(O)CCSCC1COC(=O)O1 62a_100000073702_100012276601 [0,1,0,0,0,0|2,0,0]=3 1114 B13R1.128 CC(O)CCSCC1COC(=O)O1 62a_100012276601_100000073702 [0,1,0,0,0,0|2,0,0]=3 1115 B13R1.128 CC(O)CCSC[C@@H]1CCC(=O)N1 62a_100012276601_100015189358 [0,1,0,0,0,0|2,0,0]=3 1116 B13R1.128 CC(O)CCSC[C@@H]1CCC(=O)N1 62a_100015189358_100012276601 [0,1,0,0,0,0|2,0,0]=3 1117 B13R1.128 CC(O)CCSC[C@H]1COC(=O)N1 62a_100012276601_100015307671 [0,1,0,0,0,0|3,0,0]=4 1118 B13R1.128 CC(O)CCSC[C@H]1COC(=O)N1 62a_100015307671_100012276601 [0,1,0,0,0,0|3,0,0]=4 1119 B13R1.128 CC(O)CSCCC1COS(=O)O1 62a_100011218427_100009840081 [0,1,0,0,0,0|3,0,0]=4 1120 B13R1.128 CN(C)CCSCC1CNC(=O)O1 62a_100000181169_100000755713 [0,1,0,0,0,0|3,0,0]=4 1121 B13R1.128 CN(C)CCSCC1COC(=O)O1 62a_100000073702_100000755713 [0,1,0,0,0,0|3,0,0]=4 1122 B13R1.128 CN(C)CCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000755713 [0,1,0,0,0,0|3,0,0]=4 1123 B13R1.128 C[C@@H](N)CCOCC1CNC(=O)O1 34a_100000706166_100000181169 [0,1,0,0,0,0|2,0,0]=3 1124 B13R1.128 C[C@@H](N)CCOCC1COC(=O)O1 34a_100000706166_100000073702 [0,1,0,0,0,0|2,0,0]=3 1125 B13R1.128 C[C@@H](N)CCOC[C@H]1COC(=O)N1 34a_100000706166_100015307671 [0,1,0,0,0,0|3,0,0]=4 1126 B13R1.128 C[C@@H](O)CSCCC1COS(=O)O1 62a_100009817552_100009840081 [0,1,0,0,0,0|3,0,0]=4 1127 B13R1.128 O=C1NCC(O1)COCCC(F)F 34a_100103093639_100000181169 [0,1,0,0,0,0|3,0,0]=4 1128 B13R1.128 O=C1OCC(O1)COCCC(F)F 34a_100103093639_100000073702 [0,1,0,0,0,0|3,0,0]=4 1129 B13R1.191 CCCCCNC1C=C(C(=O)O1)C 2230a_100000209983_200009893386 [0,1,0,0,0,0|1,0,2]=4 1130 B13R1.191 CCCCCNC1CC(=O)N(C1)C 2230a_100000748898_100000210326 [0,1,0,0,0,0|3,0,0]=4 1131 B13R1.191 CCCCCNC1CC(=O)N(C1)C 34a_100000748898_100000718602 [0,1,0,0,0,0|3,0,0]=4 1132 B13R1.191 CCCCCSC1C=C(C(=O)O1)C 62a_100000210326_200009893386 [0,1,0,0,0,0|1,0,2]=4 1133 B13R1.191 CCCCCSC1C=C(C(=O)O1)C 62a_200009893386_100000210326 [0,1,0,0,0,0|1,0,2]=4 1134 B13R1.191 CCCCOCC1CC(=O)N(C1)C 34a_100015185614_100000210210 [0,1,0,0,0,0|3,0,0]=4 1135 B13R1.717 CC(CN)COCC1CNC(=O)O1 34a_100000744482_100000181169 [0,1,0,0,0,0|3,0,0]=4 1136 B13R1.717 CC(CN)COCC1COC(=O)O1 34a_100000744482_100000073702 [0,1,0,0,0,0|3,0,0]=4 1137 B13R1.717 CC(CO)CCNC1COC(=O)O1 34a_106354213184_100000032252 [0,1,0,0,0,0|3,0,0]=4 1138 B13R1.717 CC(CO)CNCC1CNC(=O)O1 34a_100000744482_100000181169 [0,1,0,0,0,0|3,0,0]=4 1139 B13R1.717 CC(CO)CNCC1COC(=O)O1 34a_100000744482_100000073702 [0,1,0,0,0,0|3,0,0]=4 1140 B13R1.717 CCC(=O)COCC1CNC(=O)O1 34a_100000725409_100000181169 [0,1,0,0,0,0|2,0,1]=4 1141 B13R1.717 CCC(=O)COCC1COC(=O)O1 34a_100000725409_100000073702 [0,1,0,0,0,0|2,0,1]=4 1142 B13R1.717 CCC(=O)CSCC1CNC(=O)O1 62a_100000181169_100000747405 [0,1,0,0,0,0|2,0,1]=4 1143 B13R1.717 CCC(=O)CSCC1CNC(=O)O1 62a_100000747405_100000181169 [0,1,0,0,0,0|2,0,1]=4 1144 B13R1.717 CCC(=O)CSCC1COC(=O)O1 62a_100000073702_100000747405 [0,1,0,0,0,0|2,0,1]=4 1145 B13R1.717 CCC(=O)CSCC1COC(=O)O1 62a_100000747405_100000073702 [0,1,0,0,0,0|2,0,1]=4 1146 B13R1.717 CCC(=O)CSC[C@@H]1CCC(=O)N1 62a_100000747405_100015189358 [0,1,0,0,0,0|2,0,1]=4 1147 B13R1.717 CCC(=O)CSC[C@@H]1CCC(=O)N1 62a_100015189358_100000747405 [0,1,0,0,0,0|2,0,1]=4 1148 B13R1.717 CCC(C)CNCC1CNC(=O)C1 2230a_100016993742_100000748023 [0,1,0,0,0,0|3,0,0]=4 1149 B13R1.717 CCC(C)CNCC1CNC(=O)C1 34a_100016993742_100000748023 [0,1,0,0,0,0|3,0,0]=4 1150 B13R1.717 CCC(C)CNCC1CNC(=O)O1 2230a_100020588543_100000181169 [0,1,0,0,0,0|2,0,0]=3 1151 B13R1.717 CCC(C)CNC[C@@H]1CCC(=O)N1 2230a_100020588543_100015189358 [0,1,0,0,0,0|2,0,0]=3 1152 B13R1.717 CCC(C)CNC[C@H]1CCC(=O)N1 2230a_100015423886_100000748023 [0,1,0,0,0,0|2,0,0]=3 1153 B13R1.717 CCC(C)CNC[C@H]1CCC(=O)N1 270004a_100015423886_100000243153 [0,1,0,0,0,0|2,0,0]=3 1154 B13R1.717 CCC(C)CNC[C@H]1CCC(=O)N1 34a_100015423886_100000748023 [0,1,0,0,0,0|2,0,0]=3 1155 B13R1.717 CCC(C)CNC[C@H]1COC(=O)N1 2230a_100020588543_100015307671 [0,1,0,0,0,0|3,0,0]=4 1156 B13R1.717 CCC(C)COCC1CCC(=O)N1 34a_100000737831_100000748023 [0,1,0,0,0,0|2,0,0]=3 1157 B13R1.717 CCC(C)COCC1CNC(=O)C1 34a_100016041077_100000748023 [0,1,0,0,0,0|3,0,0]=4 1158 B13R1.717 CCC(C)COCC1CNC(=O)O1 34a_100011315639_100000748023 [0,1,0,0,0,0|2,0,0]=3 1159 B13R1.717 CCC(C)CSCC1CNC(=O)O1 62a_100000181169_100000748023 [0,1,0,0,0,0|2,0,0]=3 1160 B13R1.717 CCC(C)CSCC1CNC(=O)O1 62a_100000748023_100000181169 [0,1,0,0,0,0|2,0,0]=3 1161 B13R1.717 CCC(C)CSCC1COC(=O)O1 62a_100000073702_100000748023 [0,1,0,0,0,0|2,0,0]=3 1162 B13R1.717 CCC(C)CSCC1COC(=O)O1 62a_100000748023_100000073702 [0,1,0,0,0,0|2,0,0]=3 1163 B13R1.717 CCC(C)CSC[C@@H]1CCC(=O)N1 62a_100000748023_100015189358 [0,1,0,0,0,0|2,0,0]=3 1164 B13R1.717 CCC(C)CSC[C@@H]1CCC(=O)N1 62a_100015189358_100000748023 [0,1,0,0,0,0|2,0,0]=3 1165 B13R1.717 CCC(C)CSC[C@H]1COC(=O)N1 62a_100000748023_100015307671 [0,1,0,0,0,0|3,0,0]=4 1166 B13R1.717 CCC(C)CSC[C@H]1COC(=O)N1 62a_100015307671_100000748023 [0,1,0,0,0,0|3,0,0]=4 1167 B13R1.717 CCC(C)OCCC1COS(=O)O1 7a_100000210228_100009840081 [0,1,0,0,0,0|3,0,0]=4 1168 B13R1.717 CCC(C)SCCC1COS(=O)O1 62a_100000758301_100009840081 [0,1,0,0,0,0|3,0,0]=4 1169 B13R1.717 CCC(O)CNCC1CNC(=O)C1 2230a_100016993742_100011218378 [0,1,0,0,0,0|3,0,0]=4 1170 B13R1.717 CCC(O)CNCC1CNC(=O)C1 34a_100016993742_100011218378 [0,1,0,0,0,0|3,0,0]=4 1171 B13R1.717 CCC(O)CNCC1CNC(=O)O1 2230a_100011218483_100000181169 [0,1,0,0,0,0|2,0,0]=3 1172 B13R1.717 CCC(O)CNC[C@@H]1CCC(=O)N1 2230a_100011218483_100015189358 [0,1,0,0,0,0|2,0,0]=3 1173 B13R1.717 CCC(O)CNC[C@H]1CCC(=O)N1 2230a_100015423886_100011218378 [0,1,0,0,0,0|2,0,0]=3 1174 B13R1.717 CCC(O)CNC[C@H]1CCC(=O)N1 34a_100015423886_100011218378 [0,1,0,0,0,0|2,0,0]=3 1175 B13R1.717 CCC(O)CNC[C@H]1COC(=O)N1 2230a_100011218483_100015307671 [0,1,0,0,0,0|3,0,0]=4 1176 B13R1.717 CCC(O)COCC1CCC(=O)N1 34a_100000737831_100011218378 [0,1,0,0,0,0|2,0,0]=3 1177 B13R1.717 CCC(O)COCC1CNC(=O)C1 34a_100016041077_100011218378 [0,1,0,0,0,0|3,0,0]=4 1178 B13R1.717 CCC(O)COCC1CNC(=O)O1 34a_100011315639_100011218378 [0,1,0,0,0,0|2,0,0]=3 1179 B13R1.717 CCC(O)CSCC1CNC(=O)O1 62a_100000181169_100011218378 [0,1,0,0,0,0|2,0,0]=3 1180 B13R1.717 CCC(O)CSCC1CNC(=O)O1 62a_100011218378_100000181169 [0,1,0,0,0,0|2,0,0]=3 1181 B13R1.717 CCC(O)CSCC1COC(=O)O1 62a_100000073702_100011218378 [0,1,0,0,0,0|2,0,0]=3 1182 B13R1.717 CCC(O)CSCC1COC(=O)O1 62a_100011218378_100000073702 [0,1,0,0,0,0|2,0,0]=3 1183 B13R1.717 CCC(O)CSC[C@@H]1CCC(=O)N1 62a_100011218378_100015189358 [0,1,0,0,0,0|2,0,0]=3 1184 B13R1.717 CCC(O)CSC[C@@H]1CCC(=O)N1 62a_100015189358_100011218378 [0,1,0,0,0,0|2,0,0]=3 1185 B13R1.717 CCC(O)CSC[C@H]1COC(=O)N1 62a_100011218378_100015307671 [0,1,0,0,0,0|3,0,0]=4 1186 B13R1.717 CCC(O)CSC[C@H]1COC(=O)N1 62a_100015307671_100011218378 [0,1,0,0,0,0|3,0,0]=4 1187 B13R1.717 CC[C@H](C)CNCC1CNC(=O)C1 2230a_100016993742_100009816398 [0,1,0,0,0,0|3,0,0]=4 1188 B13R1.717 CC[C@H](C)CNCC1CNC(=O)C1 34a_100016993742_100009816398 [0,1,0,0,0,0|3,0,0]=4 1189 B13R1.717 CC[C@H](C)CNC[C@H]1CCC(=O)N1 2230a_100015423886_100009816398 [0,1,0,0,0,0|2,0,0]=3 1190 B13R1.717 CC[C@H](C)CNC[C@H]1CCC(=O)N1 34a_100015423886_100009816398 [0,1,0,0,0,0|2,0,0]=3 1191 B13R1.717 CC[C@H](C)COCC1CCC(=O)N1 34a_100000737831_100009816398 [0,1,0,0,0,0|2,0,0]=3 1192 B13R1.717 CC[C@H](C)COCC1CNC(=O)C1 34a_100016041077_100009816398 [0,1,0,0,0,0|3,0,0]=4 1193 B13R1.717 CC[C@H](C)COCC1CNC(=O)O1 34a_100011315639_100009816398 [0,1,0,0,0,0|2,0,0]=3 1194 B13R1.717 CC[C@H](C)COCC1CNC(=O)O1 7a_100009816381_100000181169 [0,1,0,0,0,0|2,0,0]=3 1195 B13R1.717 CC[C@H](C)COC[C@@H]1CCC(=O)N1 7a_100009816381_100015189358 [0,1,0,0,0,0|2,0,0]=3 1196 B13R1.717 CC[C@H](C)COC[C@H]1COC(=O)N1 7a_100009816381_100015307671 [0,1,0,0,0,0|3,0,0]=4 1197 B13R1.717 CC[C@H](C)CSCC1CNC(=O)O1 62a_100000181169_100009816398 [0,1,0,0,0,0|2,0,0]=3 1198 B13R1.717 CC[C@H](C)CSCC1CNC(=O)O1 62a_100009816398_100000181169 [0,1,0,0,0,0|2,0,0]=3 1199 B13R1.717 CC[C@H](C)CSCC1COC(=O)O1 62a_100000073702_100009816398 [0,1,0,0,0,0|2,0,0]=3 1200 B13R1.717 CC[C@H](C)CSCC1COC(=O)O1 62a_100009816398_100000073702 [0,1,0,0,0,0|2,0,0]=3 1201 B13R1.717 CC[C@H](C)CSC[C@@H]1CCC(=O)N1 62a_100009816398_100015189358 [0,1,0,0,0,0|2,0,0]=3 1202 B13R1.717 CC[C@H](C)CSC[C@@H]1CCC(=O)N1 62a_100015189358_100009816398 [0,1,0,0,0,0|2,0,0]=3 1203 B13R1.717 CC[C@H](C)CSC[C@H]1COC(=O)N1 62a_100009816398_100015307671 [0,1,0,0,0,0|3,0,0]=4 1204 B13R1.717 CC[C@H](C)CSC[C@H]1COC(=O)N1 62a_100015307671_100009816398 [0,1,0,0,0,0|3,0,0]=4 1205 B13R1.717 COC(C)COCC1CNC(=O)O1 34a_100000690652_100000181169 [0,1,0,0,0,0|3,0,0]=4 1206 B13R1.717 COC(C)COCC1COC(=O)O1 34a_100000690652_100000073702 [0,1,0,0,0,0|3,0,0]=4 1207 B13R1.717 CO[C@H](C)CNCC1CNC(=O)O1 2230a_100020591295_100000181169 [0,1,0,0,0,0|3,0,0]=4 1208 B13R1.717 CO[C@H](C)CNC[C@@H]1CCC(=O)N1 2230a_100020591295_100015189358 [0,1,0,0,0,0|3,0,0]=4 1209 B13R1.717 C[C@@H](CO)CNC[C@H]1CCC(=O)N1 2230a_100015423886_100000059175 [0,1,0,0,0,0|3,0,0]=4 1210 B13R1.717 C[C@@H](CO)CNC[C@H]1CCC(=O)N1 34a_100015423886_100000059175 [0,1,0,0,0,0|3,0,0]=4 1211 B13R1.717 C[C@@H](CO)COCC1CCC(=O)N1 34a_100000737831_100000059175 [0,1,0,0,0,0|3,0,0]=4 1212 B13R1.717 C[C@@H](CO)COCC1CNC(=O)O1 34a_100011315639_100000059175 [0,1,0,0,0,0|3,0,0]=4 1213 B13R1.717 C[C@@H](CO)CSCC1CNC(=O)O1 62a_100000059175_100000181169 [0,1,0,0,0,0|3,0,0]=4 1214 B13R1.717 C[C@@H](CO)CSCC1CNC(=O)O1 62a_100000181169_100000059175 [0,1,0,0,0,0|3,0,0]=4 1215 B13R1.717 C[C@@H](CO)CSCC1COC(=O)O1 62a_100000059175_100000073702 [0,1,0,0,0,0|3,0,0]=4 1216 B13R1.717 C[C@@H](CO)CSCC1COC(=O)O1 62a_100000073702_100000059175 [0,1,0,0,0,0|3,0,0]=4 1217 B13R1.717 C[C@@H](CO)CSC[C@@H]1CCC(=O)N1 62a_100000059175_100015189358 [0,1,0,0,0,0|3,0,0]=4 1218 B13R1.717 C[C@@H](CO)CSC[C@@H]1CCC(=O)N1 62a_100015189358_100000059175 [0,1,0,0,0,0|3,0,0]=4 1219 B13R1.717 NC[C@@H](F)COCC1CNC(=O)O1 34a_100015665980_100000181169 [0,1,0,0,0,0|3,0,0]=4 1220 B13R1.717 NC[C@@H](F)COCC1COC(=O)O1 34a_100015665980_100000073702 [0,1,0,0,0,0|3,0,0]=4 1221 B13R1.717 O=C1CCC(N1)COCC(O)CO 34a_100000737831_100011219619 [0,1,0,0,0,0|3,0,0]=4 1222 B13R1.717 O=C1CCC(N1)COC[C@@H](O)CF 34a_100000737831_100015614560 [0,1,0,0,0,0|3,0,0]=4 1223 B13R1.717 O=C1CCC(N1)COC[C@@H](O)CO 34a_100000737831_100009815848 [0,1,0,0,0,0|3,0,0]=4 1224 B13R1.717 O=C1CC[C@@H](N1)CNCC(O)CO 2230a_100015423886_100011219619 [0,1,0,0,0,0|3,0,0]=4 1225 B13R1.717 O=C1CC[C@@H](N1)CNCC(O)CO 34a_100015423886_100011219619 [0,1,0,0,0,0|3,0,0]=4 1226 B13R1.717 O=C1CC[C@@H](N1)CNC[C@@H](O)CF 2230a_100015423886_100015614560 [0,1,0,0,0,0|3,0,0]=4 1227 B13R1.717 O=C1CC[C@@H](N1)CNC[C@@H](O)CF 34a_100015423886_100015614560 [0,1,0,0,0,0|3,0,0]=4 1228 B13R1.717 O=C1CC[C@@H](N1)CNC[C@@H](O)CO 2230a_100015423886_100009815848 [0,1,0,0,0,0|3,0,0]=4 1229 B13R1.717 O=C1CC[C@@H](N1)CNC[C@@H](O)CO 34a_100015423886_100009815848 [0,1,0,0,0,0|3,0,0]=4 1230 B13R1.717 O=C1CC[C@H](N1)CNC[C@H](O)CO 2230a_100020644852_100015189358 [0,1,0,0,0,0|3,0,0]=4 1231 B13R1.717 O=C1CC[C@H](N1)CSCC(O)CO 62a_100011219619_100015189358 [0,1,0,0,0,0|3,0,0]=4 1232 B13R1.717 O=C1CC[C@H](N1)CSCC(O)CO 62a_100015189358_100011219619 [0,1,0,0,0,0|3,0,0]=4 1233 B13R1.717 O=C1CC[C@H](N1)CSC[C@@H](O)CF 62a_100015189358_100015614560 [0,1,0,0,0,0|3,0,0]=4 1234 B13R1.717 O=C1CC[C@H](N1)CSC[C@@H](O)CF 62a_100015614560_100015189358 [0,1,0,0,0,0|3,0,0]=4 1235 B13R1.717 O=C1CC[C@H](N1)CSC[C@@H](O)CO 62a_100009815848_100015189358 [0,1,0,0,0,0|3,0,0]=4 1236 B13R1.717 O=C1CC[C@H](N1)CSC[C@@H](O)CO 62a_100015189358_100009815848 [0,1,0,0,0,0|3,0,0]=4 1237 B13R1.717 O=C1NCC(O1)CNC[C@@H](F)CO 34a_100015665980_100000181169 [0,1,0,0,0,0|3,0,0]=4 1238 B13R1.717 O=C1NCC(O1)CNC[C@H](O)CO 2230a_100020644852_100000181169 [0,1,0,0,0,0|3,0,0]=4 1239 B13R1.717 O=C1NCC(O1)COCC(Cl)CCl 34a_100000033668_100000181169 [0,1,0,0,0,0|3,0,0]=4 1240 B13R1.717 O=C1NCC(O1)COCC(O)CO 34a_100011315639_100011219619 [0,1,0,0,0,0|3,0,0]=4 1241 B13R1.717 O=C1NCC(O1)COC[C@@H](O)CF 34a_100011315639_100015614560 [0,1,0,0,0,0|3,0,0]=4 1242 B13R1.717 O=C1NCC(O1)COC[C@@H](O)CO 34a_100011315639_100009815848 [0,1,0,0,0,0|3,0,0]=4 1243 B13R1.717 O=C1NCC(O1)CSCC(O)CO 62a_100000181169_100011219619 [0,1,0,0,0,0|3,0,0]=4 1244 B13R1.717 O=C1NCC(O1)CSCC(O)CO 62a_100011219619_100000181169 [0,1,0,0,0,0|3,0,0]=4 1245 B13R1.717 O=C1NCC(O1)CSC[C@@H](O)CF 62a_100000181169_100015614560 [0,1,0,0,0,0|3,0,0]=4 1246 B13R1.717 O=C1NCC(O1)CSC[C@@H](O)CF 62a_100015614560_100000181169 [0,1,0,0,0,0|3,0,0]=4 1247 B13R1.717 O=C1NCC(O1)CSC[C@@H](O)CO 62a_100000181169_100009815848 [0,1,0,0,0,0|3,0,0]=4 1248 B13R1.717 O=C1NCC(O1)CSC[C@@H](O)CO 62a_100009815848_100000181169 [0,1,0,0,0,0|3,0,0]=4 1249 B13R1.717 O=C1OCC(O1)CNC[C@@H](F)CO 34a_100015665980_100000073702 [0,1,0,0,0,0|3,0,0]=4 1250 B13R1.717 O=C1OCC(O1)COCC(Cl)CCl 34a_100000033668_100000073702 [0,1,0,0,0,0|3,0,0]=4 1251 B13R1.717 O=C1OCC(O1)CSCC(O)CO 62a_100000073702_100011219619 [0,1,0,0,0,0|3,0,0]=4 1252 B13R1.717 O=C1OCC(O1)CSCC(O)CO 62a_100011219619_100000073702 [0,1,0,0,0,0|3,0,0]=4 1253 B13R1.717 O=C1OCC(O1)CSC[C@@H](O)CF 62a_100000073702_100015614560 [0,1,0,0,0,0|3,0,0]=4 1254 B13R1.717 O=C1OCC(O1)CSC[C@@H](O)CF 62a_100015614560_100000073702 [0,1,0,0,0,0|3,0,0]=4 1255 B13R1.717 O=C1OCC(O1)CSC[C@@H](O)CO 62a_100000073702_100009815848 [0,1,0,0,0,0|3,0,0]=4 1256 B13R1.717 O=C1OCC(O1)CSC[C@@H](O)CO 62a_100009815848_100000073702 [0,1,0,0,0,0|3,0,0]=4 1257 B13R1.3441 CCCCCNC1CCS(=O)(=O)C1 2230a_100000683523_100000210326 [0,1,0,0,0,0|3,0,0]=4 1258 B13R1.3441 CCCCCNC1CCS(=O)(=O)C1 34a_100000683523_100000718602 [0,1,0,0,0,0|3,0,0]=4 1259 B13R1.3441 CCCCCOC1CCS(=O)(=O)C1 34a_100000186101_100000718602 [0,1,0,0,0,0|3,0,0]=4 1260 B13R1.3441 CCCCCOC1CCS(=O)(=O)C1 7a_100000186101_100000210326 [0,1,0,0,0,0|3,0,0]=4 1261 B13R1.3441 CCCCNCC1CCS(=O)(=O)C1 2230a_100000737051_100000210211 [0,1,0,0,0,0|3,0,0]=4 1262 B13R1.3441 CCCCNCC1CCS(=O)(=O)C1 34a_100000737051_100000210210 [0,1,0,0,0,0|3,0,0]=4 1263 B11R0.2 C#CCCCSC(C)OC(=O)C 62a_100009818208_100011215417 [0,0,1,0,0,0|1,0,2]=4 1264 B11R0.2 C#CCCCSC(C)OC(=O)C 62a_100011215417_100009818208 [0,0,1,0,0,0|1,0,2]=4 1265 B11R0.2 C=C(C)CN(C)CCCCCC 2230a_100000225649_100000210314 [0,0,1,0,0,0|3,0,0]=4 1266 B11R0.2 C=C(C)CN(C)CCCCCC 2230a_106256046315_100000748629 [0,0,1,0,0,0|3,0,0]=4 1267 B11R0.2 C=C(C)CN(C)CCCCCC 269982a_100000225649_100000210757 [0,0,1,0,0,0|3,0,0]=4 1268 B11R0.2 C=C(C)CN(C)CCCCCC 269982a_106256046315_100000748629 [0,0,1,0,0,0|3,0,0]=4 1269 B11R0.2 C=CCCCSC(C)OC(=O)C 62a_100009818208_100000757094 [0,0,1,0,0,0|1,0,2]=4 1270 B11R0.2 C=CCCCSC(C)OC(=O)C 62a_100011713584_100009818208 [0,0,1,0,0,0|1,0,2]=4 1271 B11R0.2 CC(=O)OC(C)SCCCC#N 62a_100000687738_100009818208 [0,0,1,0,0,0|2,0,1]=4 1272 B11R0.2 CC(=O)OC(C)SCCCC#N 62a_100009818208_100000687738 [0,0,1,0,0,0|2,0,1]=4 1273 B11R0.2 CC(=O)OC(C)SCCCC=O 62a_100009818208_200011292268 [0,0,1,0,0,0|2,0,1]=4 1274 B11R0.2 CC(=O)OC(C)SCCCC=O 62a_200011292268_100009818208 [0,0,1,0,0,0|2,0,1]=4 1275 B11R0.2 CC(=O)OC(C)SCCCCF 62a_100000729493_100009818208 [0,0,1,0,0,0|2,0,0]=3 1276 B11R0.2 CC(=O)OC(C)SCCCCF 62a_100009818208_100000729493 [0,0,1,0,0,0|2,0,0]=3 1277 B11R0.2 CC(=O)OC(C)SCCCCO 62a_100000210776_100009818208 [0,0,1,0,0,0|2,0,0]=3 1278 B11R0.2 CC(=O)OC(C)SCCCCO 62a_100009818208_100000210776 [0,0,1,0,0,0|2,0,0]=3 1279 B11R0.2 CC/C=C\CSC(C)OC(=O)C 62a_100009818208_100103147603 [0,0,1,0,0,0|1,0,2]=4 1280 B11R0.2 CC/C=C\CSC(C)OC(=O)C 62a_100103147603_100009818208 [0,0,1,0,0,0|1,0,2]=4 1281 B11R0.2 CCC#CCSC(C)OC(=O)C 62a_100009813939_100009818208 [0,0,1,0,0,0|1,0,2]=4 1282 B11R0.2 CCC#CCSC(C)OC(=O)C 62a_100009818208_100009813939 [0,0,1,0,0,0|1,0,2]=4 1283 B11R0.2 CCCCCCC(C)NC(=O)C 11a_100000210919_100015343762 [0,0,1,0,0,0|1,0,0]=2 1284 B11R0.2 CCCCCCC(C)NC(=O)C 1626a_100000210919_100015343762 [0,0,1,0,0,0|1,0,0]=2 1285 B11R0.2 CCCCCCC(C)NC(=O)C 240690a_100000210919_100015343762 [0,0,1,0,0,0|1,0,0]=2 1286 B11R0.2 CCCCCCC(C)NC(=O)C 527a_100000210919_100103153847 [0,0,1,0,0,0|1,0,0]=2 1287 B11R0.2 CCCCCCC(C)NC(C)C 2230a_100000210919_100000210206 [0,0,1,0,0,0|2,0,1]=4 1288 B11R0.2 CCCCCCC(C)NC(C)C 2230a_100138425928_100011215978 [0,0,1,0,0,0|2,0,1]=4 1289 B11R0.2 CCCCCCC(C)NC(C)C 34a_100000210919_100000210206 [0,0,1,0,0,0|2,0,1]=4 1290 B11R0.2 CCCCCCC(C)NC(C)C 34a_100138425928_100011215978 [0,0,1,0,0,0|2,0,1]=4 1291 B11R0.2 CCCCCCC(C)OC(C)C 34a_100000210265_100000210206 [0,0,1,0,0,0|1,0,1]=3 1292 B11R0.2 CCCCCCC(C)OC(C)C 34a_100000212225_100011215978 [0,0,1,0,0,0|1,0,1]=3 1293 B11R0.2 CCCCCCC(C)OC(C)C 7a_100000210265_100000210206 [0,0,1,0,0,0|1,0,1]=3 1294 B11R0.2 CCCCCCC(C)SC(C)C 62a_100000210206_100011215978 [0,0,1,0,0,0|1,1,1]=4 1295 B11R0.2 CCCCCCC(C)SC(C)C 62a_100011215978_100000210206 [0,0,1,0,0,0|1,1,1]=4 1296 B11R0.2 CCCCCCN(C)CC(=O)N 2230a_100000739694_100000210314 [0,0,1,0,0,0|3,0,0]=4 1297 B11R0.2 CCCCCCN(C)CC(=O)N 2230a_106256046315_100000747473 [0,0,1,0,0,0|3,0,0]=4 1298 B11R0.2 CCCCCCN(C)CC(=O)N 269982a_106256046315_100000187820 [0,0,1,0,0,0|3,0,0]=4 1299 B11R0.2 CCCCCCN(C)CC(=O)O 269956a_100000746989_100000210757 [0,0,1,0,0,0|3,0,0]=4 1300 B11R0.2 CCCCCCN(C)CC(=O)[O-] 269982a_106256046315_100020667443 [0,0,1,0,0,0|3,0,0]=4 1301 B11R0.2 CCCCCOC(C)C=C(C)C 34a_100000717055_100000718602 [0,0,1,0,0,0|3,0,0]=4 1302 B11R0.2 CCCCCSC(C)OC(=O)C 62a_100000210326_100009818208 [0,0,1,0,0,0|1,0,0]=2 1303 B11R0.2 CCCCCSC(C)OC(=O)C 62a_100009818208_100000210326 [0,0,1,0,0,0|1,0,0]=2 1304 B11R0.2 CCCCOCC(C)OC(C)C 34a_100011217071_100000210206 [0,0,1,0,0,0|2,0,1]=4 1305 B11R0.2 CCCCOCC(C)OC(C)C 7a_100011217071_100000210206 [0,0,1,0,0,0|2,0,1]=4 1306 B11R0.2 CCOCCSC(C)OC(=O)C 62a_100000210147_100009818208 [0,0,1,0,0,0|2,0,0]=3 1307 B11R0.2 CCOCCSC(C)OC(=O)C 62a_100009818208_100011215890 [0,0,1,0,0,0|2,0,0]=3 1308 B11R0.2 CCSCCSC(C)OC(=O)C 62a_100000757381_100009818208 [0,0,1,0,0,0|2,0,0]=3 1309 B11R0.2 CCSCCSC(C)OC(=O)C 62a_100009818208_100000757381 [0,0,1,0,0,0|2,0,0]=3 1310 B11R0.2 COCCCSC(C)OC(=O)C 62a_100000709357_100009818208 [0,0,1,0,0,0|2,0,0]=3 1311 B11R0.2 COCCCSC(C)OC(=O)C 62a_100009818208_100000709357 [0,0,1,0,0,0|2,0,0]=3 1312 B11R0.40 C#CC(=O)CCCCCCCC 1458a_100000211873_100000210759 [0,0,1,0,0,0|1,0,2]=4 1313 B11R0.40 C#CCCCCCCC(=O)CC 1458a_100000034748_100000210202 [0,0,1,0,0,0|1,0,2]=4 1314 B11R0.40 C#CCCCCCCC(=O)CC 1458a_100000210414_100012276617 [0,0,1,0,0,0|1,0,2]=4 1315 B11R0.40 C#CCCOCCOC(=O)CC 7a_200000031056_100000688953 [0,0,1,0,0,0|1,0,2]=4 1316 B11R0.40 C/C=C/COCCOC(=O)CC 7a_200000031056_100102629194 [0,0,1,0,0,0|1,0,2]=4 1317 B11R0.40 C=CC(=O)CCCCCCCC 1458a_100000185746_100000210759 [0,0,1,0,0,0|1,0,2]=4 1318 B11R0.40 C=CC(=O)NCCCCCCC 1626a_100000229938_100000185746 [0,0,1,0,0,0|1,0,2]=4 1319 B11R0.40 C=CC(=O)NCCCCCCC 240690a_100000229938_200121576911 [0,0,1,0,0,0|1,0,2]=4 1320 B11R0.40 C=CC(=O)OCCCCCOC 7a_200011023508_200000210301 [0,0,1,0,0,0|1,0,2]=4 1321 B11R0.40 C=CC(=O)OCCCCCO[13CH3] 7a_200011023508_200025704644 [0,0,1,0,0,0|1,0,2]=4 1322 B11R0.40 C=CC(=O)OCCNCCCC 2230a_100000102301_100009813456 [0,0,1,0,0,0|1,0,2]=4 1323 B11R0.40 C=CC(=O)OCCNCCCC 7a_106832991798_100009813456 [0,0,1,0,0,0|1,0,2]=4 1324 B11R0.40 C=CC(=O)OCCOCCCC 34a_100000210227_100009813456 [0,0,1,0,0,0|1,0,2]=4 1325 B11R0.40 C=CC(=O)OCCOCCCC 7a_100000210227_100009813456 [0,0,1,0,0,0|1,0,2]=4 1326 B11R0.40 C=CC(=O)OCCSCCCC 62a_100000210211_100009813456 [0,0,1,0,0,0|1,0,2]=4 1327 B11R0.40 C=CC(=O)OCCSCCCC 62a_100009813456_100000210210 [0,0,1,0,0,0|1,0,2]=4 1328 B11R0.40 C=CCCCCCCC(=O)CC 1458a_100000210414_100011215473 [0,0,1,0,0,0|1,0,2]=4 1329 B11R0.40 C=CCCCCCCC(=O)CC 1458a_100011809334_100000210202 [0,0,1,0,0,0|1,0,2]=4 1330 B11R0.40 C=CCCOCCOC(=O)CC 7a_200000031056_100000754431 [0,0,1,0,0,0|1,0,2]=4 1331 B11R0.40 CC#CCOCCOC(=O)CC 7a_200000031056_100000748600 [0,0,1,0,0,0|1,0,2]=4 1332 B11R0.40 CC=CCOCCOC(=O)CC 7a_200000031056_100000070051 [0,0,1,0,0,0|1,0,2]=4 1333 B11R0.40 CCC(=O)CCCCCCC#N 1458a_100000210414_100009813337 [0,0,1,0,0,0|2,0,1]=4 1334 B11R0.40 CCC(=O)CCCCCCCO 1458a_100000210414_100000760002 [0,0,1,0,0,0|2,0,0]=3 1335 B11R0.40 CCC(=O)CCCCCCCO 1458a_100011219782_100000210202 [0,0,1,0,0,0|2,0,0]=3 1336 B11R0.40 CCC(=O)CCCCCCOC 1458a_100000210414_100011998445 [0,0,1,0,0,0|2,0,0]=3 1337 B11R0.40 CCC(=O)CCCOCCOC 1458a_100000210414_100011216529 [0,0,1,0,0,0|3,0,0]=4 1338 B11R0.40 CCC(=O)COCCCCCBr 7a_100000746331_100000747405 [0,0,1,0,0,0|3,0,0]=4 1339 B11R0.40 CCC(=O)COCCCCCCl 7a_100000746330_100000747405 [0,0,1,0,0,0|3,0,0]=4 1340 B11R0.40 CCC(=O)COCCCCCF 34a_100000725409_100000729378 [0,0,1,0,0,0|3,0,0]=4 1341 B11R0.40 CCC(=O)COCCCCCI 7a_200012148887_100000747405 [0,0,1,0,0,0|3,0,0]=4 1342 B11R0.40 CCC(=O)COCCCCCO 34a_100000725409_100000746330 [0,0,1,0,0,0|3,0,0]=4 1343 B11R0.40 CCC(=O)COCCCCOC 34a_100000725409_100000755781 [0,0,1,0,0,0|3,0,0]=4 1344 B11R0.40 CCC(=O)COCCCCSC 7a_100011217163_100000747405 [0,0,1,0,0,0|3,0,0]=4 1345 B11R0.40 CCC(=O)CSCCCCCF 62a_100000729378_100000747405 [0,0,1,0,0,0|3,0,0]=4 1346 B11R0.40 CCC(=O)CSCCCCCF 62a_100000747405_100000729378 [0,0,1,0,0,0|3,0,0]=4 1347 B11R0.40 CCC(=O)CSCCCCCO 62a_100000746330_100000747405 [0,0,1,0,0,0|3,0,0]=4 1348 B11R0.40 CCC(=O)CSCCCCCO 62a_100000747405_100000746330 [0,0,1,0,0,0|3,0,0]=4 1349 B11R0.40 CCC(=O)CSCCCCOC 62a_100000730899_100000747405 [0,0,1,0,0,0|3,0,0]=4 1350 B11R0.40 CCC(=O)CSCCCCOC 62a_100000747405_100000730899 [0,0,1,0,0,0|3,0,0]=4 1351 B11R0.40 CCC(=O)NCCCCCC#N 11a_100000061152_100000210414 [0,0,1,0,0,0|2,0,1]=4 1352 B11R0.40 CCC(=O)NCCCCCC#N 1626a_100000061152_100000210414 [0,0,1,0,0,0|2,0,1]=4 1353 B11R0.40 CCC(=O)NCCCCCC#N 240690a_100000061152_100000210414 [0,0,1,0,0,0|2,0,1]=4 1354 B11R0.40 CCC(=O)NCCCCCC#N 527a_100000061152_100000210414 [0,0,1,0,0,0|2,0,1]=4 1355 B11R0.40 CCC(=O)NCCCCCCO 240690a_100000686447_100000210414 [0,0,1,0,0,0|2,0,0]=3 1356 B11R0.40 CCC(=O)NCCCCCCO 527a_100000686447_100000210414 [0,0,1,0,0,0|2,0,0]=3 1357 B11R0.40 CCC(=O)NCCCCCOC 11a_100000747528_100000210414 [0,0,1,0,0,0|2,0,0]=3 1358 B11R0.40 CCC(=O)NCCCCCOC 1626a_100000747528_100000210414 [0,0,1,0,0,0|2,0,0]=3 1359 B11R0.40 CCC(=O)NCCCCCOC 240690a_100000747528_100000210414 [0,0,1,0,0,0|2,0,0]=3 1360 B11R0.40 CCC(=O)NCCCCCOC 527a_100000747528_100000210414 [0,0,1,0,0,0|2,0,0]=3 1361 B11R0.40 CCC(=O)NCCNCCCF 34a_100132302217_100011934791 [0,0,1,0,0,0|3,0,0]=4 1362 B11R0.40 CCC(=O)NCCNCCCO 34a_100132302217_100000230001 [0,0,1,0,0,0|3,0,0]=4 1363 B11R0.40 CCC(=O)NCCNCCOC 34a_100132302217_100011201679 [0,0,1,0,0,0|3,0,0]=4 1364 B11R0.40 CCC(=O)NCCNCCSC 34a_100132302217_100000212216 [0,0,1,0,0,0|3,0,0]=4 1365 B11R0.40 CCC(=O)NCCOCCCF 34a_200000158885_100011934791 [0,0,1,0,0,0|3,0,0]=4 1366 B11R0.40 CCC(=O)NCCOCCCF 7a_200000158885_100011934791 [0,0,1,0,0,0|3,0,0]=4 1367 B11R0.40 CCC(=O)NCCOCCCO 34a_200000158885_100000230001 [0,0,1,0,0,0|3,0,0]=4 1368 B11R0.40 CCC(=O)NCCOCCCO 7a_200000158885_100011215043 [0,0,1,0,0,0|3,0,0]=4 1369 B11R0.40 CCC(=O)NCCOCCOC 11a_100000745349_100000210414 [0,0,1,0,0,0|3,0,0]=4 1370 B11R0.40 CCC(=O)NCCOCCOC 1626a_100000745349_100000210414 [0,0,1,0,0,0|3,0,0]=4 1371 B11R0.40 CCC(=O)NCCOCCOC 240690a_100000745349_100000210414 [0,0,1,0,0,0|3,0,0]=4 1372 B11R0.40 CCC(=O)NCCOCCOC 34a_200000158885_100011201679 [0,0,1,0,0,0|3,0,0]=4 1373 B11R0.40 CCC(=O)NCCOCCOC 527a_100000745349_100000210414 [0,0,1,0,0,0|3,0,0]=4 1374 B11R0.40 CCC(=O)NCCOCCOC 7a_200000158885_100000233755 [0,0,1,0,0,0|3,0,0]=4 1375 B11R0.40 CCC(=O)NCCOCCSC 34a_200000158885_100000212216 [0,0,1,0,0,0|3,0,0]=4 1376 B11R0.40 CCC(=O)NCCOCCSC 7a_200000158885_100000212216 [0,0,1,0,0,0|3,0,0]=4 1377 B11R0.40 CCC(=O)OCCOCCC#N 7a_200000031056_100000184422 [0,0,1,0,0,0|2,0,1]=4 1378 B11R0.40 CCC(=O)OCCOCCCF 7a_200000031056_100011934791 [0,0,1,0,0,0|2,0,0]=3 1379 B11R0.40 CCC(=O)OCCOCCCO 7a_200000031056_100011215043 [0,0,1,0,0,0|2,0,0]=3 1380 B11R0.40 CCC(=O)OCCOCCOC 7a_200000031056_100000233755 [0,0,1,0,0,0|2,0,0]=3 1381 B11R0.40 CCC(=O)OCCOCCSC 7a_200000031056_100000212216 [0,0,1,0,0,0|2,0,0]=3 1382 B11R0.40 CCC(C)OCCCCCCBr 34a_100011215345_100011215416 [0,0,1,0,0,0|2,0,1]=4 1383 B11R0.40 CCC(C)OCCCCCCBr 7a_100011215345_100000758301 [0,0,1,0,0,0|2,0,1]=4 1384 B11R0.40 CCC(C)OCCCCCCCl 34a_100000766143_100011215416 [0,0,1,0,0,0|2,0,1]=4 1385 B11R0.40 CCC(C)OCCCCCCCl 7a_100000766143_100000758301 [0,0,1,0,0,0|2,0,1]=4 1386 B11R0.40 CCC(C)OCCCCCCF 34a_100000732779_100011215416 [0,0,1,0,0,0|2,0,1]=4 1387 B11R0.40 CCC(C)OCCCCCCF 7a_100000210228_100015922095 [0,0,1,0,0,0|2,0,1]=4 1388 B11R0.40 CCC(C)OCCCCCCF 7a_100000732779_100000758301 [0,0,1,0,0,0|2,0,1]=4 1389 B11R0.40 CCC(C)OCCCCCCN 34a_100000686447_100011215416 [0,0,1,0,0,0|2,0,1]=4 1390 B11R0.40 CCC(C)OCCCCCCO 7a_100000210228_100000766143 [0,0,1,0,0,0|2,0,1]=4 1391 B11R0.40 CCC(C)OCCCCCNC 34a_100000722520_100011215416 [0,0,1,0,0,0|2,0,1]=4 1392 B11R0.40 CCCCC/C=C/CC(=O)CC 1458a_100020675968_100000210202 [0,0,1,0,0,0|1,0,2]=4 1393 B11R0.40 CCCCCC#CCC(=O)CC 1458a_100000210414_100009816472 [0,0,1,0,0,0|1,0,2]=4 1394 B11R0.40 CCCCCC=NNC(=O)CC 4a_100000183195_100000737632 [0,0,1,0,0,0|2,0,1]=4 1395 B11R0.40 CCCCCCC=CC(=O)CC 1458a_200015324643_100000210202 [0,0,1,0,0,0|1,0,1]=3 1396 B11R0.40 CCCCCCC=CC(=O)CF 1458a_200015324643_100015361967 [0,0,1,0,0,0|2,0,1]=4 1397 B11R0.40 CCCCCCC=CC(=O)NC 11a_106832991635_200015324643 [0,0,1,0,0,0|2,0,1]=4 1398 B11R0.40 CCCCCCC=CC(=O)NC 1626a_100102657272_200015324643 [0,0,1,0,0,0|2,0,1]=4 1399 B11R0.40 CCCCCCC=CC(=O)NC 240690a_100102657272_200015324643 [0,0,1,0,0,0|2,0,1]=4 1400 B11R0.40 CCCCCCCCC(=O)CC 1458a_100000210188_100000210202 [0,0,1,0,0,0|1,0,0]=2 1401 B11R0.40 CCCCCCCCC(=O)CC 1458a_100000210414_100000210759 [0,0,1,0,0,0|1,0,0]=2 1402 B11R0.40 CCCCCCCCC(=O)CF 1458a_100000210188_100015361967 [0,0,1,0,0,0|2,0,0]=3 1403 B11R0.40 CCCCCCCCC(=O)CO 1458a_100000210174_100000210759 [0,0,1,0,0,0|2,0,0]=3 1404 B11R0.40 CCCCCCCCC(=O)NC 11a_106832991635_100000210188 [0,0,1,0,0,0|2,0,0]=3 1405 B11R0.40 CCCCCCCCC(=O)NC 1626a_100102657272_100000210188 [0,0,1,0,0,0|2,0,0]=3 1406 B11R0.40 CCCCCCCCC(=O)NC 240690a_100102657272_100000210188 [0,0,1,0,0,0|2,0,0]=3 1407 B11R0.40 CCCCCCCCC(=O)NC 527a_100102657272_100000210188 [0,0,1,0,0,0|2,0,0]=3 1408 B11R0.40 CCCCCCCCN(C)CC 2230a_100000207567_100000210202 [0,0,1,0,0,0|3,0,0]=4 1409 B11R0.40 CCCCCCCCN(C)CC 2230a_100000225621_100000210759 [0,0,1,0,0,0|3,0,0]=4 1410 B11R0.40 CCCCCCCCN(C)CC 269982a_100000207567_100000204670 [0,0,1,0,0,0|3,0,0]=4 1411 B11R0.40 CCCCCCCCN(C)CC 269982a_100000225621_100000210759 [0,0,1,0,0,0|3,0,0]=4 1412 B11R0.40 CCCCCCCNC(=O)CC 11a_100000229938_100000210414 [0,0,1,0,0,0|1,0,0]=2 1413 B11R0.40 CCCCCCCNC(=O)CC 1626a_100000229938_100000210414 [0,0,1,0,0,0|1,0,0]=2 1414 B11R0.40 CCCCCCCNC(=O)CC 240690a_100000229938_100000210414 [0,0,1,0,0,0|1,0,0]=2 1415 B11R0.40 CCCCCCCNC(=O)CC 527a_100000229938_100000210414 [0,0,1,0,0,0|1,0,0]=2 1416 B11R0.40 CCCCCCCNC(=O)CO 240690a_100000229938_100000210174 [0,0,1,0,0,0|2,0,0]=3 1417 B11R0.40 CCCCCCCNC(=O)CO 527a_100000229938_100000210174 [0,0,1,0,0,0|2,0,0]=3 1418 B11R0.40 CCCCCCCNC(=O)NC 2708a_100000229938_106832991635 [0,0,1,0,0,0|2,0,0]=3 1419 B11R0.40 CCCCCCCNC(=O)NC 2708a_100102657272_100000229938 [0,0,1,0,0,0|2,0,0]=3 1420 B11R0.40 CCCCCCCNC(=O)NC 273464a_100000229938_100102657272 [0,0,1,0,0,0|2,0,0]=3 1421 B11R0.40 CCCCCCCNC(=O)NC 273464a_100102657272_100000229938 [0,0,1,0,0,0|2,0,0]=3 1422 B11R0.40 CCCCCCCNC(=O)NC 512a_100000229938_100102657272 [0,0,1,0,0,0|2,0,0]=3 1423 B11R0.40 CCCCCCCNC(=O)NC 512a_106832991638_100000229938 [0,0,1,0,0,0|2,0,0]=3 1424 B11R0.40 CCCCCCCNC(C)CC 2230a_100000209981_100000210681 [0,0,1,0,0,0|2,0,1]=4 1425 B11R0.40 CCCCCCCNC(C)CC 2230a_100000229938_100000758301 [0,0,1,0,0,0|2,0,1]=4 1426 B11R0.40 CCCCCCCOC(C)CC 34a_100000210272_100011215416 [0,0,1,0,0,0|1,0,1]=3 1427 B11R0.40 CCCCCCCOC(C)CC 7a_100000210228_100000210614 [0,0,1,0,0,0|1,0,1]=3 1428 B11R0.40 CCCCCCCOC(C)CC 7a_100000210272_100000758301 [0,0,1,0,0,0|1,0,1]=3 1429 B11R0.40 CCCCCCCOC(C)CF 34a_100016041109_100000210614 [0,0,1,0,0,0|2,0,1]=4 1430 B11R0.40 CCCCCCCOC(C)CF 7a_100016041109_100000210614 [0,0,1,0,0,0|2,0,1]=4 1431 B11R0.40 CCCCCCCOC(C)CN 34a_100000210904_100000210614 [0,0,1,0,0,0|2,0,1]=4 1432 B11R0.40 CCCCCCCOC(C)CO 34a_100000210272_100012180447 [0,0,1,0,0,0|2,0,1]=4 1433 B11R0.40 CCCCCCCOC(C)CO 7a_100000210272_100012180447 [0,0,1,0,0,0|2,0,1]=4 1434 B11R0.40 CCCCCCCSC(C)CC 62a_100000210614_100000758301 [0,0,1,0,0,0|1,1,1]=4 1435 B11R0.40 CCCCCCCSC(C)CC 62a_100000758301_100000210316 [0,0,1,0,0,0|1,1,1]=4 1436 B11R0.40 CCCCCCNCC(=O)NC 2230a_100000210581_100000183359 [0,0,1,0,0,0|3,0,0]=4 1437 B11R0.40 CCCCCCNCC(=O)NC 2230a_100000693194_100000210314 [0,0,1,0,0,0|3,0,0]=4 1438 B11R0.40 CCCCCCNCC(=O)OC 2230a_100000210581_100000747449 [0,0,1,0,0,0|3,0,0]=4 1439 B11R0.40 CCCCCCOCC(=O)CC 34a_100000725409_100000210314 [0,0,1,0,0,0|2,0,0]=3 1440 B11R0.40 CCCCCCOCC(=O)CC 7a_100000210259_100000747405 [0,0,1,0,0,0|2,0,0]=3 1441 B11R0.40 CCCCCCOCC(=O)NC 34a_100000210259_100000183359 [0,0,1,0,0,0|3,0,0]=4 1442 B11R0.40 CCCCCCOCC(=O)NC 34a_100000750040_100000210314 [0,0,1,0,0,0|3,0,0]=4 1443 B11R0.40 CCCCCCOCC(=O)NC 7a_100000210259_100000183359 [0,0,1,0,0,0|3,0,0]=4 1444 B11R0.40 CCCCCCOCC(=O)OC 34a_100000210259_100000747449 [0,0,1,0,0,0|3,0,0]=4 1445 B11R0.40 CCCCCCOCC(=O)OC 7a_100000210259_100000747449 [0,0,1,0,0,0|3,0,0]=4 1446 B11R0.40 CCCCCCSCC(=O)CC 62a_100000210314_100000747405 [0,0,1,0,0,0|2,0,0]=3 1447 B11R0.40 CCCCCCSCC(=O)CC 62a_100000747405_100000210757 [0,0,1,0,0,0|2,0,0]=3 1448 B11R0.40 CCCCCCSCC(=O)NC 62a_100000183359_100000210757 [0,0,1,0,0,0|3,0,0]=4 1449 B11R0.40 CCCCCCSCC(=O)NC 62a_100000210314_100000183359 [0,0,1,0,0,0|3,0,0]=4 1450 B11R0.40 CCCCCCSCC(=O)OC 62a_100000210314_100000747449 [0,0,1,0,0,0|3,0,0]=4 1451 B11R0.40 CCCCCCSCC(=O)OC 62a_100000747449_100000210757 [0,0,1,0,0,0|3,0,0]=4 1452 B11R0.40 CCCCCNCCC(=O)NC 2230a_100000209983_100000737683 [0,0,1,0,0,0|3,0,0]=4 1453 B11R0.40 CCCCCNCCC(=O)NC 2230a_100000738227_100000210326 [0,0,1,0,0,0|3,0,0]=4 1454 B11R0.40 CCCCCNCCC(=O)NC 34a_100000738227_100000718602 [0,0,1,0,0,0|3,0,0]=4 1455 B11R0.40 CCCCCNCCC(=O)OC 2230a_100000209983_100000204255 [0,0,1,0,0,0|3,0,0]=4 1456 B11R0.40 CCCCCOCCC(=O)NC 34a_100000210253_100012179268 [0,0,1,0,0,0|3,0,0]=4 1457 B11R0.40 CCCCCOCCC(=O)NC 34a_100000754576_100000718602 [0,0,1,0,0,0|3,0,0]=4 1458 B11R0.40 CCCCCOCCC(=O)NC 7a_100000210253_100000737683 [0,0,1,0,0,0|3,0,0]=4 1459 B11R0.40 CCCCCOCCC(=O)OC 34a_100000210253_100000742370 [0,0,1,0,0,0|3,0,0]=4 1460 B11R0.40 CCCCCOCCC(=O)OC 7a_100000210253_100000204255 [0,0,1,0,0,0|3,0,0]=4 1461 B11R0.40 CCCCCSCCC(=O)NC 62a_100000210326_100000737683 [0,0,1,0,0,0|3,0,0]=4 1462 B11R0.40 CCCCCSCCC(=O)NC 62a_100000737683_100000210326 [0,0,1,0,0,0|3,0,0]=4 1463 B11R0.40 CCCCCSCCC(=O)OC 62a_100000204255_100000210326 [0,0,1,0,0,0|3,0,0]=4 1464 B11R0.40 CCCCCSCCC(=O)OC 62a_100000210326_100000204255 [0,0,1,0,0,0|3,0,0]=4 1465 B11R0.40 CCCCCSCOC(=O)OC 62a_100000210326_100000139417 [0,0,1,0,0,0|2,0,0]=3 1466 B11R0.40 CCCCNCCCC(=O)NC 2230a_100000102301_100000741757 [0,0,1,0,0,0|3,0,0]=4 1467 B11R0.40 CCCCNCCCC(=O)NC 2230a_100000740002_100000210211 [0,0,1,0,0,0|3,0,0]=4 1468 B11R0.40 CCCCNCCCC(=O)NC 34a_100000740002_100000210210 [0,0,1,0,0,0|3,0,0]=4 1469 B11R0.40 CCCCNCCCC(=O)NC 7a_106832991798_100000741757 [0,0,1,0,0,0|3,0,0]=4 1470 B11R0.40 CCCCNCCCC(=O)OC 2230a_100000102301_100011218270 [0,0,1,0,0,0|3,0,0]=4 1471 B11R0.40 CCCCNCCCC(=O)OC 7a_106832991798_100011218270 [0,0,1,0,0,0|3,0,0]=4 1472 B11R0.40 CCCCNCCNC(=O)CC 34a_100132302217_100000210210 [0,0,1,0,0,0|2,0,0]=3 1473 B11R0.40 CCCCNCCNC(=O)NC 34a_100015205895_100000210210 [0,0,1,0,0,0|3,0,0]=4 1474 B11R0.40 CCCCNCCOC(=O)NC 7a_106832991798_200011997002 [0,0,1,0,0,0|2,0,0]=3 1475 B11R0.40 CCCCOCCCC(=O)NC 34a_100000210227_100000741757 [0,0,1,0,0,0|3,0,0]=4 1476 B11R0.40 CCCCOCCCC(=O)NC 7a_100000210227_100000741757 [0,0,1,0,0,0|3,0,0]=4 1477 B11R0.40 CCCCOCCCC(=O)OC 34a_100000210227_100000742333 [0,0,1,0,0,0|3,0,0]=4 1478 B11R0.40 CCCCOCCCC(=O)OC 7a_100000210227_100011218270 [0,0,1,0,0,0|3,0,0]=4 1479 B11R0.40 CCCCOCCNC(=O)CC 34a_200000158885_100000210210 [0,0,1,0,0,0|2,0,0]=3 1480 B11R0.40 CCCCOCCNC(=O)CC 7a_200000158885_100000210211 [0,0,1,0,0,0|2,0,0]=3 1481 B11R0.40 CCCCOCCNC(=O)OC 34a_100000757965_100000210210 [0,0,1,0,0,0|3,0,0]=4 1482 B11R0.40 CCCCOCCOC(=O)CC 7a_200000031056_100000210211 [0,0,1,0,0,0|1,0,0]=2 1483 B11R0.40 CCCCOCCOC(=O)NC 34a_100000210227_200011997002 [0,0,1,0,0,0|2,0,0]=3 1484 B11R0.40 CCCCOCCOC(=O)NC 7a_100000210227_200011997002 [0,0,1,0,0,0|2,0,0]=3 1485 B11R0.40 CCCCOCCOC(=O)OC 34a_100010262106_100000210210 [0,0,1,0,0,0|2,0,0]=3 1486 B11R0.40 CCCCOCCOC(C)CC 34a_100000210238_100011215416 [0,0,1,0,0,0|2,0,1]=4 1487 B11R0.40 CCCCOCCOC(C)CC 7a_100000210228_100000743108 [0,0,1,0,0,0|2,0,1]=4 1488 B11R0.40 CCCCOCCOC(C)CC 7a_100000210238_100000758301 [0,0,1,0,0,0|2,0,1]=4 1489 B11R0.40 CCCCOCOCC(=O)CC 34a_100000725409_100011995733 [0,0,1,0,0,0|3,0,0]=4 1490 B11R0.40 CCCCOCSCC(=O)CC 62a_100000747405_100011995733 [0,0,1,0,0,0|3,0,0]=4 1491 B11R0.40 CCCCOCSCC(=O)CC 62a_100011995733_100000747405 [0,0,1,0,0,0|3,0,0]=4 1492 B11R0.40 CCCCSCCCC(=O)NC 62a_100000210211_100000741757 [0,0,1,0,0,0|3,0,0]=4 1493 B11R0.40 CCCCSCCCC(=O)NC 62a_100000741757_100000210210 [0,0,1,0,0,0|3,0,0]=4 1494 B11R0.40 CCCCSCCCC(=O)OC 62a_100000210211_100011218270 [0,0,1,0,0,0|3,0,0]=4 1495 B11R0.40 CCCCSCCCC(=O)OC 62a_100011218270_100000210210 [0,0,1,0,0,0|3,0,0]=4 1496 B11R0.40 CCCCSCCNC(=O)CC 11a_100025743550_100000210414 [0,0,1,0,0,0|2,0,0]=3 1497 B11R0.40 CCCCSCCNC(=O)CC 1626a_100025743550_100000210414 [0,0,1,0,0,0|2,0,0]=3 1498 B11R0.40 CCCCSCCNC(=O)CC 240690a_100025743550_100000210414 [0,0,1,0,0,0|2,0,0]=3 1499 B11R0.40 CCCCSCCNC(=O)CC 527a_100025743550_100000210414 [0,0,1,0,0,0|2,0,0]=3 1500 B11R0.40 CCCCSCCNC(=O)CO 240690a_100025743550_100000210174 [0,0,1,0,0,0|3,0,0]=4 1501 B11R0.40 CCCCSCCNC(=O)CO 527a_100025743550_100000210174 [0,0,1,0,0,0|3,0,0]=4 1502 B11R0.40 CCCCSCCNC(=O)NC 2708a_100025743550_106832991635 [0,0,1,0,0,0|3,0,0]=4 1503 B11R0.40 CCCCSCCNC(=O)NC 2708a_100102657272_100025743550 [0,0,1,0,0,0|3,0,0]=4 1504 B11R0.40 CCCCSCCNC(=O)NC 273464a_100025743550_100102657272 [0,0,1,0,0,0|3,0,0]=4 1505 B11R0.40 CCCCSCCNC(=O)NC 273464a_100102657272_100025743550 [0,0,1,0,0,0|3,0,0]=4 1506 B11R0.40 CCCCSCCNC(=O)NC 512a_100025743550_100102657272 [0,0,1,0,0,0|3,0,0]=4 1507 B11R0.40 CCCCSCCNC(=O)NC 512a_106832991638_100025743550 [0,0,1,0,0,0|3,0,0]=4 1508 B11R0.40 CCCCSCCOC(=O)NC 62a_100000210211_200011997002 [0,0,1,0,0,0|2,0,0]=3 1509 B11R0.40 CCCCSCCOC(=O)NC 62a_200011997002_100000210210 [0,0,1,0,0,0|2,0,0]=3 1510 B11R0.40 CCCCSCCOC(C)CC 34a_200000230436_100011215416 [0,0,1,0,0,0|2,0,1]=4 1511 B11R0.40 CCCCSCCOC(C)CC 7a_200000230436_100000758301 [0,0,1,0,0,0|2,0,1]=4 1512 B11R0.40 CCCOCCCCC(=O)OC 34a_100000059025_100000210303 [0,0,1,0,0,0|3,0,0]=4 1513 B11R0.40 CCCOCCCCC(=O)OC 34a_100000210258_100000204269 [0,0,1,0,0,0|3,0,0]=4 1514 B11R0.40 CCCOCCCCC(=O)OC 7a_100000059025_100000210303 [0,0,1,0,0,0|3,0,0]=4 1515 B11R0.40 CCCOCCCNC(=O)CC 1626a_100011217757_100000210414 [0,0,1,0,0,0|2,0,0]=3 1516 B11R0.40 CCCOCCCNC(=O)CC 240690a_100011217757_100000210414 [0,0,1,0,0,0|2,0,0]=3 1517 B11R0.40 CCCOCCCNC(=O)CC 527a_100011217757_100000210414 [0,0,1,0,0,0|2,0,0]=3 1518 B11R0.40 CCCOCCCNC(=O)CO 240690a_100011217757_100000210174 [0,0,1,0,0,0|3,0,0]=4 1519 B11R0.40 CCCOCCCNC(=O)CO 527a_100011217757_100000210174 [0,0,1,0,0,0|3,0,0]=4 1520 B11R0.40 CCCOCCCNC(=O)NC 2708a_100011217757_106832991635 [0,0,1,0,0,0|3,0,0]=4 1521 B11R0.40 CCCOCCCNC(=O)NC 2708a_100102657272_100011217757 [0,0,1,0,0,0|3,0,0]=4 1522 B11R0.40 CCCOCCCNC(=O)NC 273464a_100011217757_100102657272 [0,0,1,0,0,0|3,0,0]=4 1523 B11R0.40 CCCOCCCNC(=O)NC 273464a_100102657272_100011217757 [0,0,1,0,0,0|3,0,0]=4 1524 B11R0.40 CCCOCCCNC(=O)NC 512a_100011217757_100102657272 [0,0,1,0,0,0|3,0,0]=4 1525 B11R0.40 CCCOCCCNC(=O)NC 512a_106832991638_100011217757 [0,0,1,0,0,0|3,0,0]=4 1526 B11R0.40 CCCOCCOCC(=O)CC 34a_100000725409_100011215938 [0,0,1,0,0,0|3,0,0]=4 1527 B11R0.40 CCCOCCOCC(=O)CC 7a_100000752267_100000747405 [0,0,1,0,0,0|3,0,0]=4 1528 B11R0.40 CCCOCCSCC(=O)CC 62a_100000747405_100011215938 [0,0,1,0,0,0|3,0,0]=4 1529 B11R0.40 CCCOCCSCC(=O)CC 62a_100011215938_100000747405 [0,0,1,0,0,0|3,0,0]=4 1530 B11R0.40 CCCSCCCCC(=O)OC 62a_100000204269_100000210303 [0,0,1,0,0,0|3,0,0]=4 1531 B11R0.40 CCCSCCCCC(=O)OC 62a_100000210303_100000204269 [0,0,1,0,0,0|3,0,0]=4 1532 B11R0.40 CCCSCCOCC(=O)CC 7a_200000230433_100000747405 [0,0,1,0,0,0|3,0,0]=4 1533 B11R0.40 CCNCCCCCC(=O)OC 2230a_100015525214_100009816466 [0,0,1,0,0,0|3,0,0]=4 1534 B11R0.40 CCOCCCCCC(=O)OC 34a_100000074720_100000210202 [0,0,1,0,0,0|3,0,0]=4 1535 B11R0.40 CCOCCCCCC(=O)OC 34a_100121572206_100009816466 [0,0,1,0,0,0|3,0,0]=4 1536 B11R0.40 CCOCCCCCC(=O)OC 7a_100000074720_100000210202 [0,0,1,0,0,0|3,0,0]=4 1537 B11R0.40 CCOCCCOCC(=O)CC 34a_100000725409_100012232248 [0,0,1,0,0,0|3,0,0]=4 1538 B11R0.40 CCOCCCOCC(=O)CC 7a_100000757476_100000747405 [0,0,1,0,0,0|3,0,0]=4 1539 B11R0.40 CCOCCCSCC(=O)CC 62a_100000747405_100012232248 [0,0,1,0,0,0|3,0,0]=4 1540 B11R0.40 CCOCCCSCC(=O)CC 62a_100012232248_100000747405 [0,0,1,0,0,0|3,0,0]=4 1541 B11R0.40 CCOCCOCCC(=O)CC 1458a_100000210414_100011211534 [0,0,1,0,0,0|3,0,0]=4 1542 B11R0.40 CCOCCSCOC(=O)OC 62a_100000210147_100000139417 [0,0,1,0,0,0|3,0,0]=4 1543 B11R0.40 CCOCSCCOC(=O)NC 62a_100000739092_200011997002 [0,0,1,0,0,0|3,0,0]=4 1544 B11R0.40 CCOCSCCOC(=O)NC 62a_200011997002_100000739092 [0,0,1,0,0,0|3,0,0]=4 1545 B11R0.40 CCSCCCCCC(=O)OC 62a_100000210202_100009816466 [0,0,1,0,0,0|3,0,0]=4 1546 B11R0.40 CCSCCCCCC(=O)OC 62a_100009816466_100000210202 [0,0,1,0,0,0|3,0,0]=4 1547 B11R0.40 CCSCCCOCC(=O)CC 7a_100011216438_100000747405 [0,0,1,0,0,0|3,0,0]=4 1548 B11R0.40 CCSCCSCOC(=O)OC 62a_100000757381_100000139417 [0,0,1,0,0,0|3,0,0]=4 1549 B11R0.40 CNC(=O)CCCCCCCO 240690a_100102657272_100011219782 [0,0,1,0,0,0|3,0,0]=4 1550 B11R0.40 CNC(=O)NCCCCCCO 2708a_100102657272_100000686447 [0,0,1,0,0,0|3,0,0]=4 1551 B11R0.40 CNC(=O)NCCCCCCO 273464a_100000686447_100102657272 [0,0,1,0,0,0|3,0,0]=4 1552 B11R0.40 CNC(=O)NCCCCCCO 273464a_100102657272_100000686447 [0,0,1,0,0,0|3,0,0]=4 1553 B11R0.40 CNC(=O)NCCCCCCO 512a_100000686447_100102657272 [0,0,1,0,0,0|3,0,0]=4 1554 B11R0.40 CNC(=O)NCCCCCCO 512a_106832991638_100000686447 [0,0,1,0,0,0|3,0,0]=4 1555 B11R0.40 CNC(=O)NCCCCCOC 2708a_100000747528_106832991635 [0,0,1,0,0,0|3,0,0]=4 1556 B11R0.40 CNC(=O)NCCCCCOC 2708a_100102657272_100000747528 [0,0,1,0,0,0|3,0,0]=4 1557 B11R0.40 CNC(=O)NCCCCCOC 273464a_100000747528_100102657272 [0,0,1,0,0,0|3,0,0]=4 1558 B11R0.40 CNC(=O)NCCCCCOC 273464a_100102657272_100000747528 [0,0,1,0,0,0|3,0,0]=4 1559 B11R0.40 CNC(=O)NCCCCCOC 512a_100000747528_100102657272 [0,0,1,0,0,0|3,0,0]=4 1560 B11R0.40 CNC(=O)NCCCCCOC 512a_106832991638_100000747528 [0,0,1,0,0,0|3,0,0]=4 1561 B11R0.40 CNC(=O)OCCNCCCF 34a_100015189416_200011997002 [0,0,1,0,0,0|3,0,0]=4 1562 B11R0.40 CNC(=O)OCCOCCCBr 34a_100011217188_200011997002 [0,0,1,0,0,0|3,0,0]=4 1563 B11R0.40 CNC(=O)OCCOCCCCl 34a_100000230001_200011997002 [0,0,1,0,0,0|3,0,0]=4 1564 B11R0.40 CNC(=O)OCCOCCCF 34a_100000759539_200011997002 [0,0,1,0,0,0|3,0,0]=4 1565 B11R0.40 CNC(=O)OCCOCCCN 34a_100000182051_200011997002 [0,0,1,0,0,0|3,0,0]=4 1566 B11R0.40 CNC(=O)OCCOCCOC 34a_100000210237_200011997002 [0,0,1,0,0,0|3,0,0]=4 1567 B11R0.40 CNC(=O)OCCOCCSC 34a_100000230434_200011997002 [0,0,1,0,0,0|3,0,0]=4 1568 B11R0.40 CNC(=O)OCCOCCSC 7a_100000230434_200011997002 [0,0,1,0,0,0|3,0,0]=4 1569 B11R0.40 CNC(=O)OCCSCCCF 62a_100011934791_200011997002 [0,0,1,0,0,0|3,0,0]=4 1570 B11R0.40 CNC(=O)OCCSCCCF 62a_200011997002_100011934791 [0,0,1,0,0,0|3,0,0]=4 1571 B11R0.40 CNC(=O)OCCSCCCO 62a_100011215043_200011997002 [0,0,1,0,0,0|3,0,0]=4 1572 B11R0.40 CNC(=O)OCCSCCCO 62a_200011997002_100011215043 [0,0,1,0,0,0|3,0,0]=4 1573 B11R0.40 CNC(=O)OCCSCCOC 62a_100000233755_200011997002 [0,0,1,0,0,0|3,0,0]=4 1574 B11R0.40 CNC(=O)OCCSCCOC 62a_200011997002_100000233755 [0,0,1,0,0,0|3,0,0]=4 1575 B11R0.40 CNC(=O)OCCSCCSC 62a_100000212216_200011997002 [0,0,1,0,0,0|3,0,0]=4 1576 B11R0.40 CNC(=O)OCCSCCSC 62a_200011997002_100000751147 [0,0,1,0,0,0|3,0,0]=4 1577 B11R0.40 CNCCCCCCC(=O)OC 2230a_106832991635_100009815986 [0,0,1,0,0,0|3,0,0]=4 1578 B11R0.40 CNCCCCCCC(=O)OC 34a_100102657272_100009815986 [0,0,1,0,0,0|3,0,0]=4 1579 B11R0.40 CNCCCCCCC(=O)OC 7a_106832991635_100009815986 [0,0,1,0,0,0|3,0,0]=4 1580 B11R0.40 COC(=O)CCCCCCO[13CH3] 34a_100009863599_200025704644 [0,0,1,0,0,0|3,0,0]=4 1581 B11R0.40 COC(=O)CCCCCCO[13CH3] 7a_100009863599_200025704644 [0,0,1,0,0,0|3,0,0]=4 1582 B11R0.40 COC(=O)CCCCCCSC 62a_100009815986_200000210301 [0,0,1,0,0,0|3,0,0]=4 1583 B11R0.40 COC(=O)CCCCCCSC 62a_200000210301_100009815986 [0,0,1,0,0,0|3,0,0]=4 1584 B11R0.40 COC(=O)CCCCCCS[13CH3] 62a_100009815986_200025704644 [0,0,1,0,0,0|3,0,0]=4 1585 B11R0.40 COC(=O)CCCCCCS[13CH3] 62a_200025704644_100009815986 [0,0,1,0,0,0|3,0,0]=4 1586 B11R0.40 COC(=O)OCCOCCCF 34a_100010262106_100011934791 [0,0,1,0,0,0|3,0,0]=4 1587 B11R0.40 COC(=O)OCCOCCCO 34a_100010262106_100000230001 [0,0,1,0,0,0|3,0,0]=4 1588 B11R0.40 COC(=O)OCCOCCSC 34a_100010262106_100000212216 [0,0,1,0,0,0|3,0,0]=4 1589 B11R0.40 COC(=O)OCSCCCCF 62a_100000729493_100000139417 [0,0,1,0,0,0|3,0,0]=4 1590 B11R0.40 COC(=O)OCSCCCCO 62a_100000210776_100000139417 [0,0,1,0,0,0|3,0,0]=4 1591 B11R0.40 COCCCCCCC(=O)CO 1458a_100000210174_100011998445 [0,0,1,0,0,0|3,0,0]=4 1592 B11R0.40 COCCCCCCC(=O)OC 34a_100009863599_200000210301 [0,0,1,0,0,0|3,0,0]=4 1593 B11R0.40 COCCCCCCC(=O)OC 34a_100138415774_100009815986 [0,0,1,0,0,0|3,0,0]=4 1594 B11R0.40 COCCCCCCC(=O)OC 7a_100009863599_200000210301 [0,0,1,0,0,0|3,0,0]=4 1595 B11R0.40 COCCCCCNC(=O)CO 240690a_100000747528_100000210174 [0,0,1,0,0,0|3,0,0]=4 1596 B11R0.40 COCCCCCNC(=O)CO 527a_100000747528_100000210174 [0,0,1,0,0,0|3,0,0]=4 1597 B11R0.40 COCCCSCOC(=O)OC 62a_100000709357_100000139417 [0,0,1,0,0,0|3,0,0]=4 1598 B11R0.40 COCCOCCOC(=O)OC 34a_100010262106_100011201679 [0,0,1,0,0,0|3,0,0]=4 1599 B11R0.40 O=C(CF)CCCCCCCO 1458a_100011219782_100015361967 [0,0,1,0,0,0|3,0,0]=4 1600 B11R0.40 O=C(CO)CCCCCCCO 1458a_100000210174_100000760002 [0,0,1,0,0,0|3,0,0]=4 1601 B11R0.40 O=C(CO)NCCCCCCO 240690a_100000686447_100000210174 [0,0,1,0,0,0|3,0,0]=4 1602 B11R0.40 O=C(CO)NCCCCCCO 527a_100000686447_100000210174 [0,0,1,0,0,0|3,0,0]=4 1603 B11R0.81 C=CCCC(=O)CCCCCC 1458a_100000749702_100000210757 [0,0,1,0,0,0|1,0,2]=4 1604 B11R0.81 C=CCCC(=O)CCCCCC 1458a_100102632555_100000754431 [0,0,1,0,0,0|1,0,2]=4 1605 B11R0.81 C=CCCC(C)NCCCCC 270004a_100000209983_100000762624 [0,0,1,0,0,0|3,0,0]=4 1606 B11R0.81 C=CCCC(C)OCCCCC 34a_100000765329_100000718602 [0,0,1,0,0,0|3,0,0]=4 1607 B11R0.81 C=CCCC(C)OCCCCC 7a_100000765329_100000210326 [0,0,1,0,0,0|3,0,0]=4 1608 B11R0.81 C=CCCN(C)CCCCCC 2230a_100020639649_100000210314 [0,0,1,0,0,0|3,0,0]=4 1609 B11R0.81 C=CCCN(C)CCCCCC 2230a_106256046315_100000754431 [0,0,1,0,0,0|3,0,0]=4 1610 B11R0.81 C=CCCN(C)CCCCCC 269982a_100020639649_100000210757 [0,0,1,0,0,0|3,0,0]=4 1611 B11R0.81 C=CCCN(C)CCCCCC 269982a_106256046315_100000754431 [0,0,1,0,0,0|3,0,0]=4 1612 B11R0.81 C=CCNC(C)CCCCCC 2230a_100000210919_100000210623 [0,0,1,0,0,0|3,0,0]=4 1613 B11R0.81 C=CCNC(C)CCCCCC 2230a_100020586998_100011215978 [0,0,1,0,0,0|3,0,0]=4 1614 B11R0.81 C=CCNC(C)CCCCCC 270004a_100020586998_100000210826 [0,0,1,0,0,0|3,0,0]=4 1615 B11R0.81 C=CCNC(C)CCCCCC 34a_100000210919_100015514636 [0,0,1,0,0,0|3,0,0]=4 1616 B11R0.81 C=CCOC(C)CCCCCC 34a_100000210265_100015514636 [0,0,1,0,0,0|3,0,0]=4 1617 B11R0.81 C=CCOC(C)CCCCCC 34a_200000210373_100011215978 [0,0,1,0,0,0|3,0,0]=4 1618 B11R0.81 C=CCOC(C)CCCCCC 7a_100000210265_100015514636 [0,0,1,0,0,0|3,0,0]=4 1619 B11R0.81 C=CCSC(C)CCCCCC 62a_100000210623_100011215978 [0,0,1,0,0,0|3,0,0]=4 1620 B11R0.81 C=CCSC(C)CCCCCC 62a_100011215978_100000210623 [0,0,1,0,0,0|3,0,0]=4 1621 B11R0.81 CCCCCCC(C)CCOC 34a_200011024964_200000210301 [0,0,1,0,0,0|3,0,0]=4 1622 B11R0.81 CCCCCCC(C)CCOC 7a_200011024964_200000210301 [0,0,1,0,0,0|3,0,0]=4 1623 B11R0.81 CCCCCCC(C)CCO[13CH3] 34a_200011024964_200025704644 [0,0,1,0,0,0|3,0,0]=4 1624 B11R0.81 CCCCCCC(C)CCO[13CH3] 7a_200011024964_200025704644 [0,0,1,0,0,0|3,0,0]=4 1625 B11R0.81 CCCCCCC(C)NCC=O 2230a_100000210919_200015260668 [0,0,1,0,0,0|2,0,0]=3 1626 B11R0.81 CCCCCCC(C)NCC=O 34a_100000210919_200009817547 [0,0,1,0,0,0|2,0,0]=3 1627 B11R0.81 CCCCCCC(C)OCC=O 34a_100000210265_200009817547 [0,0,1,0,0,0|2,0,0]=3 1628 B11R0.81 CCCCCCC(C)OCC=O 7a_100000210265_200015260668 [0,0,1,0,0,0|2,0,0]=3 1629 B11R0.81 CCCCCCC(C)SCC=O 62a_100011215978_200015260668 [0,0,1,0,0,0|2,0,0]=3 1630 B11R0.81 CCCCCCC(C)SCC=O 62a_200015260668_100011215978 [0,0,1,0,0,0|2,0,0]=3 1631 B11R0.81 CCCCOCC(C)OCC=O 34a_100011217071_200009817547 [0,0,1,0,0,0|3,0,0]=4 1632 B11R0.81 CCCCOCC(C)OCC=O 7a_100011217071_200015260668 [0,0,1,0,0,0|3,0,0]=4 1633 B11R0.148 C#CCCCCCCCC(=O)C 1458a_100000070787_100153394163 [0,0,1,0,0,0|1,0,2]=4 1634 B11R0.148 C#CCCCCCCCC(=O)C 1458a_100000087357_200000210301 [0,0,1,0,0,0|1,0,2]=4 1635 B11R0.148 C#CCCCCCCCC(=O)[13CH3] 1458a_100000087357_200025704644 [0,0,1,0,0,0|1,0,2]=4 1636 B11R0.148 C#CCCCCCNCC(=O)O 269956a_100016091260_100012094781 [0,0,1,0,0,0|1,0,2]=4 1637 B11R0.148 C=C(Br)CCOCCCCCC 34a_100009813270_100000210314 [0,0,1,0,0,0|3,0,0]=4 1638 B11R0.148 C=C(C)CCNCCCCCC 2230a_100000210581_100000730704 [0,0,1,0,0,0|3,0,0]=4 1639 B11R0.148 C=C(C)CCOCCCCCC 34a_100000210259_100000730704 [0,0,1,0,0,0|3,0,0]=4 1640 B11R0.148 C=C(C)CCOCCCCCC 34a_100000764851_100000210314 [0,0,1,0,0,0|3,0,0]=4 1641 B11R0.148 C=C(C)CCOCCCCCC 7a_100000210259_100000730704 [0,0,1,0,0,0|3,0,0]=4 1642 B11R0.148 C=C(C)CCSCCCCCC 62a_100000210314_100000730704 [0,0,1,0,0,0|3,0,0]=4 1643 B11R0.148 C=C(C)CCSCCCCCC 62a_100000730704_100000210757 [0,0,1,0,0,0|3,0,0]=4 1644 B11R0.148 C=C(C)CNCCCCCCC 2230a_100000229938_100000748629 [0,0,1,0,0,0|3,0,0]=4 1645 B11R0.148 C=C(C)COCCCCCCC 34a_100000210245_100000210614 [0,0,1,0,0,0|3,0,0]=4 1646 B11R0.148 C=C(C)COCCCCCCC 34a_100000210272_100000748629 [0,0,1,0,0,0|3,0,0]=4 1647 B11R0.148 C=C(C)COCCCCCCC 7a_100000210272_100000748629 [0,0,1,0,0,0|3,0,0]=4 1648 B11R0.148 C=C(C)CSCCCCCCC 62a_100000210614_100000211660 [0,0,1,0,0,0|3,0,0]=4 1649 B11R0.148 C=C(C)CSCCCCCCC 62a_100000748629_100000210316 [0,0,1,0,0,0|3,0,0]=4 1650 B11R0.148 C=C(F)CNCCCCCCC 2230a_100000229938_100009893438 [0,0,1,0,0,0|3,0,0]=4 1651 B11R0.148 C=C(F)COCCCCCCC 34a_100000210272_100009893438 [0,0,1,0,0,0|3,0,0]=4 1652 B11R0.148 C=C(F)COCCCCCCC 34a_200010262243_100000210614 [0,0,1,0,0,0|3,0,0]=4 1653 B11R0.148 C=C(F)COCCCCCCC 7a_100000210272_100000042424 [0,0,1,0,0,0|3,0,0]=4 1654 B11R0.148 C=C(F)CSCCCCCCC 62a_100000042424_100000210316 [0,0,1,0,0,0|3,0,0]=4 1655 B11R0.148 C=C(F)CSCCCCCCC 62a_100000210614_100000042424 [0,0,1,0,0,0|3,0,0]=4 1656 B11R0.148 C=CCCCCCCCC(=O)C 1458a_100000070787_100012355270 [0,0,1,0,0,0|1,0,2]=4 1657 B11R0.148 C=CCCCCCCCC(=O)C 1458a_100011216160_200000210301 [0,0,1,0,0,0|1,0,2]=4 1658 B11R0.148 C=CCCCCCCCC(=O)[13CH3] 1458a_100011216160_200025704644 [0,0,1,0,0,0|1,0,2]=4 1659 B11R0.148 C=CCCCCCNCC(=O)O 269956a_100016091260_100000700193 [0,0,1,0,0,0|1,0,2]=4 1660 B11R0.148 CC(=O)CCCCCCCCO 1458a_100000070787_100000033203 [0,0,1,0,0,0|2,0,0]=3 1661 B11R0.148 CC(=O)CCCCNCCCF 34a_100015189416_100009817362 [0,0,1,0,0,0|3,0,0]=4 1662 B11R0.148 CC(=O)CCCCOCCCBr 34a_100011217188_100009817362 [0,0,1,0,0,0|3,0,0]=4 1663 B11R0.148 CC(=O)CCCCOCCCCl 34a_100000230001_100009817362 [0,0,1,0,0,0|3,0,0]=4 1664 B11R0.148 CC(=O)CCCCOCCCF 34a_100000759539_100009817362 [0,0,1,0,0,0|3,0,0]=4 1665 B11R0.148 CC(=O)CCCCOCCCN 34a_100000182051_100009817362 [0,0,1,0,0,0|3,0,0]=4 1666 B11R0.148 CC(=O)CCCCSCCCF 62a_100000735457_100011934791 [0,0,1,0,0,0|3,0,0]=4 1667 B11R0.148 CC(=O)CCCCSCCCF 62a_100011934791_100000735457 [0,0,1,0,0,0|3,0,0]=4 1668 B11R0.148 CC(=O)CCCCSCCCO 62a_100000735457_100011215043 [0,0,1,0,0,0|3,0,0]=4 1669 B11R0.148 CC(=O)CCCCSCCCO 62a_100011215043_100000735457 [0,0,1,0,0,0|3,0,0]=4 1670 B11R0.148 CC(=O)CCCNCCCCO 34a_100000750430_100000685027 [0,0,1,0,0,0|3,0,0]=4 1671 B11R0.148 CC(=O)CCCOCCCCBr 34a_100011216708_100000685027 [0,0,1,0,0,0|3,0,0]=4 1672 B11R0.148 CC(=O)CCCOCCCCCl 34a_100000210776_100000685027 [0,0,1,0,0,0|3,0,0]=4 1673 B11R0.148 CC(=O)CCCOCCCCCl 7a_100000210776_100011215641 [0,0,1,0,0,0|3,0,0]=4 1674 B11R0.148 CC(=O)CCCOCCCCF 34a_100000759063_100000729493 [0,0,1,0,0,0|3,0,0]=4 1675 B11R0.148 CC(=O)CCCOCCCCF 34a_100011995726_100000685027 [0,0,1,0,0,0|3,0,0]=4 1676 B11R0.148 CC(=O)CCCOCCCCF 7a_100000759063_100000729493 [0,0,1,0,0,0|3,0,0]=4 1677 B11R0.148 CC(=O)CCCOCCCCF 7a_100011995726_100011215641 [0,0,1,0,0,0|3,0,0]=4 1678 B11R0.148 CC(=O)CCCOCCCCI 34a_200012148704_100000685027 [0,0,1,0,0,0|3,0,0]=4 1679 B11R0.148 CC(=O)CCCOCCCCN 34a_100000750430_100000685027 [0,0,1,0,0,0|3,0,0]=4 1680 B11R0.148 CC(=O)CCCOCCCCO 34a_100000759063_100011216708 [0,0,1,0,0,0|3,0,0]=4 1681 B11R0.148 CC(=O)CCCOCCCCO 7a_100000759063_100000210776 [0,0,1,0,0,0|3,0,0]=4 1682 B11R0.148 CC(=O)CCCSCCCCF 62a_100000729493_100011215641 [0,0,1,0,0,0|3,0,0]=4 1683 B11R0.148 CC(=O)CCCSCCCCF 62a_100011215641_100000729493 [0,0,1,0,0,0|3,0,0]=4 1684 B11R0.148 CC(=O)CCCSCCCCO 62a_100000210776_100011215641 [0,0,1,0,0,0|3,0,0]=4 1685 B11R0.148 CC(=O)CCCSCCCCO 62a_100011215641_100000210776 [0,0,1,0,0,0|3,0,0]=4 1686 B11R0.148 CC(=O)CCOCCCCCBr 7a_100000746331_100000053229 [0,0,1,0,0,0|3,0,0]=4 1687 B11R0.148 CC(=O)CCOCCCCCCl 7a_100000746330_100000053229 [0,0,1,0,0,0|3,0,0]=4 1688 B11R0.148 CC(=O)CCOCCCCCF 34a_100000759926_100000729378 [0,0,1,0,0,0|3,0,0]=4 1689 B11R0.148 CC(=O)CCOCCCCCF 7a_100000759926_100000729378 [0,0,1,0,0,0|3,0,0]=4 1690 B11R0.148 CC(=O)CCOCCCCCI 7a_200012148887_100000053229 [0,0,1,0,0,0|3,0,0]=4 1691 B11R0.148 CC(=O)CCOCCCCCO 34a_100000759926_100000746330 [0,0,1,0,0,0|3,0,0]=4 1692 B11R0.148 CC(=O)CCOCCCCCO 7a_100000759926_100000746330 [0,0,1,0,0,0|3,0,0]=4 1693 B11R0.148 CC(=O)CCSCCCCCF 62a_100000053229_100000729378 [0,0,1,0,0,0|3,0,0]=4 1694 B11R0.148 CC(=O)CCSCCCCCF 62a_100000729378_100000053229 [0,0,1,0,0,0|3,0,0]=4 1695 B11R0.148 CC(=O)CCSCCCCCO 62a_100000053229_100000746330 [0,0,1,0,0,0|3,0,0]=4 1696 B11R0.148 CC(=O)CCSCCCCCO 62a_100000746330_100000053229 [0,0,1,0,0,0|3,0,0]=4 1697 B11R0.148 CC(=O)COCCCCCCF 34a_100000211253_100015922095 [0,0,1,0,0,0|3,0,0]=4 1698 B11R0.148 CC(=O)COCCCCCCO 34a_100000211253_100000766143 [0,0,1,0,0,0|3,0,0]=4 1699 B11R0.148 CC(=O)NCCCCCCCO 240690a_100011996573_100015343762 [0,0,1,0,0,0|3,0,0]=4 1700 B11R0.148 CC(=O)NCCCCCCN[13CH3] 2230a_200011996284_200025704644 [0,0,1,0,0,0|3,0,0]=4 1701 B11R0.148 CC(=O)NCCCCCCN[13CH3] 34a_200011996284_200025704644 [0,0,1,0,0,0|3,0,0]=4 1702 B11R0.148 CCCCC#CCCCC(=O)C 1458a_100000070787_200000047210 [0,0,1,0,0,0|1,0,2]=4 1703 B11R0.148 CCCCC/C=C/CCC(=O)C 1458a_200015255902_200000210301 [0,0,1,0,0,0|1,0,2]=4 1704 B11R0.148 CCCCC/C=C/CCC(=O)[13CH3] 1458a_200015255902_200025704644 [0,0,1,0,0,0|1,0,2]=4 1705 B11R0.148 CCCCCC/C=C/CC(=O)C 1458a_100020681715_200000210301 [0,0,1,0,0,0|1,0,2]=4 1706 B11R0.148 CCCCCC/C=C/CC(=O)[13CH3] 1458a_100020681715_200025704644 [0,0,1,0,0,0|1,0,2]=4 1707 B11R0.148 CCCCCCCC=CC(=O)C 1458a_200015332781_200000210301 [0,0,1,0,0,0|1,0,2]=4 1708 B11R0.148 CCCCCCCC=CC(=O)[13CH3] 1458a_200015332781_200025704644 [0,0,1,0,0,0|1,0,2]=4 1709 B11R0.148 CCCCCCCCCC(=O)C 1458a_100000070787_100000210670 [0,0,1,0,0,0|1,0,0]=2 1710 B11R0.148 CCCCCCCCCC(=O)C 1458a_100000210558_200000210301 [0,0,1,0,0,0|1,0,0]=2 1711 B11R0.148 CCCCCCCCCC(=O)[13CH3] 1458a_100000210558_200025704644 [0,0,1,0,0,0|1,0,0]=2 1712 B11R0.148 CCCCCCCCCN(C)C 2230a_100000232482_200000210301 [0,0,1,0,0,0|3,0,0]=4 1713 B11R0.148 CCCCCCCCCN(C)C 2230a_100102631434_100011214924 [0,0,1,0,0,0|3,0,0]=4 1714 B11R0.148 CCCCCCCCCN(C)C 269982a_100000232482_200000210301 [0,0,1,0,0,0|3,0,0]=4 1715 B11R0.148 CCCCCCCCCN(C)C 269982a_100102631434_100000210670 [0,0,1,0,0,0|3,0,0]=4 1716 B11R0.148 CCCCCCCCCN(C)[13CH3] 2230a_100000232482_200025704644 [0,0,1,0,0,0|3,0,0]=4 1717 B11R0.148 CCCCCCCCCN(C)[13CH3] 269982a_100000232482_200025704644 [0,0,1,0,0,0|3,0,0]=4 1718 B11R0.148 CCCCCCCCNC(=O)C 11a_100000229939_100015343762 [0,0,1,0,0,0|2,0,0]=3 1719 B11R0.148 CCCCCCCCNC(=O)C 1626a_100000229939_100015343762 [0,0,1,0,0,0|2,0,0]=3 1720 B11R0.148 CCCCCCCCNC(=O)C 240690a_100000229939_100015343762 [0,0,1,0,0,0|2,0,0]=3 1721 B11R0.148 CCCCCCCCNC(=O)C 527a_100000229939_100103153847 [0,0,1,0,0,0|2,0,0]=3 1722 B11R0.148 CCCCCCCNCC(=O)N 2230a_100000229938_100000747473 [0,0,1,0,0,0|2,0,0]=3 1723 B11R0.148 CCCCCCCNCC(=O)N 2230a_100000711301_100000210681 [0,0,1,0,0,0|2,0,0]=3 1724 B11R0.148 CCCCCCCNCC(=O)O 269956a_100016091260_100000210614 [0,0,1,0,0,0|1,0,0]=2 1725 B11R0.148 CCCCCCCNCC(C)O 2230a_100000210904_100000210681 [0,0,1,0,0,0|2,0,1]=4 1726 B11R0.148 CCCCCCCNCC(C)O 2230a_100000229938_100011218427 [0,0,1,0,0,0|2,0,1]=4 1727 B11R0.148 CCCCCCCNCC(C)O 34a_100000210904_100000210614 [0,0,1,0,0,0|2,0,1]=4 1728 B11R0.148 CCCCCCCNC[C@@H](C)O 2230a_100000229938_100009817552 [0,0,1,0,0,0|2,0,1]=4 1729 B11R0.148 CCCCCCCOCC(=O)C 34a_100000211253_100000210614 [0,0,1,0,0,0|2,0,0]=3 1730 B11R0.148 CCCCCCCOCC(=O)N 34a_100000210272_100000187820 [0,0,1,0,0,0|2,0,0]=3 1731 B11R0.148 CCCCCCCOCC(=O)N 7a_100000210272_100000187820 [0,0,1,0,0,0|2,0,0]=3 1732 B11R0.148 CCCCCCCOCC(=O)[O-] 34a_100000210272_100020667443 [0,0,1,0,0,0|1,0,1]=3 1733 B11R0.148 CCCCCCCOCC(C)O 34a_100000210272_100011218427 [0,0,1,0,0,0|2,0,1]=4 1734 B11R0.148 CCCCCCCOCC(C)O 7a_100000210272_100011218427 [0,0,1,0,0,0|2,0,1]=4 1735 B11R0.148 CCCCCCCOC[C@@H](C)O 34a_100000210272_100009817552 [0,0,1,0,0,0|2,0,1]=4 1736 B11R0.148 CCCCCCCOC[C@@H](C)O 7a_100000210272_100009817552 [0,0,1,0,0,0|2,0,1]=4 1737 B11R0.148 CCCCCCCOC[N+](=O)[O-] 34a_100000210272_100000761209 [0,0,1,0,0,0|2,0,1]=4 1738 B11R0.148 CCCCCCCSCC(=O)N 62a_100000210614_100000747473 [0,0,1,0,0,0|2,0,0]=3 1739 B11R0.148 CCCCCCCSCC(=O)N 62a_100000747473_100000210316 [0,0,1,0,0,0|2,0,0]=3 1740 B11R0.148 CCCCCCCSCC(=O)[O-] 62a_100000210614_100020667443 [0,0,1,0,0,0|1,0,1]=3 1741 B11R0.148 CCCCCCCSCC(=O)[O-] 62a_100020667443_100000210316 [0,0,1,0,0,0|1,0,1]=3 1742 B11R0.148 CCCCCCCSCC(C)O 62a_100000210614_100011218427 [0,0,1,0,0,0|2,0,1]=4 1743 B11R0.148 CCCCCCCSCC(C)O 62a_100011218427_100000210316 [0,0,1,0,0,0|2,0,1]=4 1744 B11R0.148 CCCCCCCSC[C@@H](C)O 62a_100000210614_100009817552 [0,0,1,0,0,0|2,0,1]=4 1745 B11R0.148 CCCCCCCSC[C@@H](C)O 62a_100009817552_100000210316 [0,0,1,0,0,0|2,0,1]=4 1746 B11R0.148 CCCCCCCSC[N+](=O)[O-] 62a_100000210614_100000761209 [0,0,1,0,0,0|2,0,1]=4 1747 B11R0.148 CCCCCCNCCC(=O)N 2230a_100000210581_100000744528 [0,0,1,0,0,0|2,0,0]=3 1748 B11R0.148 CCCCCCNCCC(C)O 2230a_100000210581_100012276601 [0,0,1,0,0,0|2,0,1]=4 1749 B11R0.148 CCCCCCNCCC(C)O 2230a_200000755665_100000210314 [0,0,1,0,0,0|2,0,1]=4 1750 B11R0.148 CCCCCCNOCC(=O)O 269956a_100000106656_100000210757 [0,0,1,0,0,0|2,0,0]=3 1751 B11R0.148 CCCCCCOCCC(=O)C 34a_100000759926_100000210314 [0,0,1,0,0,0|2,0,0]=3 1752 B11R0.148 CCCCCCOCCC(=O)C 7a_100000210259_100000053229 [0,0,1,0,0,0|2,0,0]=3 1753 B11R0.148 CCCCCCOCCC(=O)C 7a_100000759926_100000210314 [0,0,1,0,0,0|2,0,0]=3 1754 B11R0.148 CCCCCCOCCC(=O)N 34a_100000210259_100000731001 [0,0,1,0,0,0|2,0,0]=3 1755 B11R0.148 CCCCCCOCCC(=O)N 34a_100000757172_100000210314 [0,0,1,0,0,0|2,0,0]=3 1756 B11R0.148 CCCCCCOCCC(=O)N 7a_100000210259_100000744528 [0,0,1,0,0,0|2,0,0]=3 1757 B11R0.148 CCCCCCOCCC(=O)N 7a_100000757172_100000210314 [0,0,1,0,0,0|2,0,0]=3 1758 B11R0.148 CCCCCCOCCC(C)O 34a_100000210259_100012276601 [0,0,1,0,0,0|2,0,1]=4 1759 B11R0.148 CCCCCCOCCC(C)O 7a_100000210259_100012276601 [0,0,1,0,0,0|2,0,1]=4 1760 B11R0.148 CCCCCCOCOC(=O)C 34a_100000210259_100009813279 [0,0,1,0,0,0|3,0,0]=4 1761 B11R0.148 CCCCCCSCCC(=O)C 62a_100000053229_100000210757 [0,0,1,0,0,0|2,0,0]=3 1762 B11R0.148 CCCCCCSCCC(=O)C 62a_100000210314_100000053229 [0,0,1,0,0,0|2,0,0]=3 1763 B11R0.148 CCCCCCSCCC(=O)N 62a_100000210314_100000744528 [0,0,1,0,0,0|2,0,0]=3 1764 B11R0.148 CCCCCCSCCC(=O)N 62a_100000744528_100000210757 [0,0,1,0,0,0|2,0,0]=3 1765 B11R0.148 CCCCCCSCCC(C)O 62a_100000210314_100012276601 [0,0,1,0,0,0|2,0,1]=4 1766 B11R0.148 CCCCCCSCCC(C)O 62a_100012276601_100000210757 [0,0,1,0,0,0|2,0,1]=4 1767 B11R0.148 CCCCCCSCOC(=O)C 62a_100000076356_100000210757 [0,0,1,0,0,0|3,0,0]=4 1768 B11R0.148 CCCCCCSCOC(=O)C 62a_100000210314_100000076356 [0,0,1,0,0,0|3,0,0]=4 1769 B11R0.148 CCCCCNCCCC(=O)N 34a_100000739312_100000718602 [0,0,1,0,0,0|2,0,0]=3 1770 B11R0.148 CCCCCNCCCC(C)O 2230a_100000209983_200000718107 [0,0,1,0,0,0|2,0,1]=4 1771 B11R0.148 CCCCCNCCCS(=O)C 2230a_200000753449_100000210326 [0,0,1,0,0,0|3,0,0]=4 1772 B11R0.148 CCCCCNCCNC(=O)C 2230a_100000209853_100000210326 [0,0,1,0,0,0|3,0,0]=4 1773 B11R0.148 CCCCCNCCNC(=O)C 2230a_100000209983_100000189650 [0,0,1,0,0,0|3,0,0]=4 1774 B11R0.148 CCCCCNCCNC(=O)N 2230a_100000209983_200000034859 [0,0,1,0,0,0|3,0,0]=4 1775 B11R0.148 CCCCCNCCNC(=O)N 34a_100020590234_100000718602 [0,0,1,0,0,0|3,0,0]=4 1776 B11R0.148 CCCCCOCCCC(=O)C 34a_100000210253_100000685027 [0,0,1,0,0,0|2,0,0]=3 1777 B11R0.148 CCCCCOCCCC(=O)C 34a_100000759063_100000718602 [0,0,1,0,0,0|2,0,0]=3 1778 B11R0.148 CCCCCOCCCC(=O)C 7a_100000210253_100011215641 [0,0,1,0,0,0|2,0,0]=3 1779 B11R0.148 CCCCCOCCCC(=O)C 7a_100000759063_100000210326 [0,0,1,0,0,0|2,0,0]=3 1780 B11R0.148 CCCCCOCCCC(=O)N 34a_100000210253_100102525003 [0,0,1,0,0,0|2,0,0]=3 1781 B11R0.148 CCCCCOCCCC(=O)N 7a_100000210253_100102525003 [0,0,1,0,0,0|2,0,0]=3 1782 B11R0.148 CCCCCOCCCC(C)O 34a_100000210253_200000718107 [0,0,1,0,0,0|2,0,1]=4 1783 B11R0.148 CCCCCOCCCC(C)O 7a_100000210253_200000718107 [0,0,1,0,0,0|2,0,1]=4 1784 B11R0.148 CCCCCOCCC[N+](=O)[O-] 34a_200000037920_100000718602 [0,0,1,0,0,0|2,0,1]=4 1785 B11R0.148 CCCCCOCCNC(=O)C 34a_100000158858_100000718602 [0,0,1,0,0,0|3,0,0]=4 1786 B11R0.148 CCCCCOCCNC(=O)C 7a_100000210253_100000189650 [0,0,1,0,0,0|3,0,0]=4 1787 B11R0.148 CCCCCOCCNC(=O)N 34a_100000181757_100000718602 [0,0,1,0,0,0|3,0,0]=4 1788 B11R0.148 CCCCCOCCNC(=O)N 7a_100000210253_200000034859 [0,0,1,0,0,0|3,0,0]=4 1789 B11R0.148 CCCCCOCCOC(=O)C 34a_100000210253_100009814007 [0,0,1,0,0,0|3,0,0]=4 1790 B11R0.148 CCCCCOCCOC(=O)C 7a_100000210253_100009814007 [0,0,1,0,0,0|3,0,0]=4 1791 B11R0.148 CCCCCOCCOC(=O)N 34a_100000210253_200011214921 [0,0,1,0,0,0|3,0,0]=4 1792 B11R0.148 CCCCCOCCOC(=O)N 7a_100000210253_200011214921 [0,0,1,0,0,0|3,0,0]=4 1793 B11R0.148 CCCCCOCCOC(=O)N 7a_100000766696_100000210326 [0,0,1,0,0,0|3,0,0]=4 1794 B11R0.148 CCCCCSCCCC(=O)C 62a_100000210326_100011215641 [0,0,1,0,0,0|2,0,0]=3 1795 B11R0.148 CCCCCSCCCC(=O)C 62a_100011215641_100000210326 [0,0,1,0,0,0|2,0,0]=3 1796 B11R0.148 CCCCCSCCCC(=O)N 62a_100000210326_100102525003 [0,0,1,0,0,0|2,0,0]=3 1797 B11R0.148 CCCCCSCCCC(=O)N 62a_100102525003_100000210326 [0,0,1,0,0,0|2,0,0]=3 1798 B11R0.148 CCCCCSCCCC(C)O 62a_100000210326_200000718107 [0,0,1,0,0,0|2,0,1]=4 1799 B11R0.148 CCCCCSCCCC(C)O 62a_200000718107_100000210326 [0,0,1,0,0,0|2,0,1]=4 1800 B11R0.148 CCCCCSCCNC(=O)C 62a_100000189650_100000210326 [0,0,1,0,0,0|3,0,0]=4 1801 B11R0.148 CCCCCSCCNC(=O)C 62a_100000210326_100000189650 [0,0,1,0,0,0|3,0,0]=4 1802 B11R0.148 CCCCCSCCNC(=O)N 62a_100000210326_200000034859 [0,0,1,0,0,0|3,0,0]=4 1803 B11R0.148 CCCCCSCCNC(=O)N 62a_200000034859_100000210326 [0,0,1,0,0,0|3,0,0]=4 1804 B11R0.148 CCCCCSCCOC(=O)C 62a_100000210326_100009814007 [0,0,1,0,0,0|3,0,0]=4 1805 B11R0.148 CCCCCSCCOC(=O)C 62a_100009814007_100000210326 [0,0,1,0,0,0|3,0,0]=4 1806 B11R0.148 CCCCCSCCOC(=O)N 62a_100000210326_200011214921 [0,0,1,0,0,0|3,0,0]=4 1807 B11R0.148 CCCCCSCCOC(=O)N 62a_200011214921_100000210326 [0,0,1,0,0,0|3,0,0]=4 1808 B11R0.148 CCCCNCCCCB(O)O 2230a_100000102301_200009817182 [0,0,1,0,0,0|2,0,1]=4 1809 B11R0.148 CCCCNCCCCB(O)O 7a_106832991798_200009817182 [0,0,1,0,0,0|2,0,1]=4 1810 B11R0.148 CCCCNCCCCC(=O)C 7a_106832991798_100000735457 [0,0,1,0,0,0|2,0,0]=3 1811 B11R0.148 CCCCNCCCCC(=O)N 34a_100000696515_100000210210 [0,0,1,0,0,0|2,0,0]=3 1812 B11R0.148 CCCCNCCCNC(=O)C 34a_100000736810_100000210210 [0,0,1,0,0,0|3,0,0]=4 1813 B11R0.148 CCCCNCCCOC(=O)C 7a_106832991798_100000042594 [0,0,1,0,0,0|3,0,0]=4 1814 B11R0.148 CCCCNCCCSC(=O)C 2230a_100000102301_100000038929 [0,0,1,0,0,0|3,0,0]=4 1815 B11R0.148 CCCCNCCCSC(=O)C 7a_106832991798_100000038929 [0,0,1,0,0,0|3,0,0]=4 1816 B11R0.148 CCCCNCCOCC(=O)N 2230a_100000102301_100000076697 [0,0,1,0,0,0|3,0,0]=4 1817 B11R0.148 CCCCNCCOCC(=O)N 7a_106832991798_100000076697 [0,0,1,0,0,0|3,0,0]=4 1818 B11R0.148 CCCCNCCOCC(=O)O 269956a_100000700818_100000210211 [0,0,1,0,0,0|2,0,0]=3 1819 B11R0.148 CCCCOCCCCB(O)O 34a_100000210227_200009817182 [0,0,1,0,0,0|2,0,1]=4 1820 B11R0.148 CCCCOCCCCB(O)O 7a_100000210227_200009817182 [0,0,1,0,0,0|2,0,1]=4 1821 B11R0.148 CCCCOCCCCC(=O)C 34a_100000210227_100009817362 [0,0,1,0,0,0|2,0,0]=3 1822 B11R0.148 CCCCOCCCCC(=O)C 7a_100000210227_100000735457 [0,0,1,0,0,0|2,0,0]=3 1823 B11R0.148 CCCCOCCCCC(=O)N 34a_100012022536_100000210210 [0,0,1,0,0,0|2,0,0]=3 1824 B11R0.148 CCCCOCCCCC(=O)N 7a_100012022536_100000210211 [0,0,1,0,0,0|2,0,0]=3 1825 B11R0.148 CCCCOCCCC[N+](=O)[O-] 34a_200015379883_100000210210 [0,0,1,0,0,0|2,0,1]=4 1826 B11R0.148 CCCCOCCCC[N+](=O)[O-] 7a_200015379883_100000210211 [0,0,1,0,0,0|2,0,1]=4 1827 B11R0.148 CCCCOCCCNC(=O)C 1626a_200000211371_100015343762 [0,0,1,0,0,0|3,0,0]=4 1828 B11R0.148 CCCCOCCCNC(=O)C 240690a_200000211371_100015343762 [0,0,1,0,0,0|3,0,0]=4 1829 B11R0.148 CCCCOCCCNC(=O)C 34a_100000752032_100000210210 [0,0,1,0,0,0|3,0,0]=4 1830 B11R0.148 CCCCOCCCNC(=O)C 527a_200000211371_100103153847 [0,0,1,0,0,0|3,0,0]=4 1831 B11R0.148 CCCCOCCCOC(=O)C 34a_100000210227_100000042594 [0,0,1,0,0,0|3,0,0]=4 1832 B11R0.148 CCCCOCCCOC(=O)C 7a_100000210227_100000042594 [0,0,1,0,0,0|3,0,0]=4 1833 B11R0.148 CCCCOCCCSC(=O)C 34a_100000210227_100000038929 [0,0,1,0,0,0|3,0,0]=4 1834 B11R0.148 CCCCOCCCSC(=O)C 7a_100000210227_100000038929 [0,0,1,0,0,0|3,0,0]=4 1835 B11R0.148 CCCCOCCNCC(=O)N 2230a_100000711301_100000743108 [0,0,1,0,0,0|3,0,0]=4 1836 B11R0.148 CCCCOCCNCC(=O)O 269956a_100016091260_100000743108 [0,0,1,0,0,0|2,0,0]=3 1837 B11R0.148 CCCCOCCOCC(=O)C 1458a_100011216887_200000210301 [0,0,1,0,0,0|3,0,0]=4 1838 B11R0.148 CCCCOCCOCC(=O)C 34a_100000211253_100000743108 [0,0,1,0,0,0|3,0,0]=4 1839 B11R0.148 CCCCOCCOCC(=O)N 34a_100000210227_100000076697 [0,0,1,0,0,0|3,0,0]=4 1840 B11R0.148 CCCCOCCOCC(=O)N 34a_100000210238_100000187820 [0,0,1,0,0,0|3,0,0]=4 1841 B11R0.148 CCCCOCCOCC(=O)N 7a_100000210227_100000076697 [0,0,1,0,0,0|3,0,0]=4 1842 B11R0.148 CCCCOCCOCC(=O)N 7a_100000210238_100000187820 [0,0,1,0,0,0|3,0,0]=4 1843 B11R0.148 CCCCOCCOCC(=O)[13CH3] 1458a_100011216887_200025704644 [0,0,1,0,0,0|3,0,0]=4 1844 B11R0.148 CCCCOCCOCC(=O)[O-] 34a_100000210238_100020667443 [0,0,1,0,0,0|2,0,1]=4 1845 B11R0.148 CCCCOCCSCC(=O)N 62a_100000743108_100000747473 [0,0,1,0,0,0|3,0,0]=4 1846 B11R0.148 CCCCOCCSCC(=O)N 62a_100000747473_100000743108 [0,0,1,0,0,0|3,0,0]=4 1847 B11R0.148 CCCCOCCSCC(=O)[O-] 62a_100000743108_100020667443 [0,0,1,0,0,0|2,0,1]=4 1848 B11R0.148 CCCCOCCSCC(=O)[O-] 62a_100020667443_100000743108 [0,0,1,0,0,0|2,0,1]=4 1849 B11R0.148 CCCCOCNOCC(=O)O 269956a_100000106656_100011995733 [0,0,1,0,0,0|3,0,0]=4 1850 B11R0.148 CCCCOCOCCC(=O)C 34a_100000759926_100011995733 [0,0,1,0,0,0|3,0,0]=4 1851 B11R0.148 CCCCOCOCCC(=O)N 34a_100000757172_100011995733 [0,0,1,0,0,0|3,0,0]=4 1852 B11R0.148 CCCCOCSCCC(=O)C 62a_100000053229_100011995733 [0,0,1,0,0,0|3,0,0]=4 1853 B11R0.148 CCCCOCSCCC(=O)C 62a_100011995733_100000053229 [0,0,1,0,0,0|3,0,0]=4 1854 B11R0.148 CCCCOCSCCC(=O)N 62a_100000744528_100011995733 [0,0,1,0,0,0|3,0,0]=4 1855 B11R0.148 CCCCOCSCCC(=O)N 62a_100011995733_100000744528 [0,0,1,0,0,0|3,0,0]=4 1856 B11R0.148 CCCCSCCCCB(O)O 62a_100000210211_200009817182 [0,0,1,0,0,0|2,0,1]=4 1857 B11R0.148 CCCCSCCCCB(O)O 62a_200009817182_100000210210 [0,0,1,0,0,0|2,0,1]=4 1858 B11R0.148 CCCCSCCCCC(=O)C 62a_100000210211_100000735457 [0,0,1,0,0,0|2,0,0]=3 1859 B11R0.148 CCCCSCCCCC(=O)C 62a_100000735457_100000210210 [0,0,1,0,0,0|2,0,0]=3 1860 B11R0.148 CCCCSCCCOC(=O)C 62a_100000042594_100000210210 [0,0,1,0,0,0|3,0,0]=4 1861 B11R0.148 CCCCSCCCOC(=O)C 62a_100000210211_100000042594 [0,0,1,0,0,0|3,0,0]=4 1862 B11R0.148 CCCCSCCCSC(=O)C 62a_100000038929_100000210210 [0,0,1,0,0,0|3,0,0]=4 1863 B11R0.148 CCCCSCCCSC(=O)C 62a_100000210211_100000038929 [0,0,1,0,0,0|3,0,0]=4 1864 B11R0.148 CCCCSCCNCC(=O)N 2230a_100025743550_100000747473 [0,0,1,0,0,0|3,0,0]=4 1865 B11R0.148 CCCCSCCOCC(=O)N 34a_200000230436_100000187820 [0,0,1,0,0,0|3,0,0]=4 1866 B11R0.148 CCCCSCCOCC(=O)N 62a_100000076697_100000210210 [0,0,1,0,0,0|3,0,0]=4 1867 B11R0.148 CCCCSCCOCC(=O)N 62a_100000210211_100000076697 [0,0,1,0,0,0|3,0,0]=4 1868 B11R0.148 CCCCSCCOCC(=O)N 7a_200000230436_100000187820 [0,0,1,0,0,0|3,0,0]=4 1869 B11R0.148 CCCCSCCOCC(=O)[O-] 34a_200000230436_100020667443 [0,0,1,0,0,0|2,0,1]=4 1870 B11R0.148 CCCNCCCCNC(=O)C 2230a_200011368371_100000210303 [0,0,1,0,0,0|3,0,0]=4 1871 B11R0.148 CCCNCCCCNC(=O)C 34a_200011368371_100000210303 [0,0,1,0,0,0|3,0,0]=4 1872 B11R0.148 CCCOCCCCCB(O)O 34a_100000210258_200009817188 [0,0,1,0,0,0|2,0,1]=4 1873 B11R0.148 CCCOCCCCCC(=O)N 34a_100000123541_100000210303 [0,0,1,0,0,0|2,0,0]=3 1874 B11R0.148 CCCOCCCCCC(=O)N 34a_100000210258_100009817443 [0,0,1,0,0,0|2,0,0]=3 1875 B11R0.148 CCCOCCCCCC(=O)N 7a_100000123541_100000210303 [0,0,1,0,0,0|2,0,0]=3 1876 B11R0.148 CCCOCCCCCC(=O)[O-] 7a_100102619762_100000210303 [0,0,1,0,0,0|1,0,1]=3 1877 B11R0.148 CCCOCCCCOC(=O)C 34a_100000073216_100000210303 [0,0,1,0,0,0|3,0,0]=4 1878 B11R0.148 CCCOCCCCOC(=O)C 34a_100000210258_100000033659 [0,0,1,0,0,0|3,0,0]=4 1879 B11R0.148 CCCOCCCCOC(=O)C 7a_100000073216_100000210303 [0,0,1,0,0,0|3,0,0]=4 1880 B11R0.148 CCCOCCCCSC(=O)C 34a_100000210258_200010402107 [0,0,1,0,0,0|3,0,0]=4 1881 B11R0.148 CCCOCCCNCC(=O)N 2230a_100011217757_100000747473 [0,0,1,0,0,0|3,0,0]=4 1882 B11R0.148 CCCOCCCNCC(=O)N 34a_100011217757_100000187820 [0,0,1,0,0,0|3,0,0]=4 1883 B11R0.148 CCCOCCCNCC(=O)[O-] 34a_100011217757_100020667443 [0,0,1,0,0,0|2,0,1]=4 1884 B11R0.148 CCCOCCNCCC(=O)N 2230a_100161115042_100000744528 [0,0,1,0,0,0|3,0,0]=4 1885 B11R0.148 CCCOCCNCCC(=O)N 34a_100161115042_100000731001 [0,0,1,0,0,0|3,0,0]=4 1886 B11R0.148 CCCOCCNOCC(=O)O 269956a_100000106656_100011215938 [0,0,1,0,0,0|3,0,0]=4 1887 B11R0.148 CCCOCCOCCC(=O)C 34a_100000759926_100011215938 [0,0,1,0,0,0|3,0,0]=4 1888 B11R0.148 CCCOCCOCCC(=O)C 7a_100000752267_100000053229 [0,0,1,0,0,0|3,0,0]=4 1889 B11R0.148 CCCOCCOCCC(=O)C 7a_100000759926_100011215938 [0,0,1,0,0,0|3,0,0]=4 1890 B11R0.148 CCCOCCOCCC(=O)N 34a_100000752267_100000731001 [0,0,1,0,0,0|3,0,0]=4 1891 B11R0.148 CCCOCCOCCC(=O)N 34a_100000757172_100011215938 [0,0,1,0,0,0|3,0,0]=4 1892 B11R0.148 CCCOCCOCCC(=O)N 7a_100000752267_100000744528 [0,0,1,0,0,0|3,0,0]=4 1893 B11R0.148 CCCOCCOCCC(=O)N 7a_100000757172_100011215938 [0,0,1,0,0,0|3,0,0]=4 1894 B11R0.148 CCCOCCSCCC(=O)C 62a_100000053229_100011215938 [0,0,1,0,0,0|3,0,0]=4 1895 B11R0.148 CCCOCCSCCC(=O)C 62a_100011215938_100000053229 [0,0,1,0,0,0|3,0,0]=4 1896 B11R0.148 CCCOCCSCCC(=O)N 62a_100000744528_100011215938 [0,0,1,0,0,0|3,0,0]=4 1897 B11R0.148 CCCOCCSCCC(=O)N 62a_100011215938_100000744528 [0,0,1,0,0,0|3,0,0]=4 1898 B11R0.148 CCCSCCCCCB(O)O 62a_100000210303_200009817188 [0,0,1,0,0,0|2,0,1]=4 1899 B11R0.148 CCCSCCCCCB(O)O 62a_200009817188_100000210303 [0,0,1,0,0,0|2,0,1]=4 1900 B11R0.148 CCCSCCCCCC(=O)N 62a_100000210303_100009817443 [0,0,1,0,0,0|2,0,0]=3 1901 B11R0.148 CCCSCCCCCC(=O)N 62a_100009817443_100000210303 [0,0,1,0,0,0|2,0,0]=3 1902 B11R0.148 CCCSCCCCOC(=O)C 62a_100000033659_100000210303 [0,0,1,0,0,0|3,0,0]=4 1903 B11R0.148 CCCSCCCCOC(=O)C 62a_100000210303_100000033659 [0,0,1,0,0,0|3,0,0]=4 1904 B11R0.148 CCCSCCCCSC(=O)C 62a_100000210303_200010402107 [0,0,1,0,0,0|3,0,0]=4 1905 B11R0.148 CCCSCCCCSC(=O)C 62a_200010402107_100000210303 [0,0,1,0,0,0|3,0,0]=4 1906 B11R0.148 CCCSCCNCCC(=O)N 2230a_100020603323_100000744528 [0,0,1,0,0,0|3,0,0]=4 1907 B11R0.148 CCCSCCOCCC(=O)C 7a_200000230433_100000053229 [0,0,1,0,0,0|3,0,0]=4 1908 B11R0.148 CCCSCCOCCC(=O)N 34a_200000230433_100000731001 [0,0,1,0,0,0|3,0,0]=4 1909 B11R0.148 CCCSCCOCCC(=O)N 7a_200000230433_100000744528 [0,0,1,0,0,0|3,0,0]=4 1910 B11R0.148 CCNCCCCCCB(O)O 2230a_100015525214_100009817187 [0,0,1,0,0,0|2,0,1]=4 1911 B11R0.148 CCNCCCCCNC(=O)C 2230a_200012022750_100000210202 [0,0,1,0,0,0|3,0,0]=4 1912 B11R0.148 CCNCCCCCNC(=O)C 34a_200012022750_100000210202 [0,0,1,0,0,0|3,0,0]=4 1913 B11R0.148 CCNCCCCCOC(=O)C 2230a_100015525214_100009813381 [0,0,1,0,0,0|3,0,0]=4 1914 B11R0.148 CCOCCCCCCB(O)O 34a_100121572206_100009817187 [0,0,1,0,0,0|2,0,1]=4 1915 B11R0.148 CCOCCCCCOC(=O)C 34a_100121572206_100000033007 [0,0,1,0,0,0|3,0,0]=4 1916 B11R0.148 CCOCCCNCCC(=O)N 2230a_100000210961_100000744528 [0,0,1,0,0,0|3,0,0]=4 1917 B11R0.148 CCOCCCNCCC(=O)N 34a_100000210961_100000731001 [0,0,1,0,0,0|3,0,0]=4 1918 B11R0.148 CCOCCCNOCC(=O)O 269956a_100000106656_100012232248 [0,0,1,0,0,0|3,0,0]=4 1919 B11R0.148 CCOCCCOCCC(=O)C 34a_100000759926_100012232248 [0,0,1,0,0,0|3,0,0]=4 1920 B11R0.148 CCOCCCOCCC(=O)C 7a_100000757476_100000053229 [0,0,1,0,0,0|3,0,0]=4 1921 B11R0.148 CCOCCCOCCC(=O)C 7a_100000759926_100012232248 [0,0,1,0,0,0|3,0,0]=4 1922 B11R0.148 CCOCCCOCCC(=O)N 34a_100000757172_100012232248 [0,0,1,0,0,0|3,0,0]=4 1923 B11R0.148 CCOCCCOCCC(=O)N 34a_100000757476_100000731001 [0,0,1,0,0,0|3,0,0]=4 1924 B11R0.148 CCOCCCOCCC(=O)N 7a_100000757172_100012232248 [0,0,1,0,0,0|3,0,0]=4 1925 B11R0.148 CCOCCCOCCC(=O)N 7a_100000757476_100000744528 [0,0,1,0,0,0|3,0,0]=4 1926 B11R0.148 CCOCCCSCCC(=O)C 62a_100000053229_100012232248 [0,0,1,0,0,0|3,0,0]=4 1927 B11R0.148 CCOCCCSCCC(=O)C 62a_100012232248_100000053229 [0,0,1,0,0,0|3,0,0]=4 1928 B11R0.148 CCOCCCSCCC(=O)N 62a_100000744528_100012232248 [0,0,1,0,0,0|3,0,0]=4 1929 B11R0.148 CCOCCCSCCC(=O)N 62a_100012232248_100000744528 [0,0,1,0,0,0|3,0,0]=4 1930 B11R0.148 CCOCCNCCCC(=O)C 34a_102516460346_100000685027 [0,0,1,0,0,0|3,0,0]=4 1931 B11R0.148 CCOCCNCCCC(=O)N 34a_100000739312_100000210147 [0,0,1,0,0,0|3,0,0]=4 1932 B11R0.148 CCOCCNCCCC(=O)N 34a_102516460346_100102525003 [0,0,1,0,0,0|3,0,0]=4 1933 B11R0.148 CCOCCOCCCC(=O)C 34a_100000210136_100000685027 [0,0,1,0,0,0|3,0,0]=4 1934 B11R0.148 CCOCCOCCCC(=O)C 34a_100000759063_100000210147 [0,0,1,0,0,0|3,0,0]=4 1935 B11R0.148 CCOCCOCCCC(=O)C 7a_100000210136_100011215641 [0,0,1,0,0,0|3,0,0]=4 1936 B11R0.148 CCOCCOCCCC(=O)C 7a_100000759063_100011215890 [0,0,1,0,0,0|3,0,0]=4 1937 B11R0.148 CCOCCOCCCC(=O)N 34a_100000210136_100102525003 [0,0,1,0,0,0|3,0,0]=4 1938 B11R0.148 CCOCCOCCCC(=O)N 7a_100000210136_100102525003 [0,0,1,0,0,0|3,0,0]=4 1939 B11R0.148 CCOCCSCCCC(=O)C 62a_100000210147_100011215641 [0,0,1,0,0,0|3,0,0]=4 1940 B11R0.148 CCOCCSCCCC(=O)C 62a_100011215641_100011215890 [0,0,1,0,0,0|3,0,0]=4 1941 B11R0.148 CCOCCSCCCC(=O)N 62a_100000210147_100102525003 [0,0,1,0,0,0|3,0,0]=4 1942 B11R0.148 CCOCCSCCCC(=O)N 62a_100102525003_100011215890 [0,0,1,0,0,0|3,0,0]=4 1943 B11R0.148 CCOCNCCOCC(=O)O 269956a_100000700818_100000739092 [0,0,1,0,0,0|3,0,0]=4 1944 B11R0.148 CCOCSCCCCC(=O)C 62a_100000735457_100000739092 [0,0,1,0,0,0|3,0,0]=4 1945 B11R0.148 CCOCSCCCCC(=O)C 62a_100000739092_100000735457 [0,0,1,0,0,0|3,0,0]=4 1946 B11R0.148 CCSCCCCCCB(O)O 62a_100000210202_100009817187 [0,0,1,0,0,0|2,0,1]=4 1947 B11R0.148 CCSCCCCCCB(O)O 62a_100009817187_100000210202 [0,0,1,0,0,0|2,0,1]=4 1948 B11R0.148 CCSCCCCCOC(=O)C 62a_100000033007_100000210202 [0,0,1,0,0,0|3,0,0]=4 1949 B11R0.148 CCSCCCCCOC(=O)C 62a_100000210202_100000033007 [0,0,1,0,0,0|3,0,0]=4 1950 B11R0.148 CCSCCCOCCC(=O)C 7a_100011216438_100000053229 [0,0,1,0,0,0|3,0,0]=4 1951 B11R0.148 CCSCCCOCCC(=O)N 34a_100011216438_100000731001 [0,0,1,0,0,0|3,0,0]=4 1952 B11R0.148 CCSCCCOCCC(=O)N 7a_100011216438_100000744528 [0,0,1,0,0,0|3,0,0]=4 1953 B11R0.148 CCSCCNCCCC(=O)N 34a_100000739312_100000757381 [0,0,1,0,0,0|3,0,0]=4 1954 B11R0.148 CCSCCOCCCC(=O)C 34a_100000212035_100000685027 [0,0,1,0,0,0|3,0,0]=4 1955 B11R0.148 CCSCCOCCCC(=O)C 34a_100000759063_100000757381 [0,0,1,0,0,0|3,0,0]=4 1956 B11R0.148 CCSCCOCCCC(=O)C 7a_100000212035_100011215641 [0,0,1,0,0,0|3,0,0]=4 1957 B11R0.148 CCSCCOCCCC(=O)C 7a_100000759063_100000757381 [0,0,1,0,0,0|3,0,0]=4 1958 B11R0.148 CCSCCOCCCC(=O)N 34a_100000212035_100102525003 [0,0,1,0,0,0|3,0,0]=4 1959 B11R0.148 CCSCCOCCCC(=O)N 7a_100000212035_100102525003 [0,0,1,0,0,0|3,0,0]=4 1960 B11R0.148 CCSCCSCCCC(=O)C 62a_100000757381_100011215641 [0,0,1,0,0,0|3,0,0]=4 1961 B11R0.148 CCSCCSCCCC(=O)C 62a_100011215641_100000757381 [0,0,1,0,0,0|3,0,0]=4 1962 B11R0.148 CCSCCSCCCC(=O)N 62a_100000757381_100102525003 [0,0,1,0,0,0|3,0,0]=4 1963 B11R0.148 CCSCCSCCCC(=O)N 62a_100102525003_100000757381 [0,0,1,0,0,0|3,0,0]=4 1964 B11R0.148 CNCCCCCCNC(=O)C 2230a_200011996284_200000210301 [0,0,1,0,0,0|3,0,0]=4 1965 B11R0.148 CNCCCCCCNC(=O)C 34a_200011996284_200000210301 [0,0,1,0,0,0|3,0,0]=4 1966 B11R0.148 CNCCCCCOCC(=O)N 34a_100000722520_100000187820 [0,0,1,0,0,0|3,0,0]=4 1967 B11R0.148 CNCCCCCOCC(=O)[O-] 34a_100000722520_100020667443 [0,0,1,0,0,0|2,0,1]=4 1968 B11R0.148 CNCCCOCCCC(=O)C 34a_100000213112_100000685027 [0,0,1,0,0,0|3,0,0]=4 1969 B11R0.148 CNCCCOCCCC(=O)N 34a_100000213112_100102525003 [0,0,1,0,0,0|3,0,0]=4 1970 B11R0.148 CNCCOCCOCC(=O)O 269956a_100009854275_200000210301 [0,0,1,0,0,0|3,0,0]=4 1971 B11R0.148 COCCCCCNCC(=O)N 2230a_100000747528_100000747473 [0,0,1,0,0,0|3,0,0]=4 1972 B11R0.148 COCCCCCNCC(=O)N 34a_100000747528_100000187820 [0,0,1,0,0,0|3,0,0]=4 1973 B11R0.148 COCCCCCNCC(=O)[O-] 34a_100000747528_100020667443 [0,0,1,0,0,0|2,0,1]=4 1974 B11R0.148 COCCCCNOCC(=O)O 269956a_100000106656_100000730899 [0,0,1,0,0,0|3,0,0]=4 1975 B11R0.148 COCCCCOCCC(=O)C 34a_100000759926_100000755781 [0,0,1,0,0,0|3,0,0]=4 1976 B11R0.148 COCCCCOCCC(=O)C 7a_100000759926_100000730899 [0,0,1,0,0,0|3,0,0]=4 1977 B11R0.148 COCCCCOCCC(=O)N 34a_100000740925_100000731001 [0,0,1,0,0,0|3,0,0]=4 1978 B11R0.148 COCCCCOCCC(=O)N 34a_100000757172_100000755781 [0,0,1,0,0,0|3,0,0]=4 1979 B11R0.148 COCCCCOCCC(=O)N 7a_100000757172_100000730899 [0,0,1,0,0,0|3,0,0]=4 1980 B11R0.148 COCCCCSCCC(=O)C 62a_100000053229_100000730899 [0,0,1,0,0,0|3,0,0]=4 1981 B11R0.148 COCCCCSCCC(=O)C 62a_100000730899_100000053229 [0,0,1,0,0,0|3,0,0]=4 1982 B11R0.148 COCCCCSCCC(=O)N 62a_100000730899_100000744528 [0,0,1,0,0,0|3,0,0]=4 1983 B11R0.148 COCCCCSCCC(=O)N 62a_100000744528_100000730899 [0,0,1,0,0,0|3,0,0]=4 1984 B11R0.148 COCCCNCCCC(=O)C 34a_100150723488_100000685027 [0,0,1,0,0,0|3,0,0]=4 1985 B11R0.148 COCCCNCCCC(=O)N 34a_100000739312_100000740836 [0,0,1,0,0,0|3,0,0]=4 1986 B11R0.148 COCCCNCCCC(=O)N 34a_100150723488_100102525003 [0,0,1,0,0,0|3,0,0]=4 1987 B11R0.148 COCCCOCCCC(=O)C 34a_100000740835_100000685027 [0,0,1,0,0,0|3,0,0]=4 1988 B11R0.148 COCCCOCCCC(=O)C 34a_100000759063_100000740836 [0,0,1,0,0,0|3,0,0]=4 1989 B11R0.148 COCCCOCCCC(=O)C 7a_100000759063_100000740836 [0,0,1,0,0,0|3,0,0]=4 1990 B11R0.148 COCCCOCCCC(=O)N 34a_100000740835_100102525003 [0,0,1,0,0,0|3,0,0]=4 1991 B11R0.148 COCCCSCCCC(=O)C 62a_100000709357_100011215641 [0,0,1,0,0,0|3,0,0]=4 1992 B11R0.148 COCCCSCCCC(=O)C 62a_100011215641_100000709357 [0,0,1,0,0,0|3,0,0]=4 1993 B11R0.148 COCCCSCCCC(=O)N 62a_100000709357_100102525003 [0,0,1,0,0,0|3,0,0]=4 1994 B11R0.148 COCCCSCCCC(=O)N 62a_100102525003_100000709357 [0,0,1,0,0,0|3,0,0]=4 1995 B11R0.148 COCCNCCCCC(=O)N 34a_100000696515_100011201679 [0,0,1,0,0,0|3,0,0]=4 1996 B11R0.148 COCCNCCOCC(=O)O 269956a_100000700818_100000233755 [0,0,1,0,0,0|3,0,0]=4 1997 B11R0.148 COCCOCCCCC(=O)C 34a_100000210237_100009817362 [0,0,1,0,0,0|3,0,0]=4 1998 B11R0.148 COCCOCCCCC(=O)N 34a_100012022536_100011201679 [0,0,1,0,0,0|3,0,0]=4 1999 B11R0.148 COCCOCCCCC(=O)N 7a_100012022536_100000233755 [0,0,1,0,0,0|3,0,0]=4 2000 B11R0.148 COCCOCCNCC(=O)O 269956a_100016091260_100000695917 [0,0,1,0,0,0|3,0,0]=4 2001 B11R0.148 COCCSCCCCC(=O)C 62a_100000233755_100000735457 [0,0,1,0,0,0|3,0,0]=4 2002 B11R0.148 COCCSCCCCC(=O)C 62a_100000735457_100000233755 [0,0,1,0,0,0|3,0,0]=4 2003 B11R0.148 COCSCCCCCC(=O)N 62a_100000766300_100009817443 [0,0,1,0,0,0|3,0,0]=4 2004 B11R0.148 COCSCCCCCC(=O)N 62a_100009817443_100000766300 [0,0,1,0,0,0|3,0,0]=4 2005 B11R0.148 CSCCCCOCCC(=O)C 7a_100011217163_100000053229 [0,0,1,0,0,0|3,0,0]=4 2006 B11R0.148 CSCCCCOCCC(=O)N 34a_100011217163_100000731001 [0,0,1,0,0,0|3,0,0]=4 2007 B11R0.148 CSCCCCOCCC(=O)N 7a_100011217163_100000744528 [0,0,1,0,0,0|3,0,0]=4 2008 B11R0.148 CSCCCOCCCC(=O)C 34a_100000690336_100000685027 [0,0,1,0,0,0|3,0,0]=4 2009 B11R0.148 CSCCCOCCCC(=O)C 7a_100000690336_100011215641 [0,0,1,0,0,0|3,0,0]=4 2010 B11R0.148 CSCCCOCCCC(=O)N 34a_100000690336_100102525003 [0,0,1,0,0,0|3,0,0]=4 2011 B11R0.148 CSCCCOCCCC(=O)N 7a_100000690336_100102525003 [0,0,1,0,0,0|3,0,0]=4 2012 B11R0.148 CSCCNCCCCC(=O)N 34a_100000696515_100000212216 [0,0,1,0,0,0|3,0,0]=4 2013 B11R0.148 CSCCNCCOCC(=O)O 269956a_100000700818_100000212216 [0,0,1,0,0,0|3,0,0]=4 2014 B11R0.148 CSCCOCCCCC(=O)C 34a_100000230434_100009817362 [0,0,1,0,0,0|3,0,0]=4 2015 B11R0.148 CSCCOCCCCC(=O)C 7a_100000230434_100000735457 [0,0,1,0,0,0|3,0,0]=4 2016 B11R0.148 CSCCOCCCCC(=O)N 34a_100012022536_100000212216 [0,0,1,0,0,0|3,0,0]=4 2017 B11R0.148 CSCCOCCCCC(=O)N 7a_100012022536_100000212216 [0,0,1,0,0,0|3,0,0]=4 2018 B11R0.148 CSCCSCCCCC(=O)C 62a_100000212216_100000735457 [0,0,1,0,0,0|3,0,0]=4 2019 B11R0.148 CSCCSCCCCC(=O)C 62a_100000735457_100000751147 [0,0,1,0,0,0|3,0,0]=4 2020 B11R0.148 CSCOCCCCCC(=O)N 34a_100000123541_100011218213 [0,0,1,0,0,0|3,0,0]=4 2021 B11R0.148 CSCSCCCCCC(=O)N 62a_100009817443_100011218213 [0,0,1,0,0,0|3,0,0]=4 2022 B11R0.148 CSCSCCCCCC(=O)N 62a_100011218213_100009817443 [0,0,1,0,0,0|3,0,0]=4 2023 B11R0.148 N#CCCCCCNCC(=O)O 269956a_100016091260_100009813376 [0,0,1,0,0,0|2,0,1]=4 2024 B11R0.148 NC(=O)CCCCCNCCF 34a_100000724931_100009817443 [0,0,1,0,0,0|3,0,0]=4 2025 B11R0.148 NC(=O)CCCCCNCCO 2230a_100016997473_100009817443 [0,0,1,0,0,0|3,0,0]=4 2026 B11R0.148 NC(=O)CCCCCNCCO 34a_100016990907_100009817443 [0,0,1,0,0,0|3,0,0]=4 2027 B11R0.148 NC(=O)CCCCCOCCBr 34a_100000211926_100009817443 [0,0,1,0,0,0|3,0,0]=4 2028 B11R0.148 NC(=O)CCCCCOCCF 34a_100000123541_100011217306 [0,0,1,0,0,0|3,0,0]=4 2029 B11R0.148 NC(=O)CCCCCOCCF 7a_100000123541_100011217306 [0,0,1,0,0,0|3,0,0]=4 2030 B11R0.148 NC(=O)CCCCCOCCO 34a_100000123541_100000211926 [0,0,1,0,0,0|3,0,0]=4 2031 B11R0.148 NC(=O)CCCCCOCCO 7a_100000123541_100000211926 [0,0,1,0,0,0|3,0,0]=4 2032 B11R0.148 NC(=O)CCCCCSCCF 62a_100009817443_100011217306 [0,0,1,0,0,0|3,0,0]=4 2033 B11R0.148 NC(=O)CCCCCSCCF 62a_100011217306_100009817443 [0,0,1,0,0,0|3,0,0]=4 2034 B11R0.148 NC(=O)CCCCCSCCO 62a_100000211926_100009817443 [0,0,1,0,0,0|3,0,0]=4 2035 B11R0.148 NC(=O)CCCCCSCCO 62a_100009817443_100000211926 [0,0,1,0,0,0|3,0,0]=4 2036 B11R0.148 NC(=O)CCCCNCCCF 34a_100000696515_100011934791 [0,0,1,0,0,0|3,0,0]=4 2037 B11R0.148 NC(=O)CCCCNCCCO 34a_100000696515_100000230001 [0,0,1,0,0,0|3,0,0]=4 2038 B11R0.148 NC(=O)CCCCOCCCF 34a_100012022536_100011934791 [0,0,1,0,0,0|3,0,0]=4 2039 B11R0.148 NC(=O)CCCCOCCCF 7a_100012022536_100011934791 [0,0,1,0,0,0|3,0,0]=4 2040 B11R0.148 NC(=O)CCCCOCCCO 34a_100012022536_100000230001 [0,0,1,0,0,0|3,0,0]=4 2041 B11R0.148 NC(=O)CCCCOCCCO 7a_100012022536_100011215043 [0,0,1,0,0,0|3,0,0]=4 2042 B11R0.148 NC(=O)CCCNCCCCF 34a_100000739312_100000729493 [0,0,1,0,0,0|3,0,0]=4 2043 B11R0.148 NC(=O)CCCNCCCCO 34a_100000739312_100011216708 [0,0,1,0,0,0|3,0,0]=4 2044 B11R0.148 NC(=O)CCCNCCCCO 34a_100000750430_100102525003 [0,0,1,0,0,0|3,0,0]=4 2045 B11R0.148 NC(=O)CCCOCCCCBr 34a_100011216708_100102525003 [0,0,1,0,0,0|3,0,0]=4 2046 B11R0.148 NC(=O)CCCOCCCCCl 34a_100000210776_100102525003 [0,0,1,0,0,0|3,0,0]=4 2047 B11R0.148 NC(=O)CCCOCCCCCl 7a_100000210776_100102525003 [0,0,1,0,0,0|3,0,0]=4 2048 B11R0.148 NC(=O)CCCOCCCCF 34a_100011995726_100102525003 [0,0,1,0,0,0|3,0,0]=4 2049 B11R0.148 NC(=O)CCCOCCCCF 7a_100011995726_100102525003 [0,0,1,0,0,0|3,0,0]=4 2050 B11R0.148 NC(=O)CCCOCCCCI 34a_200012148704_100102525003 [0,0,1,0,0,0|3,0,0]=4 2051 B11R0.148 NC(=O)CCCSCCCCF 62a_100000729493_100102525003 [0,0,1,0,0,0|3,0,0]=4 2052 B11R0.148 NC(=O)CCCSCCCCF 62a_100102525003_100000729493 [0,0,1,0,0,0|3,0,0]=4 2053 B11R0.148 NC(=O)CCCSCCCCO 62a_100000210776_100102525003 [0,0,1,0,0,0|3,0,0]=4 2054 B11R0.148 NC(=O)CCCSCCCCO 62a_100102525003_100000210776 [0,0,1,0,0,0|3,0,0]=4 2055 B11R0.148 NC(=O)CCNCCCCCO 2230a_100000762737_100000744528 [0,0,1,0,0,0|3,0,0]=4 2056 B11R0.148 NC(=O)CCNCCCCCO 34a_100000762737_100000731001 [0,0,1,0,0,0|3,0,0]=4 2057 B11R0.148 NC(=O)CCOCCCCCBr 34a_100000746331_100000731001 [0,0,1,0,0,0|3,0,0]=4 2058 B11R0.148 NC(=O)CCOCCCCCBr 7a_100000746331_100000744528 [0,0,1,0,0,0|3,0,0]=4 2059 B11R0.148 NC(=O)CCOCCCCCCl 34a_100000746330_100000731001 [0,0,1,0,0,0|3,0,0]=4 2060 B11R0.148 NC(=O)CCOCCCCCCl 7a_100000746330_100000744528 [0,0,1,0,0,0|3,0,0]=4 2061 B11R0.148 NC(=O)CCOCCCCCF 34a_100000757172_100000729378 [0,0,1,0,0,0|3,0,0]=4 2062 B11R0.148 NC(=O)CCOCCCCCF 7a_100000757172_100000729378 [0,0,1,0,0,0|3,0,0]=4 2063 B11R0.148 NC(=O)CCOCCCCCI 34a_200012148887_100000731001 [0,0,1,0,0,0|3,0,0]=4 2064 B11R0.148 NC(=O)CCOCCCCCI 7a_200012148887_100000744528 [0,0,1,0,0,0|3,0,0]=4 2065 B11R0.148 NC(=O)CCOCCCCCO 34a_100000757172_100000746330 [0,0,1,0,0,0|3,0,0]=4 2066 B11R0.148 NC(=O)CCOCCCCCO 7a_100000757172_100000746330 [0,0,1,0,0,0|3,0,0]=4 2067 B11R0.148 NC(=O)CCSCCCCCF 62a_100000729378_100000744528 [0,0,1,0,0,0|3,0,0]=4 2068 B11R0.148 NC(=O)CCSCCCCCF 62a_100000744528_100000729378 [0,0,1,0,0,0|3,0,0]=4 2069 B11R0.148 NC(=O)CCSCCCCCO 62a_100000744528_100000746330 [0,0,1,0,0,0|3,0,0]=4 2070 B11R0.148 NC(=O)CCSCCCCCO 62a_100000746330_100000744528 [0,0,1,0,0,0|3,0,0]=4 2071 B11R0.148 NC(=O)CNCCCCCCF 2230a_100000711301_100015922095 [0,0,1,0,0,0|3,0,0]=4 2072 B11R0.148 NC(=O)CNCCCCCCO 2230a_100000686447_100000747473 [0,0,1,0,0,0|3,0,0]=4 2073 B11R0.148 NC(=O)CNCCCCCCO 2230a_100000711301_100000766143 [0,0,1,0,0,0|3,0,0]=4 2074 B11R0.148 NC(=O)CNCCCCCCO 34a_100000686447_100000187820 [0,0,1,0,0,0|3,0,0]=4 2075 B11R0.148 NC(=O)COCCCCCCBr 34a_100011215345_100000187820 [0,0,1,0,0,0|3,0,0]=4 2076 B11R0.148 NC(=O)COCCCCCCBr 7a_100011215345_100000187820 [0,0,1,0,0,0|3,0,0]=4 2077 B11R0.148 NC(=O)COCCCCCCCl 34a_100000766143_100000187820 [0,0,1,0,0,0|3,0,0]=4 2078 B11R0.148 NC(=O)COCCCCCCCl 7a_100000766143_100000187820 [0,0,1,0,0,0|3,0,0]=4 2079 B11R0.148 NC(=O)COCCCCCCF 34a_100000732779_100000187820 [0,0,1,0,0,0|3,0,0]=4 2080 B11R0.148 NC(=O)COCCCCCCF 7a_100000732779_100000187820 [0,0,1,0,0,0|3,0,0]=4 2081 B11R0.148 NC(=O)CSCCCCCCF 62a_100000747473_100015922095 [0,0,1,0,0,0|3,0,0]=4 2082 B11R0.148 NC(=O)CSCCCCCCF 62a_100015922095_100000747473 [0,0,1,0,0,0|3,0,0]=4 2083 B11R0.148 NC(=O)CSCCCCCCO 62a_100000747473_100000766143 [0,0,1,0,0,0|3,0,0]=4 2084 B11R0.148 NC(=O)CSCCCCCCO 62a_100000766143_100000747473 [0,0,1,0,0,0|3,0,0]=4 2085 B11R0.148 NCCCCCCOCC(=O)N 34a_100000686447_100000187820 [0,0,1,0,0,0|3,0,0]=4 2086 B11R0.148 NCCCCCCOCC(=O)[O-] 34a_100000686447_100020667443 [0,0,1,0,0,0|2,0,1]=4 2087 B11R0.148 NCCCCCOCCC(=O)N 34a_100000762737_100000731001 [0,0,1,0,0,0|3,0,0]=4 2088 B11R0.148 NCCCCOCCCC(=O)N 34a_100000750430_100102525003 [0,0,1,0,0,0|3,0,0]=4 2089 B11R0.148 NCCOCCCCCC(=O)N 34a_100000210304_100009817443 [0,0,1,0,0,0|3,0,0]=4 2090 B11R0.148 O=C(O)CNCCCCCCF 269956a_100016091260_100015922095 [0,0,1,0,0,0|2,0,0]=3 2091 B11R0.148 O=C(O)CNCCCCCCO 269956a_100016091260_100000766143 [0,0,1,0,0,0|2,0,0]=3 2092 B11R0.148 O=C(O)COCCNCCCF 269956a_100000700818_100011934791 [0,0,1,0,0,0|3,0,0]=4 2093 B11R0.148 O=C(O)COCCNCCCO 269956a_100000700818_100011215043 [0,0,1,0,0,0|3,0,0]=4 2094 B11R0.148 O=C(O)CONCCCCCF 269956a_100000106656_100000729378 [0,0,1,0,0,0|3,0,0]=4 2095 B11R0.148 O=C(O)CONCCCCCO 269956a_100000106656_100000746330 [0,0,1,0,0,0|3,0,0]=4 2096 B11R0.148 O=C([O-])CCCCCOCCF 7a_100102619762_100011217306 [0,0,1,0,0,0|2,0,1]=4 2097 B11R0.148 O=C([O-])CCCCCOCCO 7a_100102619762_100000211926 [0,0,1,0,0,0|2,0,1]=4 2098 B11R0.148 O=C([O-])CNCCCCCCO 34a_100000686447_100020667443 [0,0,1,0,0,0|2,0,1]=4 2099 B11R0.148 O=C([O-])COCCCCCCBr 34a_100011215345_100020667443 [0,0,1,0,0,0|2,0,1]=4 2100 B11R0.148 O=C([O-])COCCCCCCCl 34a_100000766143_100020667443 [0,0,1,0,0,0|2,0,1]=4 2101 B11R0.148 O=C([O-])COCCCCCCF 34a_100000732779_100020667443 [0,0,1,0,0,0|2,0,1]=4 2102 B11R0.148 O=C([O-])CSCCCCCCF 62a_100015922095_100020667443 [0,0,1,0,0,0|2,0,1]=4 2103 B11R0.148 O=C([O-])CSCCCCCCF 62a_100020667443_100015922095 [0,0,1,0,0,0|2,0,1]=4 2104 B11R0.148 O=C([O-])CSCCCCCCO 62a_100000766143_100020667443 [0,0,1,0,0,0|2,0,1]=4 2105 B11R0.148 O=C([O-])CSCCCCCCO 62a_100020667443_100000766143 [0,0,1,0,0,0|2,0,1]=4 2106 B11R0.148 O=CCCCCCNCC(=O)O 269956a_100016091260_100000139337 [0,0,1,0,0,0|2,0,1]=4 2107 B11R0.148 [13CH3]NCCOCCOCC(=O)O 269956a_100009854275_200025704644 [0,0,1,0,0,0|3,0,0]=4 2108 B11R0.161 CCCCCCC(CC)NCC 270004a_100015525214_100011219640 [0,0,1,0,0,0|2,0,1]=4 2109 B11R0.161 CCCCCCC(CC)OCC 34a_100011215785_100000210202 [0,0,1,0,0,0|1,0,1]=3 2110 B11R0.161 CCCCCCC(CC)OCC 7a_100011215785_100000210202 [0,0,1,0,0,0|1,0,1]=3 2111 B11R0.161 CCCCCCC(CC)OCF 34a_100011215785_100015361967 [0,0,1,0,0,0|1,0,1]=3 2112 B11R0.161 CCCCCCC(CC)OCF 7a_100011215785_100015361967 [0,0,1,0,0,0|1,0,1]=3 2113 B11R0.161 CCCCNCC(CC)OCC 2230a_100015183923_100000210211 [0,0,1,0,0,0|2,0,1]=4 2114 B11R0.161 CCCCNCC(CC)OCC 34a_100015183923_100000210210 [0,0,1,0,0,0|2,0,1]=4 2115 B13R2.10 O=C1OCC(O1)N2CCCOC2 34a_100000131196_100000032252 [0,0,0,1,0,0|3,0,0]=4 2116 B13R2.10 O=C1OCC(O1)N2CCOCC2 34a_100015191051_100000032252 [0,0,0,1,0,0|3,0,0]=4 2117 B13R2.142 O=C1CC(CN1)NC2CCCC2 2230a_100000697751_100000179811 [0,0,0,1,0,0|3,0,0]=4 2118 B13R2.142 O=C1CC(CN1)OC2CCCC2 34a_100000690082_100000179811 [0,0,0,1,0,0|3,0,0]=4 2119 B13R2.142 O=C1CCC(C1)OC2CCCC2 34a_100012614533_100000179811 [0,0,0,1,0,0|2,0,0]=3 2120 B13R2.142 O=C1CCC(C1)OC2CCOC2 34a_100012614533_100000690089 [0,0,0,1,0,0|3,0,0]=4 2121 B13R2.142 O=C1CC[C@H](N1)CN2CCCC2 2230a_100000188435_100015189358 [0,0,0,1,0,0|2,0,0]=3 2122 B13R2.142 O=C1CC[C@H](N1)CN2CCCC2 269982a_100000188435_100015189358 [0,0,0,1,0,0|2,0,0]=3 2123 B13R2.142 O=C1CC[C@H](N1)CN2CCSC2 2230a_100011215254_100015189358 [0,0,0,1,0,0|3,0,0]=4 2124 B13R2.142 O=C1CC[C@H](N1)CN2CCSC2 269982a_100011215254_100015189358 [0,0,0,1,0,0|3,0,0]=4 2125 B13R2.142 O=C1CN(CN1)CC2CCCC2 2230a_200000708111_100000740388 [0,0,0,1,0,0|3,0,0]=4 2126 B13R2.142 O=C1NCC(O1)CN2CCCC2 2230a_100000188435_100000181169 [0,0,0,1,0,0|2,0,0]=3 2127 B13R2.142 O=C1NCC(O1)CN2CCCC2 269982a_100000188435_100000181169 [0,0,0,1,0,0|2,0,0]=3 2128 B13R2.142 O=C1NCC(O1)CN2CCSC2 2230a_100011215254_100000181169 [0,0,0,1,0,0|3,0,0]=4 2129 B13R2.142 O=C1NCC(O1)CN2CCSC2 269982a_100011215254_100000181169 [0,0,0,1,0,0|3,0,0]=4 2130 B13R2.142 O=C1N[C@H](CO1)CN2CCCC2 2230a_100000188435_100015307671 [0,0,0,1,0,0|3,0,0]=4 2131 B13R2.142 O=C1N[C@H](CO1)CN2CCCC2 269982a_100000188435_100015307671 [0,0,0,1,0,0|3,0,0]=4 2132 B13R2.142 O=C1OCC(O1)CN2CCCC2 269982a_100000188435_100000073702 [0,0,0,1,0,0|2,0,0]=3 2133 B13R2.142 O=C1OCC(O1)CN2CCSC2 269982a_100011215254_100000073702 [0,0,0,1,0,0|3,0,0]=4 2134 B13R2.142 O=C1OCC(O1)NC2CCCC2 34a_100000211070_100000032252 [0,0,0,1,0,0|2,0,0]=3 2135 B13R2.142 O=C1OCC(O1)N[C@H]2CCOC2 34a_100015188467_100000032252 [0,0,0,1,0,0|3,0,0]=4 2136 B13R2.142 O=C1OCC(O1)OC2CCCC2 34a_100000210269_100000032252 [0,0,0,1,0,0|2,0,0]=3 2137 B13R2.142 O=C1OCC(O1)OC2CCCO2 34a_100000085407_100000032252 [0,0,0,1,0,0|3,0,0]=4 2138 B13R2.142 O=C1OCC(O1)O[C@H]2CCOC2 34a_100000717292_100000032252 [0,0,0,1,0,0|3,0,0]=4 2139 B13R2.142 O=C1OCC(O1)SC2CCCC2 62a_100011217020_100000032252 [0,0,0,1,0,0|2,0,0]=3 2140 B13R2.143 CC1CC1COC2COC(=O)O2 34a_100000744939_100000032252 [0,0,0,1,0,0|2,0,0]=3 2141 B13R2.143 O=C1CC[C@H](N1)CN[C@@H]2C[C@@H]2F 2230a_100015190264_100015189358 [0,0,0,1,0,0|3,0,0]=4 2142 B13R2.143 O=C1CC[C@H](N1)CN[C@@H]2C[C@H]2F 2230a_100025746932_100015189358 [0,0,0,1,0,0|3,0,0]=4 2143 B13R2.143 O=C1NCC(O1)CN[C@@H]2C[C@@H]2F 2230a_100015190264_100000181169 [0,0,0,1,0,0|3,0,0]=4 2144 B13R2.143 O=C1NCC(O1)CN[C@@H]2C[C@H]2F 2230a_100025746932_100000181169 [0,0,0,1,0,0|3,0,0]=4 2145 B13R2.143 O=C1NCC(O1)CN[C@@H]2C[C@H]2F 34a_100025746932_100000181169 [0,0,0,1,0,0|3,0,0]=4 2146 B13R2.143 O=C1OCC(O1)CN[C@@H]2C[C@H]2F 34a_100025746932_100000073702 [0,0,0,1,0,0|3,0,0]=4 2147 B13R2.144 CC1SCCN1C2COC(=O)O2 34a_200011216479_100000032252 [0,0,0,1,0,0|3,0,0]=4 2148 B13R2.144 C[C@@H]1CCCN1C2COC(=O)O2 34a_100015189458_100000032252 [0,0,0,1,0,0|2,0,0]=3 2149 B13R2.145 CC1CCN1CC2CNC(=O)O2 269982a_100000755817_100000181169 [0,0,0,1,0,0|2,0,0]=3 2150 B13R2.145 CC1CCN1CC2CNC(=O)O2 34a_100000755817_100000181169 [0,0,0,1,0,0|2,0,0]=3 2151 B13R2.145 CC1CCN1CC2COC(=O)O2 269982a_100000755817_100000073702 [0,0,0,1,0,0|2,0,0]=3 2152 B13R2.145 CC1CCN1CC2COC(=O)O2 34a_100000755817_100000073702 [0,0,0,1,0,0|2,0,0]=3 2153 B13R2.145 CC1CCN1C[C@@H]2CCC(=O)N2 269982a_100000755817_100015189358 [0,0,0,1,0,0|2,0,0]=3 2154 B13R2.145 CC1CCN1C[C@H]2COC(=O)N2 269982a_100000755817_100015307671 [0,0,0,1,0,0|3,0,0]=4 2155 B13R2.145 CC1CCN1C[C@H]2COC(=O)N2 34a_100000755817_100015307671 [0,0,0,1,0,0|3,0,0]=4 2156 B13R2.165 CCCCN1CC2CCC(C1)O2 2230a_100015188616_100000210211 [0,0,0,1,0,0|2,0,1]=4 2157 B13R2.165 CCCCN1CC2CCC(C1)O2 269982a_100015188616_100000210211 [0,0,0,1,0,0|2,0,1]=4 2158 B13R2.165 CCCCN1CC2CCC(C1)O2 34a_100015188616_100000210210 [0,0,0,1,0,0|2,0,1]=4 2159 B13R2.165 CCCNC1CC2CCC(C1)O2 270004a_100020643023_100010474450 [0,0,0,1,0,0|2,0,1]=4 2160 B13R2.2973 O=C1CC(CN1)CNCC2CC2 2230a_100016993742_100000742324 [0,0,0,1,0,0|3,0,0]=4 2161 B13R2.2973 O=C1CC(CN1)CNCC2CC2 269862a_100016993742_100000741477 [0,0,0,1,0,0|3,0,0]=4 2162 B13R2.2973 O=C1CC(CN1)CNCC2CC2 34a_100016993742_100000742324 [0,0,0,1,0,0|3,0,0]=4 2163 B13R2.2973 O=C1CC(CN1)COCC2CC2 34a_100016041077_100000742324 [0,0,0,1,0,0|3,0,0]=4 2164 B13R2.2973 O=C1CC(CN1)NCCC2CC2 2230a_100000697751_100000694398 [0,0,0,1,0,0|3,0,0]=4 2165 B13R2.2973 O=C1CC(CN1)OCCC2CC2 34a_100000690082_100000694398 [0,0,0,1,0,0|3,0,0]=4 2166 B13R2.2973 O=C1CCC(C1)OCCC2CC2 34a_100012614533_100000694398 [0,0,0,1,0,0|2,0,0]=3 2167 B13R2.2973 O=C1CCC(C1)OCCC2CO2 34a_100012614533_100000732470 [0,0,0,1,0,0|3,0,0]=4 2168 B13R2.2973 O=C1CCC(N1)COCC2CC2 34a_100000737831_100000742324 [0,0,0,1,0,0|2,0,0]=3 2169 B13R2.2973 O=C1CCC(N1)COCC2CO2 34a_100000737831_102125554688 [0,0,0,1,0,0|3,0,0]=4 2170 B13R2.2973 O=C1CC[C@@H](N1)CNCC2CC2 2230a_100015423886_100000742324 [0,0,0,1,0,0|2,0,0]=3 2171 B13R2.2973 O=C1CC[C@@H](N1)CNCC2CC2 269862a_100015423886_100000741477 [0,0,0,1,0,0|2,0,0]=3 2172 B13R2.2973 O=C1CC[C@@H](N1)CNCC2CC2 34a_100015423886_100000742324 [0,0,0,1,0,0|2,0,0]=3 2173 B13R2.2973 O=C1CC[C@@H](N1)CNCC2CO2 2230a_100015423886_100011216344 [0,0,0,1,0,0|3,0,0]=4 2174 B13R2.2973 O=C1CC[C@@H](N1)CNCC2CO2 34a_100015423886_102125554688 [0,0,0,1,0,0|3,0,0]=4 2175 B13R2.2973 O=C1CC[C@H](N1)CNCC2CC2 2230a_100000735609_100015189358 [0,0,0,1,0,0|2,0,0]=3 2176 B13R2.2973 O=C1CC[C@H](N1)CSCC2CC2 62a_100000756562_100015189358 [0,0,0,1,0,0|2,0,0]=3 2177 B13R2.2973 O=C1CC[C@H](N1)CSCC2CC2 62a_100015189358_100000742324 [0,0,0,1,0,0|2,0,0]=3 2178 B13R2.2973 O=C1CC[C@H](N1)CSCC2CO2 62a_100015189358_102125554688 [0,0,0,1,0,0|3,0,0]=4 2179 B13R2.2973 O=C1CC[C@H](N1)CSCC2CO2 62a_102125554688_100015189358 [0,0,0,1,0,0|3,0,0]=4 2180 B13R2.2973 O=C1CC[C@H](N1)CSCC2CS2 62a_100000031435_100015189358 [0,0,0,1,0,0|3,0,0]=4 2181 B13R2.2973 O=C1CC[C@H](N1)CSCC2CS2 62a_100015189358_100000031435 [0,0,0,1,0,0|3,0,0]=4 2182 B13R2.2973 O=C1CC[C@H](N1)CSC[C@@H]2CO2 62a_100000745022_100015189358 [0,0,0,1,0,0|3,0,0]=4 2183 B13R2.2973 O=C1CC[C@H](N1)CSC[C@@H]2CO2 62a_100015189358_100000745022 [0,0,0,1,0,0|3,0,0]=4 2184 B13R2.2973 O=C1NCC(O1)CNCC2CC2 2230a_100000735609_100000181169 [0,0,0,1,0,0|2,0,0]=3 2185 B13R2.2973 O=C1NCC(O1)CNCC2CC2 34a_100000735609_100000181169 [0,0,0,1,0,0|2,0,0]=3 2186 B13R2.2973 O=C1NCC(O1)COCC2CC2 34a_100000211283_100000181169 [0,0,0,1,0,0|2,0,0]=3 2187 B13R2.2973 O=C1NCC(O1)COCC2CC2 34a_100011315639_100000742324 [0,0,0,1,0,0|2,0,0]=3 2188 B13R2.2973 O=C1NCC(O1)COCC2CO2 34a_100011315639_102125554688 [0,0,0,1,0,0|3,0,0]=4 2189 B13R2.2973 O=C1NCC(O1)COC[C@@H]2CO2 34a_100000757423_100000181169 [0,0,0,1,0,0|3,0,0]=4 2190 B13R2.2973 O=C1NCC(O1)CSCC2CC2 62a_100000181169_100000742324 [0,0,0,1,0,0|2,0,0]=3 2191 B13R2.2973 O=C1NCC(O1)CSCC2CC2 62a_100000756562_100000181169 [0,0,0,1,0,0|2,0,0]=3 2192 B13R2.2973 O=C1NCC(O1)CSCC2CO2 62a_100000181169_102125554688 [0,0,0,1,0,0|3,0,0]=4 2193 B13R2.2973 O=C1NCC(O1)CSCC2CO2 62a_102125554688_100000181169 [0,0,0,1,0,0|3,0,0]=4 2194 B13R2.2973 O=C1NCC(O1)CSCC2CS2 62a_100000031435_100000181169 [0,0,0,1,0,0|3,0,0]=4 2195 B13R2.2973 O=C1NCC(O1)CSCC2CS2 62a_100000181169_100000031435 [0,0,0,1,0,0|3,0,0]=4 2196 B13R2.2973 O=C1NCC(O1)CSC[C@@H]2CO2 62a_100000181169_100000745022 [0,0,0,1,0,0|3,0,0]=4 2197 B13R2.2973 O=C1NCC(O1)CSC[C@@H]2CO2 62a_100000745022_100000181169 [0,0,0,1,0,0|3,0,0]=4 2198 B13R2.2973 O=C1N[C@H](CO1)CNCC2CC2 2230a_100000735609_100015307671 [0,0,0,1,0,0|3,0,0]=4 2199 B13R2.2973 O=C1N[C@H](CO1)CNCC2CC2 34a_100000735609_100015307671 [0,0,0,1,0,0|3,0,0]=4 2200 B13R2.2973 O=C1N[C@H](CO1)COCC2CC2 34a_100000211283_100015307671 [0,0,0,1,0,0|3,0,0]=4 2201 B13R2.2973 O=C1N[C@H](CO1)CSCC2CC2 62a_100000756562_100015307671 [0,0,0,1,0,0|3,0,0]=4 2202 B13R2.2973 O=C1N[C@H](CO1)CSCC2CC2 62a_100015307671_100000742324 [0,0,0,1,0,0|3,0,0]=4 2203 B13R2.2973 O=C1OCC(O1)CNCC2CC2 34a_100000735609_100000073702 [0,0,0,1,0,0|2,0,0]=3 2204 B13R2.2973 O=C1OCC(O1)COCC2CC2 34a_100000211283_100000073702 [0,0,0,1,0,0|2,0,0]=3 2205 B13R2.2973 O=C1OCC(O1)COC[C@@H]2CO2 34a_100000757423_100000073702 [0,0,0,1,0,0|3,0,0]=4 2206 B13R2.2973 O=C1OCC(O1)CSCC2CC2 62a_100000073702_100000742324 [0,0,0,1,0,0|2,0,0]=3 2207 B13R2.2973 O=C1OCC(O1)CSCC2CC2 62a_100000756562_100000073702 [0,0,0,1,0,0|2,0,0]=3 2208 B13R2.2973 O=C1OCC(O1)CSCC2CO2 62a_100000073702_102125554688 [0,0,0,1,0,0|3,0,0]=4 2209 B13R2.2973 O=C1OCC(O1)CSCC2CO2 62a_102125554688_100000073702 [0,0,0,1,0,0|3,0,0]=4 2210 B13R2.2973 O=C1OCC(O1)CSCC2CS2 62a_100000031435_100000073702 [0,0,0,1,0,0|3,0,0]=4 2211 B13R2.2973 O=C1OCC(O1)CSCC2CS2 62a_100000073702_100000031435 [0,0,0,1,0,0|3,0,0]=4 2212 B13R2.2973 O=C1OCC(O1)CSC[C@@H]2CO2 62a_100000073702_100000745022 [0,0,0,1,0,0|3,0,0]=4 2213 B13R2.2973 O=C1OCC(O1)CSC[C@@H]2CO2 62a_100000745022_100000073702 [0,0,0,1,0,0|3,0,0]=4 2214 B13R2.2973 O=C1OCC(O1)NCCC2CC2 34a_100000764129_100000032252 [0,0,0,1,0,0|2,0,0]=3 2215 B13R2.2973 O=C1OCC(O1)OCCC2CC2 34a_100000754188_100000032252 [0,0,0,1,0,0|2,0,0]=3 2216 B13R2.2973 O=C1OCC(O1)OCC[C@@H]2CO2 34a_100009820653_100000032252 [0,0,0,1,0,0|3,0,0]=4 2217 B13R2.2973 O=C1OCC(O1)SCCC2CC2 62a_100000764125_100000032252 [0,0,0,1,0,0|2,0,0]=3 2218 B13R2.2973 O=C1OCC(O1)SCCC2CO2 62a_100000732470_100000032252 [0,0,0,1,0,0|3,0,0]=4 2219 B13R2.2974 O=C1CC(CN1)CNC2CCC2 34a_100016993742_100000749161 [0,0,0,1,0,0|3,0,0]=4 2220 B13R2.2974 O=C1CC(CN1)COC2CCC2 34a_100016041077_100000749161 [0,0,0,1,0,0|3,0,0]=4 2221 B13R2.2974 O=C1CC(CN1)NCC2CCC2 2230a_100000697751_100000763275 [0,0,0,1,0,0|3,0,0]=4 2222 B13R2.2974 O=C1CC(CN1)NCC2CCC2 269862a_100000697751_100000753134 [0,0,0,1,0,0|3,0,0]=4 2223 B13R2.2974 O=C1CC(CN1)OCC2CCC2 34a_100000690082_100000763275 [0,0,0,1,0,0|3,0,0]=4 2224 B13R2.2974 O=C1CCC(C1)OCC2CCC2 34a_100012614533_100000763275 [0,0,0,1,0,0|2,0,0]=3 2225 B13R2.2974 O=C1CCC(C1)OCC2CCO2 34a_100012614533_100000103362 [0,0,0,1,0,0|3,0,0]=4 2226 B13R2.2974 O=C1CCC(C1)OCC2COC2 34a_100012614533_100010264016 [0,0,0,1,0,0|3,0,0]=4 2227 B13R2.2974 O=C1CCC(N1)COC2CCC2 34a_100000737831_100000749161 [0,0,0,1,0,0|2,0,0]=3 2228 B13R2.2974 O=C1CCC(N1)COC2COC2 34a_100000737831_100009818527 [0,0,0,1,0,0|3,0,0]=4 2229 B13R2.2974 O=C1CC[C@@H](N1)CNC2CCC2 270004a_100015423886_100000241760 [0,0,0,1,0,0|2,0,0]=3 2230 B13R2.2974 O=C1CC[C@@H](N1)CNC2CCC2 34a_100015423886_100000749161 [0,0,0,1,0,0|2,0,0]=3 2231 B13R2.2974 O=C1CC[C@@H](N1)CNC2COC2 34a_100015423886_100009818527 [0,0,0,1,0,0|3,0,0]=4 2232 B13R2.2974 O=C1CC[C@H](N1)CNC2CCC2 2230a_100000749019_100015189358 [0,0,0,1,0,0|2,0,0]=3 2233 B13R2.2974 O=C1CC[C@H](N1)CNC2COC2 2230a_100016991112_100015189358 [0,0,0,1,0,0|3,0,0]=4 2234 B13R2.2974 O=C1CC[C@H](N1)COC2CSC2 7a_100000072292_100015189358 [0,0,0,1,0,0|3,0,0]=4 2235 B13R2.2974 O=C1CC[C@H](N1)CSC2CCC2 62a_100015189358_100000749161 [0,0,0,1,0,0|2,0,0]=3 2236 B13R2.2974 O=C1CC[C@H](N1)CSC2COC2 62a_100015189358_100009818527 [0,0,0,1,0,0|3,0,0]=4 2237 B13R2.2974 O=C1NCC(O1)CNC2CCC2 2230a_100000749019_100000181169 [0,0,0,1,0,0|2,0,0]=3 2238 B13R2.2974 O=C1NCC(O1)CNC2CCC2 34a_100000749019_100000181169 [0,0,0,1,0,0|2,0,0]=3 2239 B13R2.2974 O=C1NCC(O1)CNC2COC2 2230a_100016991112_100000181169 [0,0,0,1,0,0|3,0,0]=4 2240 B13R2.2974 O=C1NCC(O1)COC2CCC2 34a_100000748187_100000181169 [0,0,0,1,0,0|2,0,0]=3 2241 B13R2.2974 O=C1NCC(O1)COC2CCC2 34a_100011315639_100000749161 [0,0,0,1,0,0|2,0,0]=3 2242 B13R2.2974 O=C1NCC(O1)COC2COC2 34a_100011315639_100009818527 [0,0,0,1,0,0|3,0,0]=4 2243 B13R2.2974 O=C1NCC(O1)COC2CSC2 7a_100000072292_100000181169 [0,0,0,1,0,0|3,0,0]=4 2244 B13R2.2974 O=C1NCC(O1)CSC2CCC2 62a_100000181169_100000749161 [0,0,0,1,0,0|2,0,0]=3 2245 B13R2.2974 O=C1NCC(O1)CSC2COC2 62a_100000181169_100009818527 [0,0,0,1,0,0|3,0,0]=4 2246 B13R2.2974 O=C1N[C@H](CO1)CNC2CCC2 2230a_100000749019_100015307671 [0,0,0,1,0,0|3,0,0]=4 2247 B13R2.2974 O=C1N[C@H](CO1)CNC2CCC2 34a_100000749019_100015307671 [0,0,0,1,0,0|3,0,0]=4 2248 B13R2.2974 O=C1N[C@H](CO1)COC2CCC2 34a_100000748187_100015307671 [0,0,0,1,0,0|3,0,0]=4 2249 B13R2.2974 O=C1N[C@H](CO1)CSC2CCC2 62a_100015307671_100000749161 [0,0,0,1,0,0|3,0,0]=4 2250 B13R2.2974 O=C1OCC(O1)CNC2CCC2 34a_100000749019_100000073702 [0,0,0,1,0,0|2,0,0]=3 2251 B13R2.2974 O=C1OCC(O1)COC2CCC2 34a_100000748187_100000073702 [0,0,0,1,0,0|2,0,0]=3 2252 B13R2.2974 O=C1OCC(O1)CSC2CCC2 62a_100000073702_100000749161 [0,0,0,1,0,0|2,0,0]=3 2253 B13R2.2974 O=C1OCC(O1)CSC2COC2 62a_100000073702_100009818527 [0,0,0,1,0,0|3,0,0]=4 2254 B13R2.2974 O=C1OCC(O1)NCC2CCC2 34a_100000738700_100000032252 [0,0,0,1,0,0|2,0,0]=3 2255 B13R2.2974 O=C1OCC(O1)NCC2COC2 34a_100015281925_100000032252 [0,0,0,1,0,0|3,0,0]=4 2256 B13R2.2974 O=C1OCC(O1)NC[C@@H]2CCO2 34a_100020831831_100000032252 [0,0,0,1,0,0|3,0,0]=4 2257 B13R2.2974 O=C1OCC(O1)OCC2CCC2 34a_100000760304_100000032252 [0,0,0,1,0,0|2,0,0]=3 2258 B13R2.2974 O=C1OCC(O1)OCC2CCO2 34a_100000039022_100000032252 [0,0,0,1,0,0|3,0,0]=4 2259 B13R2.2974 O=C1OCC(O1)OCC2CNC2 34a_100016987283_100000032252 [0,0,0,1,0,0|3,0,0]=4 2260 B13R2.2974 O=C1OCC(O1)OCC2COC2 34a_100000060846_100000032252 [0,0,0,1,0,0|3,0,0]=4 2261 B13R2.2974 O=C1OCC(O1)SCC2CCC2 62a_100000763275_100000032252 [0,0,0,1,0,0|2,0,0]=3 2262 B13R2.2974 O=C1OCC(O1)SCC2CCO2 62a_100000103362_100000032252 [0,0,0,1,0,0|3,0,0]=4 2263 B13R2.2974 O=C1OCC(O1)SCC2COC2 62a_100010264016_100000032252 [0,0,0,1,0,0|3,0,0]=4 2264 B13R2.2974 O=S1OCC(O1)CCN2CCC2 269982a_100000754969_100009840081 [0,0,0,1,0,0|3,0,0]=4 2265 B11R1.78 C=C1CC(C1)CNCCCC 2230a_100102567296_100000210211 [0,0,0,0,1,0|3,0,0]=4 2266 B11R1.78 C=C1CC(C1)CNCCCC 34a_100102567296_100000210210 [0,0,0,0,1,0|3,0,0]=4 2267 B11R1.78 C=C1CC(C1)COCCCC 34a_100011011225_100000210210 [0,0,0,0,1,0|3,0,0]=4 2268 B11R1.78 C=C1CC(C1)NCCCCC 2230a_100132301982_100000210326 [0,0,0,0,1,0|3,0,0]=4 2269 B11R1.78 CCCCCSC1CC(=O)C1 62a_100009894365_100000210326 [0,0,0,0,1,0|2,0,0]=3 2270 B11R1.78 CCCCNCC1CC(=O)C1 2230a_100000102301_100009874392 [0,0,0,0,1,0|2,0,0]=3 2271 B11R1.78 CCCCNCC1CC(=O)C1 7a_106832991798_100009874392 [0,0,0,0,1,0|2,0,0]=3 2272 B11R1.78 CCCCOCC1CC(=O)C1 34a_100000101936_100000210210 [0,0,0,0,1,0|2,0,0]=3 2273 B11R1.78 CCCCOCC1CC(=O)C1 7a_100000210227_100009874392 [0,0,0,0,1,0|2,0,0]=3 2274 B11R1.78 CCCCSCC1CC(=O)C1 62a_100000210211_100009874392 [0,0,0,0,1,0|2,0,0]=3 2275 B11R1.78 CCCCSCC1CC(=O)C1 62a_100009874392_100000210210 [0,0,0,0,1,0|2,0,0]=3 2276 B11R1.78 CCOCCSC1CC(=O)C1 62a_100009894365_100011215890 [0,0,0,0,1,0|3,0,0]=4 2277 B11R1.78 CCOCSCC1CC(=O)C1 62a_100000739092_100009874392 [0,0,0,0,1,0|3,0,0]=4 2278 B11R1.78 CCOCSCC1CC(=O)C1 62a_100009874392_100000739092 [0,0,0,0,1,0|3,0,0]=4 2279 B11R1.78 CCSCCSC1CC(=O)C1 62a_100009894365_100000757381 [0,0,0,0,1,0|3,0,0]=4 2280 B11R1.78 COCCCSC1CC(=O)C1 62a_100009894365_100000709357 [0,0,0,0,1,0|3,0,0]=4 2281 B11R1.78 COCCNCC1CC(=O)C1 2230a_100000209980_100009874392 [0,0,0,0,1,0|3,0,0]=4 2282 B11R1.78 COCCOCC1CC(=O)C1 34a_100000101936_100011201679 [0,0,0,0,1,0|3,0,0]=4 2283 B11R1.78 COCCSCC1CC(=O)C1 62a_100000233755_100009874392 [0,0,0,0,1,0|3,0,0]=4 2284 B11R1.78 COCCSCC1CC(=O)C1 62a_100009874392_100000233755 [0,0,0,0,1,0|3,0,0]=4 2285 B11R1.78 CSCCNCC1CC(=O)C1 2230a_100020590264_100009874392 [0,0,0,0,1,0|3,0,0]=4 2286 B11R1.78 CSCCOCC1CC(=O)C1 34a_100000101936_100000212216 [0,0,0,0,1,0|3,0,0]=4 2287 B11R1.78 CSCCOCC1CC(=O)C1 7a_100000230434_100009874392 [0,0,0,0,1,0|3,0,0]=4 2288 B11R1.78 CSCCSCC1CC(=O)C1 62a_100000212216_100009874392 [0,0,0,0,1,0|3,0,0]=4 2289 B11R1.78 CSCCSCC1CC(=O)C1 62a_100009874392_100000751147 [0,0,0,0,1,0|3,0,0]=4 2290 B11R1.78 O=C1CC(C1)CNCCCF 2230a_100015189416_100009874392 [0,0,0,0,1,0|3,0,0]=4 2291 B11R1.78 O=C1CC(C1)COCCCF 34a_100000101936_100011934791 [0,0,0,0,1,0|3,0,0]=4 2292 B11R1.78 O=C1CC(C1)COCCCO 34a_100000101936_100000230001 [0,0,0,0,1,0|3,0,0]=4 2293 B11R1.78 O=C1CC(C1)CSCCCF 62a_100009874392_100011934791 [0,0,0,0,1,0|3,0,0]=4 2294 B11R1.78 O=C1CC(C1)CSCCCF 62a_100011934791_100009874392 [0,0,0,0,1,0|3,0,0]=4 2295 B11R1.78 O=C1CC(C1)CSCCCO 62a_100009874392_100011215043 [0,0,0,0,1,0|3,0,0]=4 2296 B11R1.78 O=C1CC(C1)CSCCCO 62a_100011215043_100009874392 [0,0,0,0,1,0|3,0,0]=4 2297 B11R1.78 O=C1CC(C1)SCCCCF 62a_100009894365_100000729493 [0,0,0,0,1,0|3,0,0]=4 2298 B11R1.78 O=C1CC(C1)SCCCCO 62a_100009894365_100000210776 [0,0,0,0,1,0|3,0,0]=4 2299 B11R1.190 C#CCCCNC1CCC1=O 34a_100000718082_100009892977 [0,0,0,0,1,0|1,0,2]=4 2300 B11R1.190 C#CCCCOC1CCC1=O 34a_100000215630_100009892977 [0,0,0,0,1,0|1,0,2]=4 2301 B11R1.190 C#CCCCOC1CCC1=O 7a_100000215630_100009892977 [0,0,0,0,1,0|1,0,2]=4 2302 B11R1.190 C#CCCCSC1CCC1=O 62a_100009892977_100011215417 [0,0,0,0,1,0|1,0,2]=4 2303 B11R1.190 C#CCCCSC1CCC1=O 62a_100011215417_100009892977 [0,0,0,0,1,0|1,0,2]=4 2304 B11R1.190 C#CCSCCC1CCC1=O 62a_100000038162_200016118888 [0,0,0,0,1,0|1,0,2]=4 2305 B11R1.190 C/C=C/CCOC1CCC1=O 34a_100016278192_100009892977 [0,0,0,0,1,0|1,0,2]=4 2306 B11R1.190 C=CCCCNC1CCC1=O 34a_100000700776_100009892977 [0,0,0,0,1,0|1,0,2]=4 2307 B11R1.190 C=CCCCOC1CCC1=O 34a_100000758997_100009892977 [0,0,0,0,1,0|1,0,2]=4 2308 B11R1.190 C=CCCCOC1CCC1=O 7a_100000758997_100009892977 [0,0,0,0,1,0|1,0,2]=4 2309 B11R1.190 C=CCCCSC1CCC1=O 62a_100009892977_100000757094 [0,0,0,0,1,0|1,0,2]=4 2310 B11R1.190 C=CCCCSC1CCC1=O 62a_100011713584_100009892977 [0,0,0,0,1,0|1,0,2]=4 2311 B11R1.190 C=CCNCCC1CCC1=O 2230a_100020586998_200016118888 [0,0,0,0,1,0|1,0,2]=4 2312 B11R1.190 C=CCSCCC1CCC1=O 62a_100000210623_200016118888 [0,0,0,0,1,0|1,0,2]=4 2313 B11R1.190 C=CCSCCC1CCC1=O 62a_200016118888_100000210623 [0,0,0,0,1,0|1,0,2]=4 2314 B11R1.190 CC#CCCOC1CCC1=O 34a_100000750427_100009892977 [0,0,0,0,1,0|1,0,2]=4 2315 B11R1.190 CC/C=C\COC1CCC1=O 34a_100016268518_100009892977 [0,0,0,0,1,0|1,0,2]=4 2316 B11R1.190 CC/C=C\CSC1CCC1=O 62a_100009892977_100103147603 [0,0,0,0,1,0|1,0,2]=4 2317 B11R1.190 CC/C=C\CSC1CCC1=O 62a_100103147603_100009892977 [0,0,0,0,1,0|1,0,2]=4 2318 B11R1.190 CCC#CCOC1CCC1=O 34a_100000032950_100009892977 [0,0,0,0,1,0|1,0,2]=4 2319 B11R1.190 CCC#CCSC1CCC1=O 62a_100009813939_100009892977 [0,0,0,0,1,0|1,0,2]=4 2320 B11R1.190 CCC#CCSC1CCC1=O 62a_100009892977_100009813939 [0,0,0,0,1,0|1,0,2]=4 2321 B11R1.190 CCCCCCN1CCC1C 269982a_100000755817_100000210757 [0,0,0,0,1,0|2,0,1]=4 2322 B11R1.190 CCCCCCN1CCC1C 34a_100000755817_100000210314 [0,0,0,0,1,0|2,0,1]=4 2323 B11R1.190 CCCCCOC1CCC1=O 34a_100000210253_100009892977 [0,0,0,0,1,0|1,0,0]=2 2324 B11R1.190 CCCCCOC1CCC1=O 7a_100000210253_100009892977 [0,0,0,0,1,0|1,0,0]=2 2325 B11R1.190 CCCCCSC1CCC1=O 62a_100000210326_100009892977 [0,0,0,0,1,0|1,0,0]=2 2326 B11R1.190 CCCCCSC1CCC1=O 62a_100009892977_100000210326 [0,0,0,0,1,0|1,0,0]=2 2327 B11R1.190 CCCSCCC1CCC1=O 62a_100000210303_200016118888 [0,0,0,0,1,0|1,0,0]=2 2328 B11R1.190 CCCSCCC1CCC1=O 62a_200016118888_100000210303 [0,0,0,0,1,0|1,0,0]=2 2329 B11R1.190 CCOCCNC1CCC1=O 34a_102516460346_100009892977 [0,0,0,0,1,0|2,0,0]=3 2330 B11R1.190 CCOCCOC1CCC1=O 34a_100000210136_100009892977 [0,0,0,0,1,0|2,0,0]=3 2331 B11R1.190 CCOCCOC1CCC1=O 7a_100000210136_100009892977 [0,0,0,0,1,0|2,0,0]=3 2332 B11R1.190 CCOCCSC1CCC1=O 62a_100000210147_100009892977 [0,0,0,0,1,0|2,0,0]=3 2333 B11R1.190 CCOCCSC1CCC1=O 62a_100009892977_100011215890 [0,0,0,0,1,0|2,0,0]=3 2334 B11R1.190 CCSCCOC1CCC1=O 34a_100000212035_100009892977 [0,0,0,0,1,0|2,0,0]=3 2335 B11R1.190 CCSCCOC1CCC1=O 7a_100000212035_100009892977 [0,0,0,0,1,0|2,0,0]=3 2336 B11R1.190 CCSCCSC1CCC1=O 62a_100000757381_100009892977 [0,0,0,0,1,0|2,0,0]=3 2337 B11R1.190 CCSCCSC1CCC1=O 62a_100009892977_100000757381 [0,0,0,0,1,0|2,0,0]=3 2338 B11R1.190 CNCCCOC1CCC1=O 34a_100000213112_100009892977 [0,0,0,0,1,0|2,0,0]=3 2339 B11R1.190 COCCCNC1CCC1=O 34a_100150723488_100009892977 [0,0,0,0,1,0|2,0,0]=3 2340 B11R1.190 COCCCOC1CCC1=O 34a_100000740835_100009892977 [0,0,0,0,1,0|2,0,0]=3 2341 B11R1.190 COCCCSC1CCC1=O 62a_100000709357_100009892977 [0,0,0,0,1,0|2,0,0]=3 2342 B11R1.190 COCCCSC1CCC1=O 62a_100009892977_100000709357 [0,0,0,0,1,0|2,0,0]=3 2343 B11R1.190 COCSCCC1CCC1=O 62a_100000766300_200016118888 [0,0,0,0,1,0|2,0,0]=3 2344 B11R1.190 COCSCCC1CCC1=O 62a_200016118888_100000766300 [0,0,0,0,1,0|2,0,0]=3 2345 B11R1.190 CSCCCOC1CCC1=O 34a_100000690336_100009892977 [0,0,0,0,1,0|2,0,0]=3 2346 B11R1.190 CSCCCOC1CCC1=O 7a_100000690336_100009892977 [0,0,0,0,1,0|2,0,0]=3 2347 B11R1.190 CSCSCCC1CCC1=O 62a_100011218213_200016118888 [0,0,0,0,1,0|2,0,0]=3 2348 B11R1.190 CSCSCCC1CCC1=O 62a_200016118888_100011218213 [0,0,0,0,1,0|2,0,0]=3 2349 B11R1.190 N#CCCCSC1CCC1=O 62a_100000687738_100009892977 [0,0,0,0,1,0|2,0,1]=4 2350 B11R1.190 N#CCCCSC1CCC1=O 62a_100009892977_100000687738 [0,0,0,0,1,0|2,0,1]=4 2351 B11R1.190 N#CCSCCC1CCC1=O 62a_100011215382_200016118888 [0,0,0,0,1,0|2,0,1]=4 2352 B11R1.190 N#CCSCCC1CCC1=O 62a_200016118888_100011215382 [0,0,0,0,1,0|2,0,1]=4 2353 B11R1.190 NCCCCOC1CCC1=O 34a_100000750430_100009892977 [0,0,0,0,1,0|2,0,0]=3 2354 B11R1.190 O=C1CCC1CCNCCO 2230a_100016997473_200016118888 [0,0,0,0,1,0|2,0,0]=3 2355 B11R1.190 O=C1CCC1CCSCCF 62a_100011217306_200016118888 [0,0,0,0,1,0|2,0,0]=3 2356 B11R1.190 O=C1CCC1CCSCCF 62a_200016118888_100011217306 [0,0,0,0,1,0|2,0,0]=3 2357 B11R1.190 O=C1CCC1CCSCCO 62a_100000211926_200016118888 [0,0,0,0,1,0|2,0,0]=3 2358 B11R1.190 O=C1CCC1CCSCCO 62a_200016118888_100000211926 [0,0,0,0,1,0|2,0,0]=3 2359 B11R1.190 O=C1CCC1NCCCCO 34a_100000750430_100009892977 [0,0,0,0,1,0|2,0,0]=3 2360 B11R1.190 O=C1CCC1OCCCCBr 34a_100011216708_100009892977 [0,0,0,0,1,0|2,0,0]=3 2361 B11R1.190 O=C1CCC1OCCCCCl 34a_100000210776_100009892977 [0,0,0,0,1,0|2,0,0]=3 2362 B11R1.190 O=C1CCC1OCCCCCl 7a_100000210776_100009892977 [0,0,0,0,1,0|2,0,0]=3 2363 B11R1.190 O=C1CCC1OCCCCF 34a_100011995726_100009892977 [0,0,0,0,1,0|2,0,0]=3 2364 B11R1.190 O=C1CCC1OCCCCF 7a_100011995726_100009892977 [0,0,0,0,1,0|2,0,0]=3 2365 B11R1.190 O=C1CCC1OCCCCI 34a_200012148704_100009892977 [0,0,0,0,1,0|2,0,0]=3 2366 B11R1.190 O=C1CCC1SCCCCF 62a_100000729493_100009892977 [0,0,0,0,1,0|2,0,0]=3 2367 B11R1.190 O=C1CCC1SCCCCF 62a_100009892977_100000729493 [0,0,0,0,1,0|2,0,0]=3 2368 B11R1.190 O=C1CCC1SCCCCO 62a_100000210776_100009892977 [0,0,0,0,1,0|2,0,0]=3 2369 B11R1.190 O=C1CCC1SCCCCO 62a_100009892977_100000210776 [0,0,0,0,1,0|2,0,0]=3 2370 B11R1.190 O=CCCCSC1CCC1=O 62a_100009892977_200011292268 [0,0,0,0,1,0|2,0,1]=4 2371 B11R1.190 O=CCCCSC1CCC1=O 62a_200011292268_100009892977 [0,0,0,0,1,0|2,0,1]=4 2372 B11R1.190 O=CCSCCC1CCC1=O 62a_200015260668_200016118888 [0,0,0,0,1,0|2,0,1]=4 2373 B11R1.190 O=CCSCCC1CCC1=O 62a_200016118888_200015260668 [0,0,0,0,1,0|2,0,1]=4 2374 B13R1.6 CCCCCCN1CCC=C(C1)C 2230a_100000725631_100000210314 [0,0,0,0,0,1|3,0,0]=4 2375 B13R1.6 CCCCCCN1CCC=C(C1)C 269982a_100000725631_100000210757 [0,0,0,0,0,1|3,0,0]=4 2376 B13R1.6 CCCCCCN1CCC=C(C1)C 34a_100000725631_100000210314 [0,0,0,0,0,1|3,0,0]=4 2377 B13R1.6 CCCCCCN1CCNC(=O)C1 2230a_100000184651_100000210314 [0,0,0,0,0,1|2,0,0]=3 2378 B13R1.6 CCCCCCN1CCOC(=O)C1 2230a_100000131268_100000210314 [0,0,0,0,0,1|2,0,0]=3 2379 B13R1.6 CCCCCNC1CCNC(=O)C1 2230a_100016994916_100000210326 [0,0,0,0,0,1|2,0,0]=3 2380 B13R1.6 CCCCCNC1CCNC(=O)C1 34a_100016994916_100000718602 [0,0,0,0,0,1|2,0,0]=3 2381 B13R1.6 CCCCCOC1C=C(CCC1)C 34a_100011218613_100000718602 [0,0,0,0,0,1|3,0,0]=4 2382 B13R1.6 CCCCCOC1CCCC(=O)C1 34a_100012613340_100000718602 [0,0,0,0,0,1|2,0,0]=3 2383 B13R1.6 CCCCCO[C@@H]1CCNC(=O)C1 34a_100015189427_100000718602 [0,0,0,0,0,1|2,0,0]=3 2384 B13R1.6 CCCCOCC1CCCC(=O)N1 34a_200000102386_100000210210 [0,0,0,0,0,1|2,0,0]=3 2385 B13R1.6 CCCCOCC1CCNC(=O)C1 34a_100009886756_100000210210 [0,0,0,0,0,1|2,0,0]=3 2386 B13R1.6 CCCCOCC1COCC(=O)N1 34a_200000101122_100000210210 [0,0,0,0,0,1|2,0,0]=3 2387 B13R1.6 CCCCOCN1CCNC(=O)C1 2230a_100000184651_100011995733 [0,0,0,0,0,1|3,0,0]=4 2388 B13R1.6 CCCCOCN1CCOC(=O)C1 2230a_100000131268_100011995733 [0,0,0,0,0,1|3,0,0]=4 2389 B13R1.6 CCCOCCN1CCNC(=O)C1 2230a_100000184651_100011215938 [0,0,0,0,0,1|3,0,0]=4 2390 B13R1.6 CCCOCCN1CCOC(=O)C1 2230a_100000131268_100011215938 [0,0,0,0,0,1|3,0,0]=4 2391 B13R1.6 CCNCCCN1CCNC(=O)C1 2230a_100000757908_100000210202 [0,0,0,0,0,1|3,0,0]=4 2392 B13R1.6 CCOCCCN1CCNC(=O)C1 2230a_100000184651_100012232248 [0,0,0,0,0,1|3,0,0]=4 2393 B13R1.6 CCOCCCN1CCOC(=O)C1 2230a_100000131268_100012232248 [0,0,0,0,0,1|3,0,0]=4 2394 B13R1.6 CCOCCNC1CCNC(=O)C1 2230a_100016994916_100011215890 [0,0,0,0,0,1|3,0,0]=4 2395 B13R1.6 CCOCCNC1CCNC(=O)C1 34a_100016994916_100000210147 [0,0,0,0,0,1|3,0,0]=4 2396 B13R1.6 CCOCCOC1CCCC(=O)C1 34a_100012613340_100000210147 [0,0,0,0,0,1|3,0,0]=4 2397 B13R1.6 CCOCCO[C@@H]1CCNC(=O)C1 34a_100015189427_100000210147 [0,0,0,0,0,1|3,0,0]=4 2398 B13R1.6 CCSCCNC1CCNC(=O)C1 2230a_100016994916_100000757381 [0,0,0,0,0,1|3,0,0]=4 2399 B13R1.6 CCSCCNC1CCNC(=O)C1 34a_100016994916_100000757381 [0,0,0,0,0,1|3,0,0]=4 2400 B13R1.6 CCSCCOC1CCCC(=O)C1 34a_100012613340_100000757381 [0,0,0,0,0,1|3,0,0]=4 2401 B13R1.6 CCSCCO[C@@H]1CCNC(=O)C1 34a_100015189427_100000757381 [0,0,0,0,0,1|3,0,0]=4 2402 B13R1.6 COCCCCN1CCNC(=O)C1 2230a_100000184651_100000730899 [0,0,0,0,0,1|3,0,0]=4 2403 B13R1.6 COCCCCN1CCOC(=O)C1 2230a_100000131268_100000730899 [0,0,0,0,0,1|3,0,0]=4 2404 B13R1.6 COCCCNC1CCNC(=O)C1 2230a_100016994916_100000740836 [0,0,0,0,0,1|3,0,0]=4 2405 B13R1.6 COCCCNC1CCNC(=O)C1 34a_100016994916_100000740836 [0,0,0,0,0,1|3,0,0]=4 2406 B13R1.6 COCCCOC1CCCC(=O)C1 34a_100012613340_100000740836 [0,0,0,0,0,1|3,0,0]=4 2407 B13R1.6 COCCCO[C@@H]1CCNC(=O)C1 34a_100015189427_100000740836 [0,0,0,0,0,1|3,0,0]=4 2408 B13R1.6 COCCOCC1CCCC(=O)N1 34a_200000102386_100011201679 [0,0,0,0,0,1|3,0,0]=4 2409 B13R1.6 COCCOCC1CCNC(=O)C1 34a_100009886756_100011201679 [0,0,0,0,0,1|3,0,0]=4 2410 B13R1.6 COCCOCC1COCC(=O)N1 34a_200000101122_100011201679 [0,0,0,0,0,1|3,0,0]=4 2411 B13R1.6 CSCCOCC1CCCC(=O)N1 34a_200000102386_100000212216 [0,0,0,0,0,1|3,0,0]=4 2412 B13R1.6 CSCCOCC1CCNC(=O)C1 34a_100009886756_100000212216 [0,0,0,0,0,1|3,0,0]=4 2413 B13R1.6 CSCCOCC1COCC(=O)N1 34a_200000101122_100000212216 [0,0,0,0,0,1|3,0,0]=4 2414 B13R1.6 O=C1CC(CCN1)COCCCF 34a_100009886756_100011934791 [0,0,0,0,0,1|3,0,0]=4 2415 B13R1.6 O=C1CC(CCN1)COCCCO 34a_100009886756_100000230001 [0,0,0,0,0,1|3,0,0]=4 2416 B13R1.6 O=C1CC(CCN1)NCCCCF 2230a_100016994916_100000729493 [0,0,0,0,0,1|3,0,0]=4 2417 B13R1.6 O=C1CC(CCN1)NCCCCF 34a_100016994916_100000729493 [0,0,0,0,0,1|3,0,0]=4 2418 B13R1.6 O=C1CC(CCN1)NCCCCO 2230a_100016994916_100000210776 [0,0,0,0,0,1|3,0,0]=4 2419 B13R1.6 O=C1CC(CCN1)NCCCCO 34a_100016994916_100011216708 [0,0,0,0,0,1|3,0,0]=4 2420 B13R1.6 O=C1CCCC(C1)OCCCCF 34a_100012613340_100000729493 [0,0,0,0,0,1|3,0,0]=4 2421 B13R1.6 O=C1CCCC(C1)OCCCCO 34a_100012613340_100011216708 [0,0,0,0,0,1|3,0,0]=4 2422 B13R1.6 O=C1CCCC(N1)COCCCF 34a_200000102386_100011934791 [0,0,0,0,0,1|3,0,0]=4 2423 B13R1.6 O=C1CCCC(N1)COCCCO 34a_200000102386_100000230001 [0,0,0,0,0,1|3,0,0]=4 2424 B13R1.6 O=C1CN(CCN1)CCCCCF 2230a_100000184651_100000729378 [0,0,0,0,0,1|3,0,0]=4 2425 B13R1.6 O=C1CN(CCN1)CCCCCO 2230a_100000184651_100000746330 [0,0,0,0,0,1|3,0,0]=4 2426 B13R1.6 O=C1CN(CCO1)CCCCCF 2230a_100000131268_100000729378 [0,0,0,0,0,1|3,0,0]=4 2427 B13R1.6 O=C1CN(CCO1)CCCCCO 2230a_100000131268_100000746330 [0,0,0,0,0,1|3,0,0]=4 2428 B13R1.6 O=C1COCC(N1)COCCCF 34a_200000101122_100011934791 [0,0,0,0,0,1|3,0,0]=4 2429 B13R1.6 O=C1COCC(N1)COCCCO 34a_200000101122_100000230001 [0,0,0,0,0,1|3,0,0]=4 2430 B13R1.6 O=C1C[C@@H](CCN1)OCCCCF 34a_100015189427_100000729493 [0,0,0,0,0,1|3,0,0]=4 2431 B13R1.6 O=C1C[C@@H](CCN1)OCCCCO 34a_100015189427_100011216708 [0,0,0,0,0,1|3,0,0]=4 2432 B13R1.9 C=C1CCC(CC1)COCCCC 34a_100000074039_100000210210 [0,0,0,0,0,1|3,0,0]=4 2433 B13R1.9 C=C1CCC(CC1)NCCCCC 270004a_100000209983_100010272673 [0,0,0,0,0,1|3,0,0]=4 2434 B13R1.9 C=C1CCN(CC1)CCCCCC 2230a_100000752442_100000210314 [0,0,0,0,0,1|3,0,0]=4 2435 B13R1.9 C=C1CCN(CC1)CCCCCC 269982a_100000752442_100000210757 [0,0,0,0,0,1|3,0,0]=4 2436 B13R1.9 C=C1CCN(CC1)CCCCCC 34a_100000752442_100000210314 [0,0,0,0,0,1|3,0,0]=4 2437 B13R1.9 CCCCCCN1CC=C(CC1)C 2230a_100000693516_100000210314 [0,0,0,0,0,1|3,0,0]=4 2438 B13R1.9 CCCCCCN1CC=C(CC1)C 269982a_100000693516_100000210757 [0,0,0,0,0,1|3,0,0]=4 2439 B13R1.9 CCCCCCN1CC=C(CC1)C 34a_100000693516_100000210314 [0,0,0,0,0,1|3,0,0]=4 2440 B13R1.9 CCCCCCN1CCS(=O)CC1 2230a_100000752083_100000210314 [0,0,0,0,0,1|3,0,0]=4 2441 B13R1.9 CCCCCCN1CCS(=O)CC1 269982a_100000752083_100000210757 [0,0,0,0,0,1|3,0,0]=4 2442 B13R1.9 CCCCCNC1CCC(=O)NC1 2230a_100000748762_100000210326 [0,0,0,0,0,1|2,0,0]=3 2443 B13R1.9 CCCCCNC1CCC(=O)NC1 34a_100000748762_100000718602 [0,0,0,0,0,1|2,0,0]=3 2444 B13R1.9 CCCCCOC1CCC(=O)CC1 34a_100000764474_100000718602 [0,0,0,0,0,1|2,0,0]=3 2445 B13R1.9 CCCCCOC1CCC(=O)CC1 7a_100000764474_100000210326 [0,0,0,0,0,1|2,0,0]=3 2446 B13R1.9 CCCCCOC1CCC(=O)NC1 34a_100000079199_100000718602 [0,0,0,0,0,1|2,0,0]=3 2447 B13R1.9 CCCCCOC1CNC(=O)NC1 34a_100000080929_100000718602 [0,0,0,0,0,1|3,0,0]=4 2448 B13R1.9 CCCCOCC1CCC(=O)CC1 34a_100000062911_100000210210 [0,0,0,0,0,1|2,0,0]=3 2449 B13R1.9 CCOCCNC1CCC(=O)NC1 2230a_100000748762_100011215890 [0,0,0,0,0,1|3,0,0]=4 2450 B13R1.9 CCOCCNC1CCC(=O)NC1 34a_100000748762_100000210147 [0,0,0,0,0,1|3,0,0]=4 2451 B13R1.9 CCOCCOC1CCC(=O)CC1 34a_100000764474_100000210147 [0,0,0,0,0,1|3,0,0]=4 2452 B13R1.9 CCOCCOC1CCC(=O)CC1 7a_100000764474_100011215890 [0,0,0,0,0,1|3,0,0]=4 2453 B13R1.9 CCOCCOC1CCC(=O)NC1 34a_100000079199_100000210147 [0,0,0,0,0,1|3,0,0]=4 2454 B13R1.9 CCSCCNC1CCC(=O)NC1 2230a_100000748762_100000757381 [0,0,0,0,0,1|3,0,0]=4 2455 B13R1.9 CCSCCNC1CCC(=O)NC1 34a_100000748762_100000757381 [0,0,0,0,0,1|3,0,0]=4 2456 B13R1.9 CCSCCOC1CCC(=O)CC1 34a_100000764474_100000757381 [0,0,0,0,0,1|3,0,0]=4 2457 B13R1.9 CCSCCOC1CCC(=O)CC1 7a_100000764474_100000757381 [0,0,0,0,0,1|3,0,0]=4 2458 B13R1.9 CCSCCOC1CCC(=O)NC1 34a_100000079199_100000757381 [0,0,0,0,0,1|3,0,0]=4 2459 B13R1.9 COCCCNC1CCC(=O)NC1 2230a_100000748762_100000740836 [0,0,0,0,0,1|3,0,0]=4 2460 B13R1.9 COCCCNC1CCC(=O)NC1 34a_100000748762_100000740836 [0,0,0,0,0,1|3,0,0]=4 2461 B13R1.9 COCCCOC1CCC(=O)CC1 34a_100000764474_100000740836 [0,0,0,0,0,1|3,0,0]=4 2462 B13R1.9 COCCCOC1CCC(=O)CC1 7a_100000764474_100000740836 [0,0,0,0,0,1|3,0,0]=4 2463 B13R1.9 COCCCOC1CCC(=O)NC1 34a_100000079199_100000740836 [0,0,0,0,0,1|3,0,0]=4 2464 B13R1.9 COCCOCC1CCC(=O)CC1 34a_100000062911_100011201679 [0,0,0,0,0,1|3,0,0]=4 2465 B13R1.9 CSCCOCC1CCC(=O)CC1 34a_100000062911_100000212216 [0,0,0,0,0,1|3,0,0]=4 2466 B13R1.9 O=C1CCC(CC1)COCCCF 34a_100000062911_100011934791 [0,0,0,0,0,1|3,0,0]=4 2467 B13R1.9 O=C1CCC(CC1)COCCCO 34a_100000062911_100000230001 [0,0,0,0,0,1|3,0,0]=4 2468 B13R1.9 O=C1CCC(CC1)OCCCCF 34a_100000764474_100000729493 [0,0,0,0,0,1|3,0,0]=4 2469 B13R1.9 O=C1CCC(CC1)OCCCCF 7a_100000764474_100000729493 [0,0,0,0,0,1|3,0,0]=4 2470 B13R1.9 O=C1CCC(CC1)OCCCCO 34a_100000764474_100011216708 [0,0,0,0,0,1|3,0,0]=4 2471 B13R1.9 O=C1CCC(CC1)OCCCCO 7a_100000764474_100000210776 [0,0,0,0,0,1|3,0,0]=4 2472 B13R1.9 O=C1CCC(CN1)NCCCCF 2230a_100000748762_100000729493 [0,0,0,0,0,1|3,0,0]=4 2473 B13R1.9 O=C1CCC(CN1)NCCCCF 34a_100000748762_100000729493 [0,0,0,0,0,1|3,0,0]=4 2474 B13R1.9 O=C1CCC(CN1)NCCCCO 2230a_100000748762_100000210776 [0,0,0,0,0,1|3,0,0]=4 2475 B13R1.9 O=C1CCC(CN1)NCCCCO 34a_100000748762_100011216708 [0,0,0,0,0,1|3,0,0]=4 2476 B13R1.9 O=C1CCC(CN1)OCCCCF 34a_100000079199_100000729493 [0,0,0,0,0,1|3,0,0]=4 2477 B13R1.9 O=C1CCC(CN1)OCCCCO 34a_100000079199_100011216708 [0,0,0,0,0,1|3,0,0]=4 2478 B10R0.1 C/C=C/C(C)OCCCCC 34a_200102604097_100000718602 [1,0,1,0,0,0|2,0,0]=4 2479 B10R0.1 CCCCCCC(C)NCC 2230a_100000210919_100000210202 [1,0,1,0,0,0|1,0,1]=4 2480 B10R0.1 CCCCCCC(C)NCC 2230a_100015525214_100011215978 [1,0,1,0,0,0|1,0,1]=4 2481 B10R0.1 CCCCCCC(C)NCC 270004a_100015525214_100000210826 [1,0,1,0,0,0|1,0,1]=4 2482 B10R0.1 CCCCCCC(C)NCC 34a_100000210919_100000210202 [1,0,1,0,0,0|1,0,1]=4 2483 B10R0.1 CCCCCCC(C)OCC 34a_100000210265_100000210202 [1,0,1,0,0,0|0,0,1]=3 2484 B10R0.1 CCCCCCC(C)OCC 34a_100121572206_100011215978 [1,0,1,0,0,0|0,0,1]=3 2485 B10R0.1 CCCCCCC(C)OCC 7a_100000210265_100000210202 [1,0,1,0,0,0|0,0,1]=3 2486 B10R0.1 CCCCCCC(C)OCF 34a_100000210265_100015361967 [1,0,1,0,0,0|1,0,1]=4 2487 B10R0.1 CCCCCCC(C)OCF 7a_100000210265_100015361967 [1,0,1,0,0,0|1,0,1]=4 2488 B10R0.1 CCCCCCC(C)SCC 62a_100000210202_100011215978 [1,0,1,0,0,0|0,1,1]=4 2489 B10R0.1 CCCCCCC(C)SCC 62a_100011215978_100000210202 [1,0,1,0,0,0|0,1,1]=4 2490 B10R0.1 CCCCCCN(C)CC=O 2230a_106256046315_200015260668 [1,0,1,0,0,0|2,0,0]=4 2491 B10R0.1 CCCCCCN(C)CC=O 269982a_106256046315_200015260668 [1,0,1,0,0,0|2,0,0]=4 2492 B10R0.1 CCCCOCC(C)OCC 34a_100011217071_100000210202 [1,0,1,0,0,0|1,0,1]=4 2493 B10R0.1 CCCCOCC(C)OCC 7a_100011217071_100000210202 [1,0,1,0,0,0|1,0,1]=4 2494 B10R0.4 CC(=O)CCCCCCCO 1458a_100000070787_100000760002 [1,0,1,0,0,0|2,0,0]=4 2495 B10R0.4 CC(=O)CCCCCCCO 1458a_100011219782_200000210301 [1,0,1,0,0,0|2,0,0]=4 2496 B10R0.4 CC(=O)NCCCCCCO 240690a_100000686447_100015343762 [1,0,1,0,0,0|2,0,0]=4 2497 B10R0.4 CC(=O)NCCCCCCO 527a_100000686447_100103153847 [1,0,1,0,0,0|2,0,0]=4 2498 B10R0.4 CC(=O)NCCCCCN[13CH3] 2230a_200012022750_200025704644 [1,0,1,0,0,0|2,0,0]=4 2499 B10R0.4 CC(=O)NCCCCCN[13CH3] 34a_200012022750_200025704644 [1,0,1,0,0,0|2,0,0]=4 2500 B10R0.4 CC(=O)OCCCCCS[13CH3] 62a_100000033007_200025704644 [1,0,1,0,0,0|1,0,0]=3 2501 B10R0.4 CC(=O)OCCCCCS[13CH3] 62a_200025704644_100000033007 [1,0,1,0,0,0|1,0,0]=3 2502 B10R0.4 CC(=O)OCCCCOCF 34a_100000073216_100015361967 [1,0,1,0,0,0|2,0,0]=4 2503 B10R0.4 CC(=O)OCCCCOCF 7a_100000073216_100015361967 [1,0,1,0,0,0|2,0,0]=4 2504 B10R0.4 CC(=O)OCCCCSCF 62a_100000033659_100015361967 [1,0,1,0,0,0|2,0,0]=4 2505 B10R0.4 CC(=O)OCCCCSCF 62a_100015361967_100000033659 [1,0,1,0,0,0|2,0,0]=4 2506 B10R0.4 CC(=O)OCCCNCCF 34a_100000724931_100000042594 [1,0,1,0,0,0|2,0,0]=4 2507 B10R0.4 CC(=O)OCCCNCCO 34a_100016990907_100000042594 [1,0,1,0,0,0|2,0,0]=4 2508 B10R0.4 CC(=O)OCCCOCCBr 34a_100000211926_100000042594 [1,0,1,0,0,0|2,0,0]=4 2509 B10R0.4 CC(=O)OCCCOCCN 34a_100000210304_100000042594 [1,0,1,0,0,0|2,0,0]=4 2510 B10R0.4 CC(=O)OCCCSCCF 62a_100000042594_100011217306 [1,0,1,0,0,0|2,0,0]=4 2511 B10R0.4 CC(=O)OCCCSCCF 62a_100011217306_100000042594 [1,0,1,0,0,0|2,0,0]=4 2512 B10R0.4 CC(=O)OCCCSCCO 62a_100000042594_100000211926 [1,0,1,0,0,0|2,0,0]=4 2513 B10R0.4 CC(=O)OCCCSCCO 62a_100000211926_100000042594 [1,0,1,0,0,0|2,0,0]=4 2514 B10R0.4 CC(=O)OCCNCCCF 34a_100015189416_100009814007 [1,0,1,0,0,0|2,0,0]=4 2515 B10R0.4 CC(=O)OCCOCCCBr 34a_100011217188_100009814007 [1,0,1,0,0,0|2,0,0]=4 2516 B10R0.4 CC(=O)OCCOCCCCl 34a_100000230001_100009814007 [1,0,1,0,0,0|2,0,0]=4 2517 B10R0.4 CC(=O)OCCOCCCF 34a_100000759539_100009814007 [1,0,1,0,0,0|2,0,0]=4 2518 B10R0.4 CC(=O)OCCOCCCN 34a_100000182051_100009814007 [1,0,1,0,0,0|2,0,0]=4 2519 B10R0.4 CC(=O)OCCOCCS[13CH3] 62a_200000083610_200025704644 [1,0,1,0,0,0|2,0,0]=4 2520 B10R0.4 CC(=O)OCCOCCS[13CH3] 62a_200025704644_200000083610 [1,0,1,0,0,0|2,0,0]=4 2521 B10R0.4 CC(=O)OCCSCCCF 62a_100009814007_100011934791 [1,0,1,0,0,0|2,0,0]=4 2522 B10R0.4 CC(=O)OCCSCCCF 62a_100011934791_100009814007 [1,0,1,0,0,0|2,0,0]=4 2523 B10R0.4 CC(=O)OCCSCCCO 62a_100009814007_100011215043 [1,0,1,0,0,0|2,0,0]=4 2524 B10R0.4 CC(=O)OCCSCCCO 62a_100011215043_100009814007 [1,0,1,0,0,0|2,0,0]=4 2525 B10R0.4 CC(=O)OCNCCCCO 34a_100000750430_100009813279 [1,0,1,0,0,0|2,0,0]=4 2526 B10R0.4 CC(=O)OCOCCCCBr 34a_100011216708_100009813279 [1,0,1,0,0,0|2,0,0]=4 2527 B10R0.4 CC(=O)OCOCCCCCl 34a_100000210776_100009813279 [1,0,1,0,0,0|2,0,0]=4 2528 B10R0.4 CC(=O)OCOCCCCF 34a_100011995726_100009813279 [1,0,1,0,0,0|2,0,0]=4 2529 B10R0.4 CC(=O)OCOCCCCI 34a_200012148704_100009813279 [1,0,1,0,0,0|2,0,0]=4 2530 B10R0.4 CC(=O)OCOCCCCN 34a_100000750430_100009813279 [1,0,1,0,0,0|2,0,0]=4 2531 B10R0.4 CC(=O)OCSCCCCF 62a_100000076356_100000729493 [1,0,1,0,0,0|2,0,0]=4 2532 B10R0.4 CC(=O)OCSCCCCF 62a_100000729493_100000076356 [1,0,1,0,0,0|2,0,0]=4 2533 B10R0.4 CC(=O)OCSCCCCO 62a_100000076356_100000210776 [1,0,1,0,0,0|2,0,0]=4 2534 B10R0.4 CC(=O)OCSCCCCO 62a_100000210776_100000076356 [1,0,1,0,0,0|2,0,0]=4 2535 B10R0.4 CCCCCCC=CC(=O)C 1458a_200015324643_200000210301 [1,0,1,0,0,0|1,0,1]=4 2536 B10R0.4 CCCCCCC=CC(=O)[13CH3] 1458a_200015324643_200025704644 [1,0,1,0,0,0|1,0,1]=4 2537 B10R0.4 CCCCCCCCC(=O)C 1458a_100000070787_100000210759 [1,0,1,0,0,0|1,0,0]=3 2538 B10R0.4 CCCCCCCCC(=O)C 1458a_100000210188_200000210301 [1,0,1,0,0,0|1,0,0]=3 2539 B10R0.4 CCCCCCCCC(=O)[13CH3] 1458a_100000210188_200025704644 [1,0,1,0,0,0|1,0,0]=3 2540 B10R0.4 CCCCCCCNC(=O)C 11a_100000229938_100015343762 [1,0,1,0,0,0|1,0,0]=3 2541 B10R0.4 CCCCCCCNC(=O)C 1626a_100000229938_100015343762 [1,0,1,0,0,0|1,0,0]=3 2542 B10R0.4 CCCCCCCNC(=O)C 240690a_100000229938_100015343762 [1,0,1,0,0,0|1,0,0]=3 2543 B10R0.4 CCCCCCCNC(=O)C 527a_100000229938_100103153847 [1,0,1,0,0,0|1,0,0]=3 2544 B10R0.4 CCCCCCCOC(C)C 34a_100000210272_100000210206 [1,0,1,0,0,0|1,0,1]=4 2545 B10R0.4 CCCCCCCOC(C)C 34a_100000212225_100000210614 [1,0,1,0,0,0|1,0,1]=4 2546 B10R0.4 CCCCCCCOC(C)C 7a_100000210272_100000210206 [1,0,1,0,0,0|1,0,1]=4 2547 B10R0.4 CCCCCCNCC(=O)N 2230a_100000210581_100000747473 [1,0,1,0,0,0|2,0,0]=4 2548 B10R0.4 CCCCCCNCC(=O)N 2230a_100000711301_100000210314 [1,0,1,0,0,0|2,0,0]=4 2549 B10R0.4 CCCCCCNCC(=O)O 269956a_100016091260_100000210757 [1,0,1,0,0,0|1,0,0]=3 2550 B10R0.4 CCCCCCOCC(=O)C 34a_100000211253_100000210314 [1,0,1,0,0,0|2,0,0]=4 2551 B10R0.4 CCCCCCOCC(=O)N 34a_100000210259_100000187820 [1,0,1,0,0,0|2,0,0]=4 2552 B10R0.4 CCCCCCOCC(=O)N 7a_100000210259_100000187820 [1,0,1,0,0,0|2,0,0]=4 2553 B10R0.4 CCCCCCOCC(=O)[O-] 34a_100000210259_100020667443 [1,0,1,0,0,0|1,0,1]=4 2554 B10R0.4 CCCCCCSCC(=O)N 62a_100000210314_100000747473 [1,0,1,0,0,0|2,0,0]=4 2555 B10R0.4 CCCCCCSCC(=O)N 62a_100000747473_100000210757 [1,0,1,0,0,0|2,0,0]=4 2556 B10R0.4 CCCCCCSCC(=O)[O-] 62a_100000210314_100020667443 [1,0,1,0,0,0|1,0,1]=4 2557 B10R0.4 CCCCCCSCC(=O)[O-] 62a_100020667443_100000210757 [1,0,1,0,0,0|1,0,1]=4 2558 B10R0.4 CCCCCNCCC(=O)N 2230a_100000209983_100000744528 [1,0,1,0,0,0|2,0,0]=4 2559 B10R0.4 CCCCCNOCC(=O)O 269956a_100000106656_100000210326 [1,0,1,0,0,0|2,0,0]=4 2560 B10R0.4 CCCCCOCCC(=O)C 34a_100000759926_100000718602 [1,0,1,0,0,0|2,0,0]=4 2561 B10R0.4 CCCCCOCCC(=O)C 7a_100000210253_100000053229 [1,0,1,0,0,0|2,0,0]=4 2562 B10R0.4 CCCCCOCCC(=O)C 7a_100000759926_100000210326 [1,0,1,0,0,0|2,0,0]=4 2563 B10R0.4 CCCCCOCCC(=O)N 34a_100000210253_100000731001 [1,0,1,0,0,0|2,0,0]=4 2564 B10R0.4 CCCCCOCCC(=O)N 34a_100000757172_100000718602 [1,0,1,0,0,0|2,0,0]=4 2565 B10R0.4 CCCCCOCCC(=O)N 7a_100000210253_100000744528 [1,0,1,0,0,0|2,0,0]=4 2566 B10R0.4 CCCCCOCCC(=O)N 7a_100000757172_100000210326 [1,0,1,0,0,0|2,0,0]=4 2567 B10R0.4 CCCCCOCOC(=O)C 34a_100000210253_100009813279 [1,0,1,0,0,0|1,0,0]=3 2568 B10R0.4 CCCCCSCCC(=O)C 62a_100000053229_100000210326 [1,0,1,0,0,0|2,0,0]=4 2569 B10R0.4 CCCCCSCCC(=O)C 62a_100000210326_100000053229 [1,0,1,0,0,0|2,0,0]=4 2570 B10R0.4 CCCCCSCCC(=O)N 62a_100000210326_100000744528 [1,0,1,0,0,0|2,0,0]=4 2571 B10R0.4 CCCCCSCCC(=O)N 62a_100000744528_100000210326 [1,0,1,0,0,0|2,0,0]=4 2572 B10R0.4 CCCCCSCOC(=O)C 62a_100000076356_100000210326 [1,0,1,0,0,0|1,0,0]=3 2573 B10R0.4 CCCCCSCOC(=O)C 62a_100000210326_100000076356 [1,0,1,0,0,0|1,0,0]=3 2574 B10R0.4 CCCCNCCCC(=O)C 7a_106832991798_100011215641 [1,0,1,0,0,0|2,0,0]=4 2575 B10R0.4 CCCCNCCCC(=O)N 34a_100000739312_100000210210 [1,0,1,0,0,0|2,0,0]=4 2576 B10R0.4 CCCCNCCCC(=O)N 7a_106832991798_100102525003 [1,0,1,0,0,0|2,0,0]=4 2577 B10R0.4 CCCCNCCNC(=O)C 2230a_100000102301_100000189650 [1,0,1,0,0,0|2,0,0]=4 2578 B10R0.4 CCCCNCCNC(=O)C 2230a_100000209853_100000210211 [1,0,1,0,0,0|2,0,0]=4 2579 B10R0.4 CCCCNCCNC(=O)C 7a_106832991798_100000189650 [1,0,1,0,0,0|2,0,0]=4 2580 B10R0.4 CCCCNCCOC(=O)C 7a_106832991798_100009814007 [1,0,1,0,0,0|1,0,0]=3 2581 B10R0.4 CCCCNCCOC(=O)N 7a_106832991798_200011214921 [1,0,1,0,0,0|2,0,0]=4 2582 B10R0.4 CCCCOCCCC(=O)C 34a_100000210227_100000685027 [1,0,1,0,0,0|2,0,0]=4 2583 B10R0.4 CCCCOCCCC(=O)C 34a_100000759063_100000210210 [1,0,1,0,0,0|2,0,0]=4 2584 B10R0.4 CCCCOCCCC(=O)C 7a_100000210227_100011215641 [1,0,1,0,0,0|2,0,0]=4 2585 B10R0.4 CCCCOCCCC(=O)C 7a_100000759063_100000210211 [1,0,1,0,0,0|2,0,0]=4 2586 B10R0.4 CCCCOCCCC(=O)N 34a_100000210227_100102525003 [1,0,1,0,0,0|2,0,0]=4 2587 B10R0.4 CCCCOCCCC(=O)N 7a_100000210227_100102525003 [1,0,1,0,0,0|2,0,0]=4 2588 B10R0.4 CCCCOCCNC(=O)C 34a_100000158858_100000210210 [1,0,1,0,0,0|2,0,0]=4 2589 B10R0.4 CCCCOCCNC(=O)C 7a_100000210227_100000189650 [1,0,1,0,0,0|2,0,0]=4 2590 B10R0.4 CCCCOCCOC(=O)C 34a_100000210227_100009814007 [1,0,1,0,0,0|1,0,0]=3 2591 B10R0.4 CCCCOCCOC(=O)C 7a_100000210227_100009814007 [1,0,1,0,0,0|1,0,0]=3 2592 B10R0.4 CCCCOCCOC(=O)N 34a_100000210227_200011214921 [1,0,1,0,0,0|2,0,0]=4 2593 B10R0.4 CCCCOCCOC(=O)N 7a_100000210227_200011214921 [1,0,1,0,0,0|2,0,0]=4 2594 B10R0.4 CCCCOCCOC(=O)N 7a_100000766696_100000210211 [1,0,1,0,0,0|2,0,0]=4 2595 B10R0.4 CCCCOCNCC(=O)O 269956a_100016091260_100011995733 [1,0,1,0,0,0|2,0,0]=4 2596 B10R0.4 CCCCSCCCC(=O)C 62a_100000210211_100011215641 [1,0,1,0,0,0|2,0,0]=4 2597 B10R0.4 CCCCSCCCC(=O)C 62a_100011215641_100000210210 [1,0,1,0,0,0|2,0,0]=4 2598 B10R0.4 CCCCSCCCC(=O)N 62a_100000210211_100102525003 [1,0,1,0,0,0|2,0,0]=4 2599 B10R0.4 CCCCSCCCC(=O)N 62a_100102525003_100000210210 [1,0,1,0,0,0|2,0,0]=4 2600 B10R0.4 CCCCSCCNC(=O)C 11a_100025743550_100015343762 [1,0,1,0,0,0|2,0,0]=4 2601 B10R0.4 CCCCSCCNC(=O)C 1626a_100025743550_100015343762 [1,0,1,0,0,0|2,0,0]=4 2602 B10R0.4 CCCCSCCNC(=O)C 240690a_100025743550_100015343762 [1,0,1,0,0,0|2,0,0]=4 2603 B10R0.4 CCCCSCCNC(=O)C 527a_100025743550_100103153847 [1,0,1,0,0,0|2,0,0]=4 2604 B10R0.4 CCCCSCCNC(=O)C 62a_100000189650_100000210210 [1,0,1,0,0,0|2,0,0]=4 2605 B10R0.4 CCCCSCCNC(=O)C 62a_100000210211_100000189650 [1,0,1,0,0,0|2,0,0]=4 2606 B10R0.4 CCCCSCCOC(=O)C 62a_100000210211_100009814007 [1,0,1,0,0,0|1,0,0]=3 2607 B10R0.4 CCCCSCCOC(=O)C 62a_100009814007_100000210210 [1,0,1,0,0,0|1,0,0]=3 2608 B10R0.4 CCCCSCCOC(=O)N 62a_100000210211_200011214921 [1,0,1,0,0,0|2,0,0]=4 2609 B10R0.4 CCCCSCCOC(=O)N 62a_200011214921_100000210210 [1,0,1,0,0,0|2,0,0]=4 2610 B10R0.4 CCCNCCCCC(=O)N 34a_100000696515_100000210303 [1,0,1,0,0,0|2,0,0]=4 2611 B10R0.4 CCCNCCCNC(=O)C 34a_100000736810_100000210303 [1,0,1,0,0,0|2,0,0]=4 2612 B10R0.4 CCCNCCOCC(=O)O 269956a_100000700818_100000210207 [1,0,1,0,0,0|2,0,0]=4 2613 B10R0.4 CCCOCCCCC(=O)C 34a_100000210258_100009817362 [1,0,1,0,0,0|2,0,0]=4 2614 B10R0.4 CCCOCCCCC(=O)N 34a_100012022536_100000210303 [1,0,1,0,0,0|2,0,0]=4 2615 B10R0.4 CCCOCCCCC(=O)N 7a_100012022536_100000210303 [1,0,1,0,0,0|2,0,0]=4 2616 B10R0.4 CCCOCCCNC(=O)C 1626a_100011217757_100015343762 [1,0,1,0,0,0|2,0,0]=4 2617 B10R0.4 CCCOCCCNC(=O)C 240690a_100011217757_100015343762 [1,0,1,0,0,0|2,0,0]=4 2618 B10R0.4 CCCOCCCNC(=O)C 34a_100000752032_100000210303 [1,0,1,0,0,0|2,0,0]=4 2619 B10R0.4 CCCOCCCNC(=O)C 527a_100011217757_100103153847 [1,0,1,0,0,0|2,0,0]=4 2620 B10R0.4 CCCOCCCOC(=O)C 34a_100000210258_100000042594 [1,0,1,0,0,0|1,0,0]=3 2621 B10R0.4 CCCOCCCOC(=S)C 34a_100000210258_200135323944 [1,0,1,0,0,0|1,1,0]=4 2622 B10R0.4 CCCOCCCSC(=O)C 34a_100000210258_100000038929 [1,0,1,0,0,0|1,1,0]=4 2623 B10R0.4 CCCOCCNCC(=O)O 269956a_100016091260_100011215938 [1,0,1,0,0,0|2,0,0]=4 2624 B10R0.4 CCCSCCCCC(=O)C 62a_100000210303_100000735457 [1,0,1,0,0,0|2,0,0]=4 2625 B10R0.4 CCCSCCCCC(=O)C 62a_100000735457_100000210303 [1,0,1,0,0,0|2,0,0]=4 2626 B10R0.4 CCCSCCCOC(=O)C 62a_100000042594_100000210303 [1,0,1,0,0,0|1,0,0]=3 2627 B10R0.4 CCCSCCCOC(=O)C 62a_100000210303_100000042594 [1,0,1,0,0,0|1,0,0]=3 2628 B10R0.4 CCCSCCCOC(=S)C 62a_100000210303_200135323944 [1,0,1,0,0,0|1,1,0]=4 2629 B10R0.4 CCCSCCCOC(=S)C 62a_200135323944_100000210303 [1,0,1,0,0,0|1,1,0]=4 2630 B10R0.4 CCCSCCCSC(=O)C 62a_100000038929_100000210303 [1,0,1,0,0,0|1,1,0]=4 2631 B10R0.4 CCCSCCCSC(=O)C 62a_100000210303_100000038929 [1,0,1,0,0,0|1,1,0]=4 2632 B10R0.4 CCNCCCCCC(=O)N 2230a_100015525214_100009817443 [1,0,1,0,0,0|2,0,0]=4 2633 B10R0.4 CCNCCCCNC(=O)C 2230a_200011368371_100000210202 [1,0,1,0,0,0|2,0,0]=4 2634 B10R0.4 CCNCCCCNC(=O)C 34a_200011368371_100000210202 [1,0,1,0,0,0|2,0,0]=4 2635 B10R0.4 CCNCCCCSC(=O)C 2230a_100015525214_200010402107 [1,0,1,0,0,0|1,1,0]=4 2636 B10R0.4 CCOCCCCCC(=O)N 34a_100000123541_100000210202 [1,0,1,0,0,0|2,0,0]=4 2637 B10R0.4 CCOCCCCCC(=O)N 34a_100121572206_100009817443 [1,0,1,0,0,0|2,0,0]=4 2638 B10R0.4 CCOCCCCCC(=O)N 7a_100000123541_100000210202 [1,0,1,0,0,0|2,0,0]=4 2639 B10R0.4 CCOCCCCCC(=O)[O-] 7a_100102619762_100000210202 [1,0,1,0,0,0|1,0,1]=4 2640 B10R0.4 CCOCCCCOC(=O)C 34a_100000073216_100000210202 [1,0,1,0,0,0|1,0,0]=3 2641 B10R0.4 CCOCCCCOC(=O)C 34a_100121572206_100000033659 [1,0,1,0,0,0|1,0,0]=3 2642 B10R0.4 CCOCCCCOC(=O)C 7a_100000073216_100000210202 [1,0,1,0,0,0|1,0,0]=3 2643 B10R0.4 CCOCCCCSC(=O)C 34a_100121572206_200010402107 [1,0,1,0,0,0|1,1,0]=4 2644 B10R0.4 CCOCCCNCC(=O)O 269956a_100016091260_100012232248 [1,0,1,0,0,0|2,0,0]=4 2645 B10R0.4 CCOCCNCOC(=O)C 34a_102516460346_100009813279 [1,0,1,0,0,0|2,0,0]=4 2646 B10R0.4 CCOCCOCOC(=O)C 34a_100000210136_100009813279 [1,0,1,0,0,0|2,0,0]=4 2647 B10R0.4 CCOCCSCOC(=O)C 62a_100000076356_100011215890 [1,0,1,0,0,0|2,0,0]=4 2648 B10R0.4 CCOCCSCOC(=O)C 62a_100000210147_100000076356 [1,0,1,0,0,0|2,0,0]=4 2649 B10R0.4 CCOCOCCOC(=O)C 34a_100121572206_100000076355 [1,0,1,0,0,0|2,0,0]=4 2650 B10R0.4 CCOCSCCOC(=O)C 62a_100000739092_100009814007 [1,0,1,0,0,0|2,0,0]=4 2651 B10R0.4 CCOCSCCOC(=O)C 62a_100009814007_100000739092 [1,0,1,0,0,0|2,0,0]=4 2652 B10R0.4 CCSCCCCCC(=O)N 62a_100000210202_100009817443 [1,0,1,0,0,0|2,0,0]=4 2653 B10R0.4 CCSCCCCCC(=O)N 62a_100009817443_100000210202 [1,0,1,0,0,0|2,0,0]=4 2654 B10R0.4 CCSCCCCOC(=O)C 62a_100000033659_100000210202 [1,0,1,0,0,0|1,0,0]=3 2655 B10R0.4 CCSCCCCOC(=O)C 62a_100000210202_100000033659 [1,0,1,0,0,0|1,0,0]=3 2656 B10R0.4 CCSCCCCSC(=O)C 62a_100000210202_200010402107 [1,0,1,0,0,0|1,1,0]=4 2657 B10R0.4 CCSCCCCSC(=O)C 62a_200010402107_100000210202 [1,0,1,0,0,0|1,1,0]=4 2658 B10R0.4 CCSCCOCOC(=O)C 34a_100000212035_100009813279 [1,0,1,0,0,0|2,0,0]=4 2659 B10R0.4 CCSCCSCOC(=O)C 62a_100000076356_100000757381 [1,0,1,0,0,0|2,0,0]=4 2660 B10R0.4 CCSCCSCOC(=O)C 62a_100000757381_100000076356 [1,0,1,0,0,0|2,0,0]=4 2661 B10R0.4 CCSCOCCOC(=O)C 62a_100000076355_100000210202 [1,0,1,0,0,0|2,0,0]=4 2662 B10R0.4 CCSCOCCOC(=O)C 62a_100000210202_100000076355 [1,0,1,0,0,0|2,0,0]=4 2663 B10R0.4 CNCCCCCNC(=O)C 2230a_200012022750_200000210301 [1,0,1,0,0,0|2,0,0]=4 2664 B10R0.4 CNCCCCCNC(=O)C 34a_200012022750_200000210301 [1,0,1,0,0,0|2,0,0]=4 2665 B10R0.4 CNCCCCCOC(=O)C 2230a_106832991635_100009813381 [1,0,1,0,0,0|1,0,0]=3 2666 B10R0.4 CNCCCCCOC(=O)C 34a_100102657272_100000033007 [1,0,1,0,0,0|1,0,0]=3 2667 B10R0.4 CNCCCCCOC(=O)C 7a_106832991635_100000033007 [1,0,1,0,0,0|1,0,0]=3 2668 B10R0.4 CNCCCOCOC(=O)C 34a_100000213112_100009813279 [1,0,1,0,0,0|2,0,0]=4 2669 B10R0.4 CNCCOCCOC(=O)C 2230a_106832991635_200000083610 [1,0,1,0,0,0|2,0,0]=4 2670 B10R0.4 CNCCOCCOC(=O)C 34a_100102657272_200000083610 [1,0,1,0,0,0|2,0,0]=4 2671 B10R0.4 CNCCOCCOC(=O)C 7a_106832991635_200000083610 [1,0,1,0,0,0|2,0,0]=4 2672 B10R0.4 COCCCCCCC(=O)C 1458a_100000070787_100011998445 [1,0,1,0,0,0|2,0,0]=4 2673 B10R0.4 COCCCCCNC(=O)C 11a_100000747528_100015343762 [1,0,1,0,0,0|2,0,0]=4 2674 B10R0.4 COCCCCCNC(=O)C 1626a_100000747528_100015343762 [1,0,1,0,0,0|2,0,0]=4 2675 B10R0.4 COCCCCCNC(=O)C 240690a_100000747528_100015343762 [1,0,1,0,0,0|2,0,0]=4 2676 B10R0.4 COCCCCCNC(=O)C 527a_100000747528_100103153847 [1,0,1,0,0,0|2,0,0]=4 2677 B10R0.4 COCCCCCOC(=O)C 34a_100138415774_100000033007 [1,0,1,0,0,0|1,0,0]=3 2678 B10R0.4 COCCCCNCC(=O)O 269956a_100016091260_100000730899 [1,0,1,0,0,0|2,0,0]=4 2679 B10R0.4 COCCCNCOC(=O)C 34a_100150723488_100009813279 [1,0,1,0,0,0|2,0,0]=4 2680 B10R0.4 COCCCOCOC(=O)C 34a_100000740835_100009813279 [1,0,1,0,0,0|2,0,0]=4 2681 B10R0.4 COCCCSCOC(=O)C 62a_100000076356_100000709357 [1,0,1,0,0,0|2,0,0]=4 2682 B10R0.4 COCCCSCOC(=O)C 62a_100000709357_100000076356 [1,0,1,0,0,0|2,0,0]=4 2683 B10R0.4 COCCOCCOC(=O)C 34a_100000210237_100009814007 [1,0,1,0,0,0|2,0,0]=4 2684 B10R0.4 COCCOCCOC(=O)C 34a_100138415774_200000083610 [1,0,1,0,0,0|2,0,0]=4 2685 B10R0.4 COCCSCCOC(=O)C 62a_100000233755_100009814007 [1,0,1,0,0,0|2,0,0]=4 2686 B10R0.4 COCCSCCOC(=O)C 62a_100009814007_100000233755 [1,0,1,0,0,0|2,0,0]=4 2687 B10R0.4 COCSCCCOC(=O)C 62a_100000042594_100000766300 [1,0,1,0,0,0|2,0,0]=4 2688 B10R0.4 COCSCCCOC(=O)C 62a_100000766300_100000042594 [1,0,1,0,0,0|2,0,0]=4 2689 B10R0.4 CSCCCCCOC(=O)C 62a_100000033007_200000210301 [1,0,1,0,0,0|1,0,0]=3 2690 B10R0.4 CSCCCCCOC(=O)C 62a_200000210301_100000033007 [1,0,1,0,0,0|1,0,0]=3 2691 B10R0.4 CSCCCOCOC(=O)C 34a_100000690336_100009813279 [1,0,1,0,0,0|2,0,0]=4 2692 B10R0.4 CSCCOCCOC(=O)C 34a_100000230434_100009814007 [1,0,1,0,0,0|2,0,0]=4 2693 B10R0.4 CSCCOCCOC(=O)C 62a_200000083610_200000210301 [1,0,1,0,0,0|2,0,0]=4 2694 B10R0.4 CSCCOCCOC(=O)C 62a_200000210301_200000083610 [1,0,1,0,0,0|2,0,0]=4 2695 B10R0.4 CSCCOCCOC(=O)C 7a_100000230434_100009814007 [1,0,1,0,0,0|2,0,0]=4 2696 B10R0.4 CSCCSCCOC(=O)C 62a_100000212216_100009814007 [1,0,1,0,0,0|2,0,0]=4 2697 B10R0.4 CSCCSCCOC(=O)C 62a_100009814007_100000751147 [1,0,1,0,0,0|2,0,0]=4 2698 B10R0.4 CSCSCCCOC(=O)C 62a_100000042594_100011218213 [1,0,1,0,0,0|2,0,0]=4 2699 B10R0.4 CSCSCCCOC(=O)C 62a_100011218213_100000042594 [1,0,1,0,0,0|2,0,0]=4 2700 B10R0.4 O=C(O)CNCCCCCF 269956a_100016091260_100000729378 [1,0,1,0,0,0|2,0,0]=4 2701 B10R0.4 O=C(O)CNCCCCCO 269956a_100016091260_100000746330 [1,0,1,0,0,0|2,0,0]=4 2702 B10R0.4 [13CH3]C(=O)CCCCCCCO 1458a_100011219782_200025704644 [1,0,1,0,0,0|2,0,0]=4 2703 B10R0.6 CC(=O)OC(C)SCCCF 62a_100009818208_100011934791 [1,0,1,0,0,0|2,0,0]=4 2704 B10R0.6 CC(=O)OC(C)SCCCF 62a_100011934791_100009818208 [1,0,1,0,0,0|2,0,0]=4 2705 B10R0.6 CC(=O)OC(C)SCCCO 62a_100009818208_100011215043 [1,0,1,0,0,0|2,0,0]=4 2706 B10R0.6 CC(=O)OC(C)SCCCO 62a_100011215043_100009818208 [1,0,1,0,0,0|2,0,0]=4 2707 B10R0.6 CCCCCC(C)NC(=O)C 11a_100000211957_100015343762 [1,0,1,0,0,0|1,0,0]=3 2708 B10R0.6 CCCCCC(C)NC(=O)C 1626a_100000211957_100015343762 [1,0,1,0,0,0|1,0,0]=3 2709 B10R0.6 CCCCCC(C)NC(=O)C 240690a_100000211957_100015343762 [1,0,1,0,0,0|1,0,0]=3 2710 B10R0.6 CCCCCC(C)NC(=O)C 527a_100000211957_100103153847 [1,0,1,0,0,0|1,0,0]=3 2711 B10R0.6 CCCCCC(C)OC(C)C 34a_100000212225_200011218191 [1,0,1,0,0,0|1,0,1]=4 2712 B10R0.6 CCCCCC(C)OC(C)C 34a_100011215632_100000210206 [1,0,1,0,0,0|1,0,1]=4 2713 B10R0.6 CCCCCC(C)OC(C)C 7a_100011215632_100000210206 [1,0,1,0,0,0|1,0,1]=4 2714 B10R0.6 CCCCSC(C)OC(=O)C 62a_100000210211_100009818208 [1,0,1,0,0,0|1,0,0]=3 2715 B10R0.6 CCCCSC(C)OC(=O)C 62a_100009818208_100000210210 [1,0,1,0,0,0|1,0,0]=3 2716 B10R0.6 CCOCSC(C)OC(=O)C 62a_100000739092_100009818208 [1,0,1,0,0,0|2,0,0]=4 2717 B10R0.6 CCOCSC(C)OC(=O)C 62a_100009818208_100000739092 [1,0,1,0,0,0|2,0,0]=4 2718 B10R0.6 COCCSC(C)OC(=O)C 62a_100000233755_100009818208 [1,0,1,0,0,0|2,0,0]=4 2719 B10R0.6 COCCSC(C)OC(=O)C 62a_100009818208_100000233755 [1,0,1,0,0,0|2,0,0]=4 2720 B10R0.6 CSCCSC(C)OC(=O)C 62a_100000212216_100009818208 [1,0,1,0,0,0|2,0,0]=4 2721 B10R0.6 CSCCSC(C)OC(=O)C 62a_100009818208_100000751147 [1,0,1,0,0,0|2,0,0]=4 2722 B10R0.71 C=CCCCCCCCNC 2230a_106832991635_100012355270 [1,0,1,0,0,0|2,0,0]=4 2723 B10R0.71 C=CCCCCCCCNC 34a_100102657272_100012355270 [1,0,1,0,0,0|2,0,0]=4 2724 B10R0.71 C=CCCCCCCCNC 7a_106832991635_100012355270 [1,0,1,0,0,0|2,0,0]=4 2725 B10R0.71 C=CCCCCCCCOC 34a_100000730831_200000210301 [1,0,1,0,0,0|2,0,0]=4 2726 B10R0.71 C=CCCCCCCCOC 34a_100138415774_100012355270 [1,0,1,0,0,0|2,0,0]=4 2727 B10R0.71 C=CCCCCCCCOC 7a_100000730831_200000210301 [1,0,1,0,0,0|2,0,0]=4 2728 B10R0.71 C=CCCCCCCCO[13CH3] 34a_100000730831_200025704644 [1,0,1,0,0,0|2,0,0]=4 2729 B10R0.71 C=CCCCCCCCO[13CH3] 7a_100000730831_200025704644 [1,0,1,0,0,0|2,0,0]=4 2730 B10R0.71 C=CCCCCCCCSC 62a_100012355270_200000210301 [1,0,1,0,0,0|2,0,0]=4 2731 B10R0.71 C=CCCCCCCCSC 62a_200000210301_100012355270 [1,0,1,0,0,0|2,0,0]=4 2732 B10R0.71 C=CCCCCCCCS[13CH3] 62a_100012355270_200025704644 [1,0,1,0,0,0|2,0,0]=4 2733 B10R0.71 C=CCCCCCCCS[13CH3] 62a_200025704644_100012355270 [1,0,1,0,0,0|2,0,0]=4 2734 B10R0.71 C=CCCCCCCNCC 2230a_100015525214_100011215473 [1,0,1,0,0,0|2,0,0]=4 2735 B10R0.71 C=CCCCCCCOCC 34a_100121572206_100011215473 [1,0,1,0,0,0|2,0,0]=4 2736 B10R0.71 C=CCCCCCCOCC 34a_200011216477_100000210202 [1,0,1,0,0,0|2,0,0]=4 2737 B10R0.71 C=CCCCCCCOCC 7a_200011216477_100000210202 [1,0,1,0,0,0|2,0,0]=4 2738 B10R0.71 C=CCCCCCCSCC 62a_100000210202_100011215473 [1,0,1,0,0,0|2,0,0]=4 2739 B10R0.71 C=CCCCCCCSCC 62a_100011215473_100000210202 [1,0,1,0,0,0|2,0,0]=4 2740 B10R0.71 C=CCCCCCOCCC 34a_100000210258_100000700193 [1,0,1,0,0,0|2,0,0]=4 2741 B10R0.71 C=CCCCCCOCCC 34a_100011216702_100000210303 [1,0,1,0,0,0|2,0,0]=4 2742 B10R0.71 C=CCCCCCOCCC 7a_100011216702_100000210303 [1,0,1,0,0,0|2,0,0]=4 2743 B10R0.71 C=CCCCCCSCCC 62a_100000210303_100000700193 [1,0,1,0,0,0|2,0,0]=4 2744 B10R0.71 C=CCCCCCSCCC 62a_100000700193_100000210303 [1,0,1,0,0,0|2,0,0]=4 2745 B10R0.71 C=CCCCCNCCCC 2230a_100000102301_100011215482 [1,0,1,0,0,0|2,0,0]=4 2746 B10R0.71 C=CCCCCNCCCC 2230a_100000703577_100000210211 [1,0,1,0,0,0|2,0,0]=4 2747 B10R0.71 C=CCCCCNCCCC 34a_100000703577_100000210210 [1,0,1,0,0,0|2,0,0]=4 2748 B10R0.71 C=CCCCCNCCCC 7a_106832991798_100011215482 [1,0,1,0,0,0|2,0,0]=4 2749 B10R0.71 C=CCCCCOCCCC 34a_100000210227_100011215482 [1,0,1,0,0,0|2,0,0]=4 2750 B10R0.71 C=CCCCCOCCCC 34a_100000766645_100000210210 [1,0,1,0,0,0|2,0,0]=4 2751 B10R0.71 C=CCCCCOCCCC 7a_100000210227_100011215482 [1,0,1,0,0,0|2,0,0]=4 2752 B10R0.71 C=CCCCCOCCCC 7a_100000766645_100000210211 [1,0,1,0,0,0|2,0,0]=4 2753 B10R0.71 C=CCCCCSCCCC 62a_100000210211_100011215482 [1,0,1,0,0,0|2,0,0]=4 2754 B10R0.71 C=CCCCCSCCCC 62a_100011215482_100000210210 [1,0,1,0,0,0|2,0,0]=4 2755 B10R0.71 C=CCCCNCCCCC 2230a_100000209983_100011713584 [1,0,1,0,0,0|2,0,0]=4 2756 B10R0.71 C=CCCCNCCCCC 2230a_100000700776_100000210326 [1,0,1,0,0,0|2,0,0]=4 2757 B10R0.71 C=CCCCNCCCCC 34a_100000700776_100000718602 [1,0,1,0,0,0|2,0,0]=4 2758 B10R0.71 C=CCCCOCCCCC 34a_100000210253_100000757094 [1,0,1,0,0,0|2,0,0]=4 2759 B10R0.71 C=CCCCOCCCCC 34a_100000758997_100000718602 [1,0,1,0,0,0|2,0,0]=4 2760 B10R0.71 C=CCCCOCCCCC 7a_100000210253_100000757094 [1,0,1,0,0,0|2,0,0]=4 2761 B10R0.71 C=CCCCOCCCCC 7a_100000758997_100000210326 [1,0,1,0,0,0|2,0,0]=4 2762 B10R0.71 C=CCCCSCCCCC 62a_100000210326_100000757094 [1,0,1,0,0,0|2,0,0]=4 2763 B10R0.71 C=CCCCSCCCCC 62a_100011713584_100000210326 [1,0,1,0,0,0|2,0,0]=4 2764 B10R0.71 C=CCCNCCCCCC 2230a_100000210581_100000754431 [1,0,1,0,0,0|2,0,0]=4 2765 B10R0.71 C=CCCNCCCCCC 2230a_100015191253_100000210314 [1,0,1,0,0,0|2,0,0]=4 2766 B10R0.71 C=CCCOCCCCCC 34a_100000210259_100000754431 [1,0,1,0,0,0|2,0,0]=4 2767 B10R0.71 C=CCCOCCCCCC 34a_100011205117_100000210314 [1,0,1,0,0,0|2,0,0]=4 2768 B10R0.71 C=CCCOCCCCCC 7a_100000210259_100000754431 [1,0,1,0,0,0|2,0,0]=4 2769 B10R0.71 C=CCCSCCCCCC 62a_100000210314_100000754431 [1,0,1,0,0,0|2,0,0]=4 2770 B10R0.71 C=CCCSCCCCCC 62a_100000754431_100000210757 [1,0,1,0,0,0|2,0,0]=4 2771 B10R0.71 C=CCNCCCCCCC 2230a_100000229938_100000210623 [1,0,1,0,0,0|2,0,0]=4 2772 B10R0.71 C=CCNCCCCCCC 2230a_100020586998_100000210681 [1,0,1,0,0,0|2,0,0]=4 2773 B10R0.71 C=CCOCCCCCCC 34a_100000210272_100015514636 [1,0,1,0,0,0|2,0,0]=4 2774 B10R0.71 C=CCOCCCCCCC 34a_200000210373_100000210614 [1,0,1,0,0,0|2,0,0]=4 2775 B10R0.71 C=CCOCCCCCCC 7a_100000210272_100015514636 [1,0,1,0,0,0|2,0,0]=4 2776 B10R0.71 C=CCSCCCCCCC 62a_100000210614_100000210623 [1,0,1,0,0,0|2,0,0]=4 2777 B10R0.71 C=CCSCCCCCCC 62a_100000210623_100000210316 [1,0,1,0,0,0|2,0,0]=4 2778 B10R0.71 CC/C=C/CCCOCCC 34a_100016287902_100000210303 [1,0,1,0,0,0|2,0,0]=4 2779 B10R0.71 CC/C=C/CCCOCCC 7a_100016287902_100000210303 [1,0,1,0,0,0|2,0,0]=4 2780 B10R0.71 CC/C=C\CCCCCNC 269862a_106832991636_100016288537 [1,0,1,0,0,0|2,0,0]=4 2781 B10R0.71 CC/C=C\CCCCCOC 34a_100016268722_200000210301 [1,0,1,0,0,0|2,0,0]=4 2782 B10R0.71 CC/C=C\CCCCCOC 7a_100016268722_200000210301 [1,0,1,0,0,0|2,0,0]=4 2783 B10R0.71 CC/C=C\CCCCCO[13CH3] 34a_100016268722_200025704644 [1,0,1,0,0,0|2,0,0]=4 2784 B10R0.71 CC/C=C\CCCCCO[13CH3] 7a_100016268722_200025704644 [1,0,1,0,0,0|2,0,0]=4 2785 B10R0.71 CC/C=C\CCCCOCC 34a_100016287862_100000210202 [1,0,1,0,0,0|2,0,0]=4 2786 B10R0.71 CC/C=C\CCCCOCC 7a_100016287862_100000210202 [1,0,1,0,0,0|2,0,0]=4 2787 B10R0.71 CC/C=C\CCNCCCC 2230a_100000102301_100015370543 [1,0,1,0,0,0|2,0,0]=4 2788 B10R0.71 CC/C=C\CCNCCCC 7a_106832991798_100015370543 [1,0,1,0,0,0|2,0,0]=4 2789 B10R0.71 CC/C=C\CCOCCCC 34a_100000210227_100015370543 [1,0,1,0,0,0|2,0,0]=4 2790 B10R0.71 CC/C=C\CCOCCCC 34a_100016288707_100000210210 [1,0,1,0,0,0|2,0,0]=4 2791 B10R0.71 CC/C=C\CCOCCCC 7a_100000210227_100015370543 [1,0,1,0,0,0|2,0,0]=4 2792 B10R0.71 CC/C=C\CCOCCCC 7a_100016288707_100000210211 [1,0,1,0,0,0|2,0,0]=4 2793 B10R0.71 CC/C=C\CCSCCCC 62a_100000210211_100015370543 [1,0,1,0,0,0|2,0,0]=4 2794 B10R0.71 CC/C=C\CCSCCCC 62a_100015370543_100000210210 [1,0,1,0,0,0|2,0,0]=4 2795 B10R0.71 CC/C=C\CNCCCCC 2230a_100000209983_100103147603 [1,0,1,0,0,0|2,0,0]=4 2796 B10R0.71 CC/C=C\COCCCCC 34a_100000210253_100103147603 [1,0,1,0,0,0|2,0,0]=4 2797 B10R0.71 CC/C=C\COCCCCC 34a_100016268518_100000718602 [1,0,1,0,0,0|2,0,0]=4 2798 B10R0.71 CC/C=C\COCCCCC 7a_100000210253_100103147603 [1,0,1,0,0,0|2,0,0]=4 2799 B10R0.71 CC/C=C\CSCCCCC 62a_100000210326_100103147603 [1,0,1,0,0,0|2,0,0]=4 2800 B10R0.71 CC/C=C\CSCCCCC 62a_100103147603_100000210326 [1,0,1,0,0,0|2,0,0]=4 2801 B10R0.71 CCCCCCCCCNC 2230a_100000212291_200000210301 [1,0,1,0,0,0|2,0,0]=4 2802 B10R0.71 CCCCCCCCCNC 2230a_106832991635_100011214924 [1,0,1,0,0,0|2,0,0]=4 2803 B10R0.71 CCCCCCCCCNC 34a_100000212291_200000210301 [1,0,1,0,0,0|2,0,0]=4 2804 B10R0.71 CCCCCCCCCNC 34a_100102657272_100011214924 [1,0,1,0,0,0|2,0,0]=4 2805 B10R0.71 CCCCCCCCCNC 7a_106832991635_100000210328 [1,0,1,0,0,0|2,0,0]=4 2806 B10R0.71 CCCCCCCCCN[13CH3] 2230a_100000212291_200025704644 [1,0,1,0,0,0|2,0,0]=4 2807 B10R0.71 CCCCCCCCCN[13CH3] 34a_100000212291_200025704644 [1,0,1,0,0,0|2,0,0]=4 2808 B10R0.71 CCCCCCCCCOC 34a_100000210712_200000210301 [1,0,1,0,0,0|2,0,0]=4 2809 B10R0.71 CCCCCCCCCOC 34a_100138415774_100011214924 [1,0,1,0,0,0|2,0,0]=4 2810 B10R0.71 CCCCCCCCCOC 7a_100000210712_200000210301 [1,0,1,0,0,0|2,0,0]=4 2811 B10R0.71 CCCCCCCCCO[13CH3] 34a_100000210712_200025704644 [1,0,1,0,0,0|2,0,0]=4 2812 B10R0.71 CCCCCCCCCO[13CH3] 7a_100000210712_200025704644 [1,0,1,0,0,0|2,0,0]=4 2813 B10R0.71 CCCCCCCCCSC 62a_200000210301_100000210670 [1,0,1,0,0,0|2,0,0]=4 2814 B10R0.71 CCCCCCCCCS[13CH3] 62a_200025704644_100000210670 [1,0,1,0,0,0|2,0,0]=4 2815 B10R0.71 CCCCCCCCNCC 2230a_100000229939_100000210202 [1,0,1,0,0,0|2,0,0]=4 2816 B10R0.71 CCCCCCCCNCC 2230a_100015525214_100000210759 [1,0,1,0,0,0|2,0,0]=4 2817 B10R0.71 CCCCCCCCNCC 34a_100000229939_100000210202 [1,0,1,0,0,0|2,0,0]=4 2818 B10R0.71 CCCCCCCCOCC 34a_100000210232_100000210202 [1,0,1,0,0,0|2,0,0]=4 2819 B10R0.71 CCCCCCCCOCC 34a_100121572206_100000210759 [1,0,1,0,0,0|2,0,0]=4 2820 B10R0.71 CCCCCCCCOCC 7a_100000210232_100000210202 [1,0,1,0,0,0|2,0,0]=4 2821 B10R0.71 CCCCCCCCSCC 62a_100000210202_100000210317 [1,0,1,0,0,0|2,0,0]=4 2822 B10R0.71 CCCCCCCCSCC 62a_100000210759_100000210202 [1,0,1,0,0,0|2,0,0]=4 2823 B10R0.71 CCCCCCCNCC=O 2230a_100000229938_200015260668 [1,0,1,0,0,0|1,0,0]=3 2824 B10R0.71 CCCCCCCNCCC 2230a_100000229938_100000210303 [1,0,1,0,0,0|1,0,1]=4 2825 B10R0.71 CCCCCCCNCCO 2230a_100000229938_100000211926 [1,0,1,0,0,0|1,0,1]=4 2826 B10R0.71 CCCCCCCNCCO 2230a_100016997473_100000210681 [1,0,1,0,0,0|1,0,1]=4 2827 B10R0.71 CCCCCCCNCCO 34a_100016990907_100000210614 [1,0,1,0,0,0|1,0,1]=4 2828 B10R0.71 CCCCCCCOCC=O 34a_100000210272_200009817547 [1,0,1,0,0,0|1,0,0]=3 2829 B10R0.71 CCCCCCCOCC=O 7a_100000210272_200015260668 [1,0,1,0,0,0|1,0,0]=3 2830 B10R0.71 CCCCCCCOCCBr 34a_100000211926_100000210614 [1,0,1,0,0,0|1,0,1]=4 2831 B10R0.71 CCCCCCCOCCC 34a_100000210258_100000210614 [1,0,1,0,0,0|0,0,1]=3 2832 B10R0.71 CCCCCCCOCCC 34a_100000210272_100000210303 [1,0,1,0,0,0|0,0,1]=3 2833 B10R0.71 CCCCCCCOCCC 7a_100000210272_100000210303 [1,0,1,0,0,0|0,0,1]=3 2834 B10R0.71 CCCCCCCOCCF 34a_100000210272_100011217306 [1,0,1,0,0,0|1,0,1]=4 2835 B10R0.71 CCCCCCCOCCF 7a_100000210272_100011217306 [1,0,1,0,0,0|1,0,1]=4 2836 B10R0.71 CCCCCCCOCCN 34a_100000210304_100000210614 [1,0,1,0,0,0|1,0,1]=4 2837 B10R0.71 CCCCCCCOCCO 34a_100000210272_100000211926 [1,0,1,0,0,0|1,0,1]=4 2838 B10R0.71 CCCCCCCOCCO 7a_100000210272_100000211926 [1,0,1,0,0,0|1,0,1]=4 2839 B10R0.71 CCCCCCCOCSC 34a_100000210272_100011218213 [1,0,1,0,0,0|1,0,1]=4 2840 B10R0.71 CCCCCCCSCC=O 62a_100000210614_200015260668 [1,0,1,0,0,0|1,0,0]=3 2841 B10R0.71 CCCCCCCSCC=O 62a_200015260668_100000210316 [1,0,1,0,0,0|1,0,0]=3 2842 B10R0.71 CCCCCCCSCCC 62a_100000210303_100000210316 [1,0,1,0,0,0|0,1,1]=4 2843 B10R0.71 CCCCCCCSCCC 62a_100000210614_100000210303 [1,0,1,0,0,0|0,1,1]=4 2844 B10R0.71 CCCCCCCSCCO 62a_100000210614_100000211926 [1,0,1,0,0,0|1,0,1]=4 2845 B10R0.71 CCCCCCCSCCO 62a_100000211926_100000210316 [1,0,1,0,0,0|1,0,1]=4 2846 B10R0.71 CCCCCCNCCCO 2230a_100000210581_100000230001 [1,0,1,0,0,0|1,0,1]=4 2847 B10R0.71 CCCCCCOCCCO 34a_100000210259_100000230001 [1,0,1,0,0,0|1,0,1]=4 2848 B10R0.71 CCCCCCOCCCO 7a_100000210259_100011215043 [1,0,1,0,0,0|1,0,1]=4 2849 B10R0.71 CCCCCCSCCCO 62a_100000210314_100011215043 [1,0,1,0,0,0|1,0,1]=4 2850 B10R0.71 CCCCCCSCCCO 62a_100011215043_100000210757 [1,0,1,0,0,0|1,0,1]=4 2851 B10R0.71 CCCCCNCCCC=O 2230a_100000209983_200011292268 [1,0,1,0,0,0|1,0,0]=3 2852 B10R0.71 CCCCCNCCCCO 2230a_100000209983_100000210776 [1,0,1,0,0,0|1,0,1]=4 2853 B10R0.71 CCCCCNCCCCO 2230a_100000750430_100000210326 [1,0,1,0,0,0|1,0,1]=4 2854 B10R0.71 CCCCCNCCCCO 34a_100000750430_100000718602 [1,0,1,0,0,0|1,0,1]=4 2855 B10R0.71 CCCCCOCCCC=O 7a_100000210253_200011292268 [1,0,1,0,0,0|1,0,0]=3 2856 B10R0.71 CCCCCOCCCCO 34a_100000210253_100011216708 [1,0,1,0,0,0|1,0,1]=4 2857 B10R0.71 CCCCCOCCCCO 7a_100000210253_100000210776 [1,0,1,0,0,0|1,0,1]=4 2858 B10R0.71 CCCCCSCCCC=O 62a_100000210326_200011292268 [1,0,1,0,0,0|1,0,0]=3 2859 B10R0.71 CCCCCSCCCC=O 62a_200011292268_100000210326 [1,0,1,0,0,0|1,0,0]=3 2860 B10R0.71 CCCCCSCCCCO 62a_100000210326_100000210776 [1,0,1,0,0,0|1,0,1]=4 2861 B10R0.71 CCCCCSCCCCO 62a_100000210776_100000210326 [1,0,1,0,0,0|1,0,1]=4 2862 B10R0.71 CCCCNCCCCC=O 2230a_100000102301_100000139335 [1,0,1,0,0,0|1,0,0]=3 2863 B10R0.71 CCCCNCCCCC=O 7a_106832991798_100000139335 [1,0,1,0,0,0|1,0,0]=3 2864 B10R0.71 CCCCNCCCCCO 2230a_100000102301_100000746330 [1,0,1,0,0,0|1,0,1]=4 2865 B10R0.71 CCCCNCCCCCO 2230a_100000762737_100000210211 [1,0,1,0,0,0|1,0,1]=4 2866 B10R0.71 CCCCNCCCCCO 34a_100000762737_100000210210 [1,0,1,0,0,0|1,0,1]=4 2867 B10R0.71 CCCCNCCCCCO 7a_106832991798_100000746330 [1,0,1,0,0,0|1,0,1]=4 2868 B10R0.71 CCCCNCCOCCC 2230a_100000102301_100011215938 [1,0,1,0,0,0|1,0,1]=4 2869 B10R0.71 CCCCNCCOCCC 2230a_100161115042_100000210211 [1,0,1,0,0,0|1,0,1]=4 2870 B10R0.71 CCCCNCCOCCC 34a_100161115042_100000210210 [1,0,1,0,0,0|1,0,1]=4 2871 B10R0.71 CCCCNCCOCCC 7a_106832991798_100011215938 [1,0,1,0,0,0|1,0,1]=4 2872 B10R0.71 CCCCOCCCCC=O 7a_100000210227_100000139335 [1,0,1,0,0,0|1,0,0]=3 2873 B10R0.71 CCCCOCCCCCO 34a_100000210227_100000746330 [1,0,1,0,0,0|1,0,1]=4 2874 B10R0.71 CCCCOCCCCCO 7a_100000210227_100000746330 [1,0,1,0,0,0|1,0,1]=4 2875 B10R0.71 CCCCOCCOCC=O 34a_100000210238_200009817547 [1,0,1,0,0,0|2,0,0]=4 2876 B10R0.71 CCCCOCCOCC=O 7a_100000210238_200015260668 [1,0,1,0,0,0|2,0,0]=4 2877 B10R0.71 CCCCOCCOCCC 34a_100000210227_100011215938 [1,0,1,0,0,0|1,0,1]=4 2878 B10R0.71 CCCCOCCOCCC 34a_100000210238_100000210303 [1,0,1,0,0,0|1,0,1]=4 2879 B10R0.71 CCCCOCCOCCC 34a_100000210258_100000743108 [1,0,1,0,0,0|1,0,1]=4 2880 B10R0.71 CCCCOCCOCCC 34a_100000752267_100000210210 [1,0,1,0,0,0|1,0,1]=4 2881 B10R0.71 CCCCOCCOCCC 7a_100000210227_100011215938 [1,0,1,0,0,0|1,0,1]=4 2882 B10R0.71 CCCCOCCOCCC 7a_100000210238_100000210303 [1,0,1,0,0,0|1,0,1]=4 2883 B10R0.71 CCCCOCCOCCC 7a_100000752267_100000210211 [1,0,1,0,0,0|1,0,1]=4 2884 B10R0.71 CCCCOCCSCC=O 62a_100000743108_200015260668 [1,0,1,0,0,0|2,0,0]=4 2885 B10R0.71 CCCCOCCSCC=O 62a_200015260668_100000743108 [1,0,1,0,0,0|2,0,0]=4 2886 B10R0.71 CCCCSCCCCC=O 62a_100000139335_100000210210 [1,0,1,0,0,0|1,0,0]=3 2887 B10R0.71 CCCCSCCCCC=O 62a_100000210211_100000139335 [1,0,1,0,0,0|1,0,0]=3 2888 B10R0.71 CCCCSCCCCCO 62a_100000210211_100000746330 [1,0,1,0,0,0|1,0,1]=4 2889 B10R0.71 CCCCSCCCCCO 62a_100000746330_100000210210 [1,0,1,0,0,0|1,0,1]=4 2890 B10R0.71 CCCCSCCNCC=O 2230a_100025743550_200015260668 [1,0,1,0,0,0|2,0,0]=4 2891 B10R0.71 CCCCSCCOCC=O 34a_200000230436_200009817547 [1,0,1,0,0,0|2,0,0]=4 2892 B10R0.71 CCCCSCCOCC=O 7a_200000230436_200015260668 [1,0,1,0,0,0|2,0,0]=4 2893 B10R0.71 CCCCSCCOCCC 34a_200000230436_100000210303 [1,0,1,0,0,0|1,0,1]=4 2894 B10R0.71 CCCCSCCOCCC 62a_100000210211_100011215938 [1,0,1,0,0,0|1,0,1]=4 2895 B10R0.71 CCCCSCCOCCC 62a_100011215938_100000210210 [1,0,1,0,0,0|1,0,1]=4 2896 B10R0.71 CCCCSCCOCCC 7a_200000230436_100000210303 [1,0,1,0,0,0|1,0,1]=4 2897 B10R0.71 CCCNCCCCCCO 2230a_100000686447_100000210303 [1,0,1,0,0,0|1,0,1]=4 2898 B10R0.71 CCCNCCCCCCO 34a_100000686447_100000210303 [1,0,1,0,0,0|1,0,1]=4 2899 B10R0.71 CCCNCCCOCCC 2230a_100011217757_100000210303 [1,0,1,0,0,0|1,0,1]=4 2900 B10R0.71 CCCNCCCOCCC 34a_100011217757_100000210303 [1,0,1,0,0,0|1,0,1]=4 2901 B10R0.71 CCCOCCCCCCBr 34a_100011215345_100000210303 [1,0,1,0,0,0|1,0,1]=4 2902 B10R0.71 CCCOCCCCCCBr 7a_100011215345_100000210303 [1,0,1,0,0,0|1,0,1]=4 2903 B10R0.71 CCCOCCCCCCCl 34a_100000766143_100000210303 [1,0,1,0,0,0|1,0,1]=4 2904 B10R0.71 CCCOCCCCCCCl 7a_100000766143_100000210303 [1,0,1,0,0,0|1,0,1]=4 2905 B10R0.71 CCCOCCCCCCF 34a_100000210258_100015922095 [1,0,1,0,0,0|1,0,1]=4 2906 B10R0.71 CCCOCCCCCCF 34a_100000732779_100000210303 [1,0,1,0,0,0|1,0,1]=4 2907 B10R0.71 CCCOCCCCCCF 7a_100000732779_100000210303 [1,0,1,0,0,0|1,0,1]=4 2908 B10R0.71 CCCOCCCCCCN 34a_100000686447_100000210303 [1,0,1,0,0,0|1,0,1]=4 2909 B10R0.71 CCCOCCCCCCO 34a_100000210258_100000766143 [1,0,1,0,0,0|1,0,1]=4 2910 B10R0.71 CCCOCCCCCNC 34a_100000722520_100000210303 [1,0,1,0,0,0|1,0,1]=4 2911 B10R0.71 CCCOCCCNCC=O 2230a_100011217757_200015260668 [1,0,1,0,0,0|2,0,0]=4 2912 B10R0.71 CCCOCCCNCC=O 34a_100011217757_200009817547 [1,0,1,0,0,0|2,0,0]=4 2913 B10R0.71 CCCSCCCCCC=O 62a_100000139337_100000210303 [1,0,1,0,0,0|1,0,0]=3 2914 B10R0.71 CCCSCCCCCC=O 62a_100000210303_100000139337 [1,0,1,0,0,0|1,0,0]=3 2915 B10R0.71 CCCSCCCCCCO 62a_100000210303_100000766143 [1,0,1,0,0,0|1,0,1]=4 2916 B10R0.71 CCCSCCCCCCO 62a_100000766143_100000210303 [1,0,1,0,0,0|1,0,1]=4 2917 B10R0.71 CCNCCCCCCCO 2230a_100011996573_100000210202 [1,0,1,0,0,0|1,0,1]=4 2918 B10R0.71 CCNCCCCCCCO 2230a_100015525214_100000760002 [1,0,1,0,0,0|1,0,1]=4 2919 B10R0.71 CCNCCCCCCCO 34a_100011996573_100000210202 [1,0,1,0,0,0|1,0,1]=4 2920 B10R0.71 CCOCCCCCCCO 34a_100121572206_100000760002 [1,0,1,0,0,0|1,0,1]=4 2921 B10R0.71 CCOCCNCCCC=O 2230a_102516460346_200011292268 [1,0,1,0,0,0|2,0,0]=4 2922 B10R0.71 CCOCCOCCCC=O 7a_100000210136_200011292268 [1,0,1,0,0,0|2,0,0]=4 2923 B10R0.71 CCOCCSCCCC=O 62a_100000210147_200011292268 [1,0,1,0,0,0|2,0,0]=4 2924 B10R0.71 CCOCCSCCCC=O 62a_200011292268_100011215890 [1,0,1,0,0,0|2,0,0]=4 2925 B10R0.71 CCOCSCCCCC=O 62a_100000139335_100000739092 [1,0,1,0,0,0|2,0,0]=4 2926 B10R0.71 CCOCSCCCCC=O 62a_100000739092_100000139335 [1,0,1,0,0,0|2,0,0]=4 2927 B10R0.71 CCSCCCCCCCO 62a_100000210202_100000760002 [1,0,1,0,0,0|1,0,1]=4 2928 B10R0.71 CCSCCCCCCCO 62a_100000760002_100000210202 [1,0,1,0,0,0|1,0,1]=4 2929 B10R0.71 CCSCCNCCCC=O 2230a_100000106463_200011292268 [1,0,1,0,0,0|2,0,0]=4 2930 B10R0.71 CCSCCOCCCC=O 7a_100000212035_200011292268 [1,0,1,0,0,0|2,0,0]=4 2931 B10R0.71 CCSCCSCCCC=O 62a_100000757381_200011292268 [1,0,1,0,0,0|2,0,0]=4 2932 B10R0.71 CCSCCSCCCC=O 62a_200011292268_100000757381 [1,0,1,0,0,0|2,0,0]=4 2933 B10R0.71 CNCCCCCCCCO 2230a_102515433106_200000210301 [1,0,1,0,0,0|1,0,1]=4 2934 B10R0.71 CNCCCCCCCCO 2230a_106832991635_100000033203 [1,0,1,0,0,0|1,0,1]=4 2935 B10R0.71 CNCCCCCCCCO 34a_100102657272_100000033203 [1,0,1,0,0,0|1,0,1]=4 2936 B10R0.71 CNCCCCCCCCO 34a_102515433106_200000210301 [1,0,1,0,0,0|1,0,1]=4 2937 B10R0.71 CNCCCCCCCCO 7a_106832991635_100000033203 [1,0,1,0,0,0|1,0,1]=4 2938 B10R0.71 CNCCCCCOCC=O 34a_100000722520_200009817547 [1,0,1,0,0,0|2,0,0]=4 2939 B10R0.71 COCCCCCCCCO 34a_100138415774_100000033203 [1,0,1,0,0,0|1,0,1]=4 2940 B10R0.71 COCCCCCNCC=O 2230a_100000747528_200015260668 [1,0,1,0,0,0|2,0,0]=4 2941 B10R0.71 COCCCCCNCC=O 34a_100000747528_200009817547 [1,0,1,0,0,0|2,0,0]=4 2942 B10R0.71 COCCCSCCCC=O 62a_100000709357_200011292268 [1,0,1,0,0,0|2,0,0]=4 2943 B10R0.71 COCCCSCCCC=O 62a_200011292268_100000709357 [1,0,1,0,0,0|2,0,0]=4 2944 B10R0.71 COCCNCCCCC=O 2230a_100000209980_100000139335 [1,0,1,0,0,0|2,0,0]=4 2945 B10R0.71 COCCSCCCCC=O 62a_100000139335_100000233755 [1,0,1,0,0,0|2,0,0]=4 2946 B10R0.71 COCCSCCCCC=O 62a_100000233755_100000139335 [1,0,1,0,0,0|2,0,0]=4 2947 B10R0.71 COCSCCCCCC=O 62a_100000139337_100000766300 [1,0,1,0,0,0|2,0,0]=4 2948 B10R0.71 COCSCCCCCC=O 62a_100000766300_100000139337 [1,0,1,0,0,0|2,0,0]=4 2949 B10R0.71 CSCCCCCCCCO 62a_100000033203_200000210301 [1,0,1,0,0,0|1,0,1]=4 2950 B10R0.71 CSCCCCCCCCO 62a_200000210301_100000033203 [1,0,1,0,0,0|1,0,1]=4 2951 B10R0.71 CSCCCNCCCC=O 2230a_100000749238_200011292268 [1,0,1,0,0,0|2,0,0]=4 2952 B10R0.71 CSCCCOCCCC=O 7a_100000690336_200011292268 [1,0,1,0,0,0|2,0,0]=4 2953 B10R0.71 CSCCNCCCCC=O 2230a_100020590264_100000139335 [1,0,1,0,0,0|2,0,0]=4 2954 B10R0.71 CSCCOCCCCC=O 7a_100000230434_100000139335 [1,0,1,0,0,0|2,0,0]=4 2955 B10R0.71 CSCCSCCCCC=O 62a_100000139335_100000751147 [1,0,1,0,0,0|2,0,0]=4 2956 B10R0.71 CSCCSCCCCC=O 62a_100000212216_100000139335 [1,0,1,0,0,0|2,0,0]=4 2957 B10R0.71 CSCSCCCCCC=O 62a_100000139337_100011218213 [1,0,1,0,0,0|2,0,0]=4 2958 B10R0.71 CSCSCCCCCC=O 62a_100011218213_100000139337 [1,0,1,0,0,0|2,0,0]=4 2959 B10R0.71 NCCCCCCOCC=O 34a_100000686447_200009817547 [1,0,1,0,0,0|2,0,0]=4 2960 B10R0.71 O=CCCCCCNCCO 2230a_100016997473_100000139337 [1,0,1,0,0,0|2,0,0]=4 2961 B10R0.71 O=CCCCCCSCCF 62a_100000139337_100011217306 [1,0,1,0,0,0|2,0,0]=4 2962 B10R0.71 O=CCCCCCSCCF 62a_100011217306_100000139337 [1,0,1,0,0,0|2,0,0]=4 2963 B10R0.71 O=CCCCCCSCCO 62a_100000139337_100000211926 [1,0,1,0,0,0|2,0,0]=4 2964 B10R0.71 O=CCCCCCSCCO 62a_100000211926_100000139337 [1,0,1,0,0,0|2,0,0]=4 2965 B10R0.71 O=CCCCCNCCCF 2230a_100015189416_100000139335 [1,0,1,0,0,0|2,0,0]=4 2966 B10R0.71 O=CCCCCSCCCF 62a_100000139335_100011934791 [1,0,1,0,0,0|2,0,0]=4 2967 B10R0.71 O=CCCCCSCCCF 62a_100011934791_100000139335 [1,0,1,0,0,0|2,0,0]=4 2968 B10R0.71 O=CCCCCSCCCO 62a_100000139335_100011215043 [1,0,1,0,0,0|2,0,0]=4 2969 B10R0.71 O=CCCCCSCCCO 62a_100011215043_100000139335 [1,0,1,0,0,0|2,0,0]=4 2970 B10R0.71 O=CCCCNCCCCO 2230a_100000750430_200011292268 [1,0,1,0,0,0|2,0,0]=4 2971 B10R0.71 O=CCCCOCCCCCl 7a_100000210776_200011292268 [1,0,1,0,0,0|2,0,0]=4 2972 B10R0.71 O=CCCCOCCCCF 7a_100011995726_200011292268 [1,0,1,0,0,0|2,0,0]=4 2973 B10R0.71 O=CCCCSCCCCF 62a_100000729493_200011292268 [1,0,1,0,0,0|2,0,0]=4 2974 B10R0.71 O=CCCCSCCCCF 62a_200011292268_100000729493 [1,0,1,0,0,0|2,0,0]=4 2975 B10R0.71 O=CCCCSCCCCO 62a_100000210776_200011292268 [1,0,1,0,0,0|2,0,0]=4 2976 B10R0.71 O=CCCCSCCCCO 62a_200011292268_100000210776 [1,0,1,0,0,0|2,0,0]=4 2977 B10R0.71 O=CCNCCCCCCO 2230a_100000686447_200015260668 [1,0,1,0,0,0|2,0,0]=4 2978 B10R0.71 O=CCNCCCCCCO 34a_100000686447_200009817547 [1,0,1,0,0,0|2,0,0]=4 2979 B10R0.71 O=CCOCCCCCCBr 34a_100011215345_200009817547 [1,0,1,0,0,0|2,0,0]=4 2980 B10R0.71 O=CCOCCCCCCBr 7a_100011215345_200015260668 [1,0,1,0,0,0|2,0,0]=4 2981 B10R0.71 O=CCOCCCCCCCl 34a_100000766143_200009817547 [1,0,1,0,0,0|2,0,0]=4 2982 B10R0.71 O=CCOCCCCCCCl 7a_100000766143_200015260668 [1,0,1,0,0,0|2,0,0]=4 2983 B10R0.71 O=CCOCCCCCCF 34a_100000732779_200009817547 [1,0,1,0,0,0|2,0,0]=4 2984 B10R0.71 O=CCOCCCCCCF 7a_100000732779_200015260668 [1,0,1,0,0,0|2,0,0]=4 2985 B10R0.71 O=CCSCCCCCCF 62a_100015922095_200015260668 [1,0,1,0,0,0|2,0,0]=4 2986 B10R0.71 O=CCSCCCCCCF 62a_200015260668_100015922095 [1,0,1,0,0,0|2,0,0]=4 2987 B10R0.71 O=CCSCCCCCCO 62a_100000766143_200015260668 [1,0,1,0,0,0|2,0,0]=4 2988 B10R0.71 O=CCSCCCCCCO 62a_200015260668_100000766143 [1,0,1,0,0,0|2,0,0]=4 2989 B10R0.71 [13CH3]NCCCCCCCCO 2230a_102515433106_200025704644 [1,0,1,0,0,0|1,0,1]=4 2990 B10R0.71 [13CH3]NCCCCCCCCO 34a_102515433106_200025704644 [1,0,1,0,0,0|1,0,1]=4 2991 B10R0.71 [13CH3]SCCCCCCCCO 62a_100000033203_200025704644 [1,0,1,0,0,0|1,0,1]=4 2992 B10R0.71 [13CH3]SCCCCCCCCO 62a_200025704644_100000033203 [1,0,1,0,0,0|1,0,1]=4 2993 B10R0.74 C#CC(=O)CCCCCCC 1458a_100000211873_100000210614 [1,0,1,0,0,0|0,0,2]=4 2994 B10R0.74 C#CCCCCCC(=O)CC 1458a_100000210414_100012094781 [1,0,1,0,0,0|0,0,2]=4 2995 B10R0.74 C#CCCCCCC(=O)CC 1458a_100000694772_100000210202 [1,0,1,0,0,0|0,0,2]=4 2996 B10R0.74 C=CC(=O)CCCCCCC 1458a_100000185746_100000210614 [1,0,1,0,0,0|0,0,2]=4 2997 B10R0.74 C=CCCCCCC(=O)CC 1458a_100000210414_100000700193 [1,0,1,0,0,0|0,0,2]=4 2998 B10R0.74 C=CCCCCCC(=O)CC 1458a_100011934241_100000210202 [1,0,1,0,0,0|0,0,2]=4 2999 B10R0.74 CCC(=O)CCCCCC#N 1458a_100000210414_100009813376 [1,0,1,0,0,0|1,0,1]=4 3000 B10R0.74 CCC(=O)CCCCCCF 1458a_100000210414_100015922095 [1,0,1,0,0,0|1,0,0]=3 3001 B10R0.74 CCC(=O)CCCCCCO 1458a_100000210414_100000766143 [1,0,1,0,0,0|1,0,0]=3 3002 B10R0.74 CCC(=O)CCCCCCO 1458a_100011996774_100000210202 [1,0,1,0,0,0|1,0,0]=3 3003 B10R0.74 CCC(=O)CCCCCOC 1458a_100011935119_100000210202 [1,0,1,0,0,0|1,0,0]=3 3004 B10R0.74 CCC(=O)CCOCCOC 1458a_100000210414_100000695917 [1,0,1,0,0,0|2,0,0]=4 3005 B10R0.74 CCC(=O)CCOCCOC 1458a_100000745395_100000210202 [1,0,1,0,0,0|2,0,0]=4 3006 B10R0.74 CCC(=O)COCCCCCl 7a_100000210776_100000747405 [1,0,1,0,0,0|2,0,0]=4 3007 B10R0.74 CCC(=O)COCCCCF 34a_100000725409_100000729493 [1,0,1,0,0,0|2,0,0]=4 3008 B10R0.74 CCC(=O)COCCCCF 7a_100011995726_100000747405 [1,0,1,0,0,0|2,0,0]=4 3009 B10R0.74 CCC(=O)COCCCCO 34a_100000725409_100011216708 [1,0,1,0,0,0|2,0,0]=4 3010 B10R0.74 CCC(=O)COCCCOC 34a_100000725409_100000740836 [1,0,1,0,0,0|2,0,0]=4 3011 B10R0.74 CCC(=O)COCCCSC 7a_100000690336_100000747405 [1,0,1,0,0,0|2,0,0]=4 3012 B10R0.74 CCC(=O)CSCCCCF 62a_100000729493_100000747405 [1,0,1,0,0,0|2,0,0]=4 3013 B10R0.74 CCC(=O)CSCCCCF 62a_100000747405_100000729493 [1,0,1,0,0,0|2,0,0]=4 3014 B10R0.74 CCC(=O)CSCCCCO 62a_100000210776_100000747405 [1,0,1,0,0,0|2,0,0]=4 3015 B10R0.74 CCC(=O)CSCCCCO 62a_100000747405_100000210776 [1,0,1,0,0,0|2,0,0]=4 3016 B10R0.74 CCC(=O)CSCCCOC 62a_100000709357_100000747405 [1,0,1,0,0,0|2,0,0]=4 3017 B10R0.74 CCC(=O)CSCCCOC 62a_100000747405_100000709357 [1,0,1,0,0,0|2,0,0]=4 3018 B10R0.74 CCC(=O)NCCCCCO 240690a_100000762737_100000210414 [1,0,1,0,0,0|2,0,0]=4 3019 B10R0.74 CCC(=O)OCCOCCF 7a_200000031056_100011217306 [1,0,1,0,0,0|2,0,0]=4 3020 B10R0.74 CCC(=O)OCCOCCO 7a_200000031056_100000211926 [1,0,1,0,0,0|2,0,0]=4 3021 B10R0.74 CCCC/C=C/CC(=O)CC 1458a_200016282684_100000210202 [1,0,1,0,0,0|0,0,2]=4 3022 B10R0.74 CCCCCC#CC(=O)CC 1458a_100011215388_100000210202 [1,0,1,0,0,0|0,0,2]=4 3023 B10R0.74 CCCCCC=CC(=O)CC 1458a_100016263427_100000210202 [1,0,1,0,0,0|0,0,2]=4 3024 B10R0.74 CCCCCCCC(=O)CC 1458a_100000210414_100000210614 [1,0,1,0,0,0|0,0,0]=2 3025 B10R0.74 CCCCCCCC(=O)CC 1458a_100000211969_100000210202 [1,0,1,0,0,0|0,0,0]=2 3026 B10R0.74 CCCCCCCC(=O)CF 1458a_100000211969_100015361967 [1,0,1,0,0,0|1,0,0]=3 3027 B10R0.74 CCCCCCCC(=O)CO 1458a_100000210174_100000210614 [1,0,1,0,0,0|1,0,0]=3 3028 B10R0.74 CCCCCCCC(=O)NC 11a_106832991635_100000211969 [1,0,1,0,0,0|1,0,0]=3 3029 B10R0.74 CCCCCCCC(=O)NC 1626a_100102657272_100000211969 [1,0,1,0,0,0|1,0,0]=3 3030 B10R0.74 CCCCCCCC(=O)NC 240690a_100102657272_100000211969 [1,0,1,0,0,0|1,0,0]=3 3031 B10R0.74 CCCCCCCC(=O)NC 527a_100102657272_100000211969 [1,0,1,0,0,0|1,0,0]=3 3032 B10R0.74 CCCCCCCN(C)CC 2230a_100000225621_100000210681 [1,0,1,0,0,0|2,0,0]=4 3033 B10R0.74 CCCCCCCN(C)CC 2230a_100000228206_100000210202 [1,0,1,0,0,0|2,0,0]=4 3034 B10R0.74 CCCCCCCN(C)CC 2230a_100000228213_200000210301 [1,0,1,0,0,0|2,0,0]=4 3035 B10R0.74 CCCCCCCN(C)CC 269982a_100000225621_100000210681 [1,0,1,0,0,0|2,0,0]=4 3036 B10R0.74 CCCCCCCN(C)CC 269982a_100000228206_100000204670 [1,0,1,0,0,0|2,0,0]=4 3037 B10R0.74 CCCCCCCN(C)CC 269982a_100000228213_200000210301 [1,0,1,0,0,0|2,0,0]=4 3038 B10R0.74 CCCCCCCN([13CH3])CC 2230a_100000228213_200025704644 [1,0,1,0,0,0|2,0,0]=4 3039 B10R0.74 CCCCCCCN([13CH3])CC 269982a_100000228213_200025704644 [1,0,1,0,0,0|2,0,0]=4 3040 B10R0.74 CCCCCCNC(=O)CC 11a_100000210581_100000210414 [1,0,1,0,0,0|1,0,0]=3 3041 B10R0.74 CCCCCCNC(=O)CC 1626a_100000210581_100000210414 [1,0,1,0,0,0|1,0,0]=3 3042 B10R0.74 CCCCCCNC(=O)CC 240690a_100000210581_100000210414 [1,0,1,0,0,0|1,0,0]=3 3043 B10R0.74 CCCCCCNC(=O)CC 527a_100000210581_100000210414 [1,0,1,0,0,0|1,0,0]=3 3044 B10R0.74 CCCCCCNC(=O)CO 240690a_100000210581_100000210174 [1,0,1,0,0,0|2,0,0]=4 3045 B10R0.74 CCCCCCNC(=O)CO 527a_100000210581_100000210174 [1,0,1,0,0,0|2,0,0]=4 3046 B10R0.74 CCCCCCNC(=O)NC 2708a_100000210581_106832991635 [1,0,1,0,0,0|2,0,0]=4 3047 B10R0.74 CCCCCCNC(=O)NC 2708a_100102657272_100000210581 [1,0,1,0,0,0|2,0,0]=4 3048 B10R0.74 CCCCCCNC(=O)NC 273464a_100000210581_100102657272 [1,0,1,0,0,0|2,0,0]=4 3049 B10R0.74 CCCCCCNC(=O)NC 273464a_100102657272_100000210581 [1,0,1,0,0,0|2,0,0]=4 3050 B10R0.74 CCCCCCNC(=O)NC 512a_100000210581_100102657272 [1,0,1,0,0,0|2,0,0]=4 3051 B10R0.74 CCCCCCNC(=O)NC 512a_106832991638_100000210581 [1,0,1,0,0,0|2,0,0]=4 3052 B10R0.74 CCCCCCOC(C)CC 34a_100000210259_100011215416 [1,0,1,0,0,0|1,0,1]=4 3053 B10R0.74 CCCCCCOC(C)CC 7a_100000210228_100000210314 [1,0,1,0,0,0|1,0,1]=4 3054 B10R0.74 CCCCCCOC(C)CC 7a_100000210259_100000758301 [1,0,1,0,0,0|1,0,1]=4 3055 B10R0.74 CCCCCNCC(=O)NC 2230a_100000209983_100000183359 [1,0,1,0,0,0|2,0,0]=4 3056 B10R0.74 CCCCCNCC(=O)NC 2230a_100000693194_100000210326 [1,0,1,0,0,0|2,0,0]=4 3057 B10R0.74 CCCCCNCC(=O)OC 2230a_100000209983_100000747449 [1,0,1,0,0,0|2,0,0]=4 3058 B10R0.74 CCCCCNNC(=O)CC 22a_100000694160_100000210414 [1,0,1,0,0,0|2,0,0]=4 3059 B10R0.74 CCCCCOCC(=O)CC 34a_100000725409_100000718602 [1,0,1,0,0,0|1,0,0]=3 3060 B10R0.74 CCCCCOCC(=O)CC 7a_100000210253_100000747405 [1,0,1,0,0,0|1,0,0]=3 3061 B10R0.74 CCCCCOCC(=O)NC 34a_100000210253_100000183359 [1,0,1,0,0,0|2,0,0]=4 3062 B10R0.74 CCCCCOCC(=O)NC 34a_100000750040_100000718602 [1,0,1,0,0,0|2,0,0]=4 3063 B10R0.74 CCCCCOCC(=O)NC 7a_100000210253_100000183359 [1,0,1,0,0,0|2,0,0]=4 3064 B10R0.74 CCCCCOCC(=O)OC 34a_100000210253_100000747449 [1,0,1,0,0,0|2,0,0]=4 3065 B10R0.74 CCCCCOCC(=O)OC 7a_100000210253_100000747449 [1,0,1,0,0,0|2,0,0]=4 3066 B10R0.74 CCCCCSCC(=O)CC 62a_100000210326_100000747405 [1,0,1,0,0,0|1,0,0]=3 3067 B10R0.74 CCCCCSCC(=O)CC 62a_100000747405_100000210326 [1,0,1,0,0,0|1,0,0]=3 3068 B10R0.74 CCCCCSCC(=O)NC 62a_100000183359_100000210326 [1,0,1,0,0,0|2,0,0]=4 3069 B10R0.74 CCCCCSCC(=O)NC 62a_100000210326_100000183359 [1,0,1,0,0,0|2,0,0]=4 3070 B10R0.74 CCCCCSCC(=O)OC 62a_100000210326_100000747449 [1,0,1,0,0,0|2,0,0]=4 3071 B10R0.74 CCCCCSCC(=O)OC 62a_100000747449_100000210326 [1,0,1,0,0,0|2,0,0]=4 3072 B10R0.74 CCCCNCCC(=O)NC 2230a_100000102301_100000737683 [1,0,1,0,0,0|2,0,0]=4 3073 B10R0.74 CCCCNCCC(=O)NC 2230a_100000738227_100000210211 [1,0,1,0,0,0|2,0,0]=4 3074 B10R0.74 CCCCNCCC(=O)NC 34a_100000738227_100000210210 [1,0,1,0,0,0|2,0,0]=4 3075 B10R0.74 CCCCNCCC(=O)NC 7a_106832991798_100000737683 [1,0,1,0,0,0|2,0,0]=4 3076 B10R0.74 CCCCNCCC(=O)OC 2230a_100000102301_100000204255 [1,0,1,0,0,0|2,0,0]=4 3077 B10R0.74 CCCCNCCC(=O)OC 7a_106832991798_100000204255 [1,0,1,0,0,0|2,0,0]=4 3078 B10R0.74 CCCCOCCC(=O)CC 1458a_100000210414_100000743108 [1,0,1,0,0,0|1,0,0]=3 3079 B10R0.74 CCCCOCCC(=O)CO 1458a_100000210174_100000743108 [1,0,1,0,0,0|2,0,0]=4 3080 B10R0.74 CCCCOCCC(=O)NC 34a_100000210227_100012179268 [1,0,1,0,0,0|2,0,0]=4 3081 B10R0.74 CCCCOCCC(=O)NC 34a_100000754576_100000210210 [1,0,1,0,0,0|2,0,0]=4 3082 B10R0.74 CCCCOCCC(=O)NC 7a_100000210227_100000737683 [1,0,1,0,0,0|2,0,0]=4 3083 B10R0.74 CCCCOCCC(=O)OC 34a_100000210227_100000742370 [1,0,1,0,0,0|2,0,0]=4 3084 B10R0.74 CCCCOCCC(=O)OC 7a_100000210227_100000204255 [1,0,1,0,0,0|2,0,0]=4 3085 B10R0.74 CCCCSCCC(=O)NC 62a_100000210211_100000737683 [1,0,1,0,0,0|2,0,0]=4 3086 B10R0.74 CCCCSCCC(=O)NC 62a_100000737683_100000210210 [1,0,1,0,0,0|2,0,0]=4 3087 B10R0.74 CCCCSCCC(=O)OC 62a_100000204255_100000210210 [1,0,1,0,0,0|2,0,0]=4 3088 B10R0.74 CCCCSCCC(=O)OC 62a_100000210211_100000204255 [1,0,1,0,0,0|2,0,0]=4 3089 B10R0.74 CCCCSCOC(=O)OC 62a_100000210211_100000139417 [1,0,1,0,0,0|2,0,0]=4 3090 B10R0.74 CCCNCCCC(=O)NC 2230a_100000740002_100000210303 [1,0,1,0,0,0|2,0,0]=4 3091 B10R0.74 CCCNCCCC(=O)NC 34a_100000740002_100000210303 [1,0,1,0,0,0|2,0,0]=4 3092 B10R0.74 CCCNCCNC(=O)CC 34a_100132302217_100000210303 [1,0,1,0,0,0|2,0,0]=4 3093 B10R0.74 CCCOCCCC(=O)NC 34a_100000210258_100000741757 [1,0,1,0,0,0|2,0,0]=4 3094 B10R0.74 CCCOCCCC(=O)OC 34a_100000210258_100000742333 [1,0,1,0,0,0|2,0,0]=4 3095 B10R0.74 CCCOCCNC(=O)CC 1626a_100161115042_100000210414 [1,0,1,0,0,0|2,0,0]=4 3096 B10R0.74 CCCOCCNC(=O)CC 240690a_100161115042_100000210414 [1,0,1,0,0,0|2,0,0]=4 3097 B10R0.74 CCCOCCNC(=O)CC 34a_200000158885_100000210303 [1,0,1,0,0,0|2,0,0]=4 3098 B10R0.74 CCCOCCNC(=O)CC 527a_100161115042_100000210414 [1,0,1,0,0,0|2,0,0]=4 3099 B10R0.74 CCCOCCNC(=O)CC 7a_200000158885_100000210303 [1,0,1,0,0,0|2,0,0]=4 3100 B10R0.74 CCCOCCOC(=O)CC 7a_200000031056_100000210303 [1,0,1,0,0,0|1,0,0]=3 3101 B10R0.74 CCCOCCOC(=O)NC 34a_100000210258_200011997002 [1,0,1,0,0,0|2,0,0]=4 3102 B10R0.74 CCCOCCOC(=O)OC 34a_100010262106_100000210303 [1,0,1,0,0,0|2,0,0]=4 3103 B10R0.74 CCCSCCCC(=O)NC 62a_100000210303_100000741757 [1,0,1,0,0,0|2,0,0]=4 3104 B10R0.74 CCCSCCCC(=O)NC 62a_100000741757_100000210303 [1,0,1,0,0,0|2,0,0]=4 3105 B10R0.74 CCCSCCCC(=O)OC 62a_100000210303_100011218270 [1,0,1,0,0,0|2,0,0]=4 3106 B10R0.74 CCCSCCCC(=O)OC 62a_100011218270_100000210303 [1,0,1,0,0,0|2,0,0]=4 3107 B10R0.74 CCCSCCNC(=O)CC 11a_100020603323_100000210414 [1,0,1,0,0,0|2,0,0]=4 3108 B10R0.74 CCCSCCNC(=O)CC 240690a_100020603323_100000210414 [1,0,1,0,0,0|2,0,0]=4 3109 B10R0.74 CCCSCCNC(=O)CC 527a_100020603323_100000210414 [1,0,1,0,0,0|2,0,0]=4 3110 B10R0.74 CCCSCCOC(=O)NC 62a_100000210303_200011997002 [1,0,1,0,0,0|2,0,0]=4 3111 B10R0.74 CCCSCCOC(=O)NC 62a_200011997002_100000210303 [1,0,1,0,0,0|2,0,0]=4 3112 B10R0.74 CCNCCCCC(=O)OC 2230a_100015525214_100000204269 [1,0,1,0,0,0|2,0,0]=4 3113 B10R0.74 CCOCCCCC(=O)OC 34a_100000059025_100000210202 [1,0,1,0,0,0|2,0,0]=4 3114 B10R0.74 CCOCCCCC(=O)OC 34a_100121572206_100000204269 [1,0,1,0,0,0|2,0,0]=4 3115 B10R0.74 CCOCCCCC(=O)OC 7a_100000059025_100000210202 [1,0,1,0,0,0|2,0,0]=4 3116 B10R0.74 CCOCCCNC(=O)CC 11a_100000210961_100000210414 [1,0,1,0,0,0|2,0,0]=4 3117 B10R0.74 CCOCCCNC(=O)CC 1626a_100000210961_100000210414 [1,0,1,0,0,0|2,0,0]=4 3118 B10R0.74 CCOCCCNC(=O)CC 240690a_100000210961_100000210414 [1,0,1,0,0,0|2,0,0]=4 3119 B10R0.74 CCOCCCNC(=O)CC 527a_100000210961_100000210414 [1,0,1,0,0,0|2,0,0]=4 3120 B10R0.74 CCOCCOCC(=O)CC 34a_100000725409_100000210147 [1,0,1,0,0,0|2,0,0]=4 3121 B10R0.74 CCOCCOCC(=O)CC 7a_100000210136_100000747405 [1,0,1,0,0,0|2,0,0]=4 3122 B10R0.74 CCOCCSCC(=O)CC 62a_100000210147_100000747405 [1,0,1,0,0,0|2,0,0]=4 3123 B10R0.74 CCOCCSCC(=O)CC 62a_100000747405_100011215890 [1,0,1,0,0,0|2,0,0]=4 3124 B10R0.74 CCSCCCCC(=O)OC 62a_100000204269_100000210202 [1,0,1,0,0,0|2,0,0]=4 3125 B10R0.74 CCSCCCCC(=O)OC 62a_100000210202_100000204269 [1,0,1,0,0,0|2,0,0]=4 3126 B10R0.74 CCSCCOCC(=O)CC 34a_100000725409_100000757381 [1,0,1,0,0,0|2,0,0]=4 3127 B10R0.74 CCSCCOCC(=O)CC 7a_100000212035_100000747405 [1,0,1,0,0,0|2,0,0]=4 3128 B10R0.74 CCSCCSCC(=O)CC 62a_100000747405_100000757381 [1,0,1,0,0,0|2,0,0]=4 3129 B10R0.74 CCSCCSCC(=O)CC 62a_100000757381_100000747405 [1,0,1,0,0,0|2,0,0]=4 3130 B10R0.74 CNC(=O)CCCCCCO 240690a_100102657272_100011996774 [1,0,1,0,0,0|2,0,0]=4 3131 B10R0.74 CNC(=O)CCCCCOC 11a_106832991635_100011935119 [1,0,1,0,0,0|2,0,0]=4 3132 B10R0.74 CNC(=O)CCCCCOC 1626a_100102657272_100011935119 [1,0,1,0,0,0|2,0,0]=4 3133 B10R0.74 CNC(=O)CCCCCOC 240690a_100102657272_100011935119 [1,0,1,0,0,0|2,0,0]=4 3134 B10R0.74 CNC(=O)CCCCCOC 527a_100102657272_100011935119 [1,0,1,0,0,0|2,0,0]=4 3135 B10R0.74 CNCCCCCC(=O)OC 2230a_106832991635_100009816466 [1,0,1,0,0,0|2,0,0]=4 3136 B10R0.74 CNCCCCCC(=O)OC 34a_100102657272_100009816466 [1,0,1,0,0,0|2,0,0]=4 3137 B10R0.74 CNCCCCCC(=O)OC 7a_106832991635_100009816466 [1,0,1,0,0,0|2,0,0]=4 3138 B10R0.74 COC(=O)CCCCCO[13CH3] 34a_100000074720_200025704644 [1,0,1,0,0,0|2,0,0]=4 3139 B10R0.74 COC(=O)CCCCCO[13CH3] 7a_100000074720_200025704644 [1,0,1,0,0,0|2,0,0]=4 3140 B10R0.74 COC(=O)CCCCCSC 62a_100009816466_200000210301 [1,0,1,0,0,0|2,0,0]=4 3141 B10R0.74 COC(=O)CCCCCSC 62a_200000210301_100009816466 [1,0,1,0,0,0|2,0,0]=4 3142 B10R0.74 COC(=O)CCCCCS[13CH3] 62a_100009816466_200025704644 [1,0,1,0,0,0|2,0,0]=4 3143 B10R0.74 COC(=O)CCCCCS[13CH3] 62a_200025704644_100009816466 [1,0,1,0,0,0|2,0,0]=4 3144 B10R0.74 COCCCCCC(=O)CF 1458a_100011935119_100015361967 [1,0,1,0,0,0|2,0,0]=4 3145 B10R0.74 COCCCCCC(=O)OC 34a_100000074720_200000210301 [1,0,1,0,0,0|2,0,0]=4 3146 B10R0.74 COCCCCCC(=O)OC 34a_100138415774_100009816466 [1,0,1,0,0,0|2,0,0]=4 3147 B10R0.74 COCCCCCC(=O)OC 7a_100000074720_200000210301 [1,0,1,0,0,0|2,0,0]=4 3148 B10R0.74 O=C(CF)CCCCCCO 1458a_100011996774_100015361967 [1,0,1,0,0,0|2,0,0]=4 3149 B10R0.74 O=C(CO)CCCCCCF 1458a_100000210174_100015922095 [1,0,1,0,0,0|2,0,0]=4 3150 B10R0.74 O=C(CO)CCCCCCO 1458a_100000210174_100000766143 [1,0,1,0,0,0|2,0,0]=4 3151 B10R0.91 CCCCCC(C)NCC=O 2230a_100000211957_200015260668 [1,0,1,0,0,0|2,0,0]=4 3152 B10R0.91 CCCCCC(C)OCC=O 34a_100011215632_200009817547 [1,0,1,0,0,0|2,0,0]=4 3153 B10R0.91 CCCCCC(C)OCC=O 7a_100011215632_200015260668 [1,0,1,0,0,0|2,0,0]=4 3154 B10R0.91 CCCCCC(C)SCC=O 62a_200011218191_200015260668 [1,0,1,0,0,0|2,0,0]=4 3155 B10R0.91 CCCCCC(C)SCC=O 62a_200015260668_200011218191 [1,0,1,0,0,0|2,0,0]=4 3156 B10R0.24 CCCCCC(CC)OCC 34a_100011215405_100000210202 [1,0,1,0,0,0|1,0,1]=4 3157 B10R0.24 CCCCCC(CC)OCC 7a_100011215405_100000210202 [1,0,1,0,0,0|1,0,1]=4 3158 B10R0.24 CCCCCC(CC)OCF 34a_100011215405_100015361967 [1,0,1,0,0,0|1,0,1]=4 3159 B10R0.24 CCCCCC(CC)OCF 7a_100011215405_100015361967 [1,0,1,0,0,0|1,0,1]=4 3160 B10R0.41 C=CC(CC)OCCCCC 34a_100000766422_100000718602 [1,0,1,0,0,0|2,0,0]=4 3161 B10R0.41 C=CC(CC)OCCCCC 7a_100000766422_100000210326 [1,0,1,0,0,0|2,0,0]=4 3162 B10R0.41 C=CC(CCCCCC)OC 34a_200011215977_200000210301 [1,0,1,0,0,0|2,0,0]=4 3163 B10R0.41 C=CC(CCCCCC)OC 7a_200011215977_200000210301 [1,0,1,0,0,0|2,0,0]=4 3164 B10R0.41 C=CC(CCCCCC)O[13CH3] 34a_200011215977_200025704644 [1,0,1,0,0,0|2,0,0]=4 3165 B10R0.41 C=CC(CCCCCC)O[13CH3] 7a_200011215977_200025704644 [1,0,1,0,0,0|2,0,0]=4 3166 B10R0.41 CCCCCCC(CC)NC 270004a_106832991635_100011219640 [1,0,1,0,0,0|1,0,1]=4 3167 B10R0.41 CCCCCCC(CC)OC 34a_100011215785_200000210301 [1,0,1,0,0,0|0,0,1]=3 3168 B10R0.41 CCCCCCC(CC)OC 7a_100011215785_200000210301 [1,0,1,0,0,0|0,0,1]=3 3169 B10R0.41 CCCCCCC(CC)O[13CH3] 34a_100011215785_200025704644 [1,0,1,0,0,0|0,0,1]=3 3170 B10R0.41 CCCCCCC(CC)O[13CH3] 7a_100011215785_200025704644 [1,0,1,0,0,0|0,0,1]=3 3171 B10R0.41 CCCCOCC(CC)OC 34a_100011934954_100000210210 [1,0,1,0,0,0|1,0,1]=4 3172 B10R0.41 CCCCOCC(CC)OC 7a_100011934954_100000210211 [1,0,1,0,0,0|1,0,1]=4 3173 B10R1.21 CCCCOC1CCCO1 34a_100000085407_100000210210 [2,0,0,0,0,0|1,0,1]=4 3174 B10R1.21 CCCNC[C@@H]1CCCO1 2230a_100020590478_100000210303 [2,0,0,0,0,0|1,0,1]=4 3175 B10R1.21 CCCNC[C@@H]1CCCO1 34a_100020590478_100000210303 [2,0,0,0,0,0|1,0,1]=4 3176 B10R1.21 CCCOCC1CCCO1 34a_100000210270_100000210303 [2,0,0,0,0,0|1,0,1]=4 3177 B10R1.21 CCCOCC1CCCO1 7a_100000210270_100000210303 [2,0,0,0,0,0|1,0,1]=4 3178 B10R1.21 CCCSCC1CCCO1 62a_100000203698_100000210303 [2,0,0,0,0,0|1,0,1]=4 3179 B10R1.21 CCCSCC1CCCO1 62a_100000210303_100000203698 [2,0,0,0,0,0|1,0,1]=4 3180 B10R1.16 CCCOC1CCC(=O)C1 34a_100012614533_100000210303 [2,0,0,0,0,0|2,0,0]=4 3181 B10R1.16 CCCOC1COC(=O)O1 34a_100000210258_100000032252 [2,0,0,0,0,0|2,0,0]=4 3182 B10R1.16 CCCSC1COC(=O)O1 62a_100000210303_100000032252 [2,0,0,0,0,0|2,0,0]=4 3183 B10R1.16 CCNCC1CNC(=O)O1 2230a_100015525214_100000181169 [2,0,0,0,0,0|2,0,0]=4 3184 B10R1.16 CCNC[C@@H]1CCC(=O)N1 2230a_100015525214_100015189358 [2,0,0,0,0,0|2,0,0]=4 3185 B10R1.16 CCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000210202 [2,0,0,0,0,0|2,0,0]=4 3186 B10R1.16 CCNC[C@H]1CCC(=O)N1 34a_100015423886_100000210202 [2,0,0,0,0,0|2,0,0]=4 3187 B10R1.16 CCOCC1CCC(=O)N1 34a_100000737831_100000210202 [2,0,0,0,0,0|2,0,0]=4 3188 B10R1.16 CCOCC1CNC(=O)O1 34a_100011315639_100000210202 [2,0,0,0,0,0|2,0,0]=4 3189 B10R1.16 CCOCC1CNC(=O)O1 34a_100121572206_100000181169 [2,0,0,0,0,0|2,0,0]=4 3190 B10R1.16 CCOCC1COC(=O)O1 34a_100121572206_100000073702 [2,0,0,0,0,0|2,0,0]=4 3191 B10R1.16 CCSCC1CNC(=O)O1 62a_100000181169_100000210202 [2,0,0,0,0,0|2,0,0]=4 3192 B10R1.16 CCSCC1CNC(=O)O1 62a_100000210202_100000181169 [2,0,0,0,0,0|2,0,0]=4 3193 B10R1.16 CCSCC1COC(=O)O1 62a_100000073702_100000210202 [2,0,0,0,0,0|2,0,0]=4 3194 B10R1.16 CCSCC1COC(=O)O1 62a_100000210202_100000073702 [2,0,0,0,0,0|2,0,0]=4 3195 B10R1.16 CCSC[C@@H]1CCC(=O)N1 62a_100000210202_100015189358 [2,0,0,0,0,0|2,0,0]=4 3196 B10R1.16 CCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000210202 [2,0,0,0,0,0|2,0,0]=4 3197 B12R0.2 CCCCC(C)SC(C)OC(=O)C 62a_100009818208_200011215066 [0,1,1,0,0,0|1,0,0]=3 3198 B12R0.2 CCCCC(C)SC(C)OC(=O)C 62a_200011215066_100009818208 [0,1,1,0,0,0|1,0,0]=3 3199 B12R0.4 C#CCCCCSC(C)OC(=O)C 62a_100009818208_100010269958 [0,1,1,0,0,0|0,0,2]=4 3200 B12R0.4 C#CCCCCSC(C)OC(=O)C 62a_100010269958_100009818208 [0,1,1,0,0,0|0,0,2]=4 3201 B12R0.4 C=CCCCCSC(C)OC(=O)C 62a_100009818208_100011215482 [0,1,1,0,0,0|0,0,2]=4 3202 B12R0.4 C=CCCCCSC(C)OC(=O)C 62a_100011215482_100009818208 [0,1,1,0,0,0|0,0,2]=4 3203 B12R0.4 CC(=O)OC(C)SCCCCC#N 62a_100009818208_100000211819 [0,1,1,0,0,0|1,0,1]=4 3204 B12R0.4 CC(=O)OC(C)SCCCCC#N 62a_100011219923_100009818208 [0,1,1,0,0,0|1,0,1]=4 3205 B12R0.4 CC(=O)OC(C)SCCCCC=O 62a_100000139335_100009818208 [0,1,1,0,0,0|1,0,1]=4 3206 B12R0.4 CC(=O)OC(C)SCCCCC=O 62a_100009818208_100000139335 [0,1,1,0,0,0|1,0,1]=4 3207 B12R0.4 CC(=O)OC(C)SCCCCCF 62a_100000729378_100009818208 [0,1,1,0,0,0|1,0,0]=3 3208 B12R0.4 CC(=O)OC(C)SCCCCCF 62a_100009818208_100000729378 [0,1,1,0,0,0|1,0,0]=3 3209 B12R0.4 CC(=O)OC(C)SCCCCCO 62a_100000746330_100009818208 [0,1,1,0,0,0|1,0,0]=3 3210 B12R0.4 CC(=O)OC(C)SCCCCCO 62a_100009818208_100000746330 [0,1,1,0,0,0|1,0,0]=3 3211 B12R0.4 CC(=O)OC(C)SCCOCCO 62a_100009818208_100011215305 [0,1,1,0,0,0|2,0,0]=4 3212 B12R0.4 CC(=O)OC(C)SCCOCCO 62a_100011215305_100009818208 [0,1,1,0,0,0|2,0,0]=4 3213 B12R0.4 CC/C=C\CCSC(C)OC(=O)C 62a_100009818208_100015370543 [0,1,1,0,0,0|0,0,2]=4 3214 B12R0.4 CC/C=C\CCSC(C)OC(=O)C 62a_100015370543_100009818208 [0,1,1,0,0,0|0,0,2]=4 3215 B12R0.4 CCCCCCCC(C)OC(C)C 34a_100000212225_200011218727 [0,1,1,0,0,0|1,0,1]=4 3216 B12R0.4 CCCCCCCC(C)OC(C)C 34a_200011215852_100000210206 [0,1,1,0,0,0|1,0,1]=4 3217 B12R0.4 CCCCCCCC(C)OC(C)C 7a_200011215852_100000210206 [0,1,1,0,0,0|1,0,1]=4 3218 B12R0.4 CCCCCCCC(O)CC(=O)C 1458a_200011667753_200000210301 [0,1,1,0,0,0|2,0,0]=4 3219 B12R0.4 CCCCCCCC(O)CC(=O)[13CH3] 1458a_200011667753_200025704644 [0,1,1,0,0,0|2,0,0]=4 3220 B12R0.4 CCCCCCOC(C)C=C(C)C 34a_100000717055_100000210314 [0,1,1,0,0,0|2,0,0]=4 3221 B12R0.4 CCCCCCSC(C)OC(=O)C 62a_100000210314_100009818208 [0,1,1,0,0,0|0,0,0]=2 3222 B12R0.4 CCCCCCSC(C)OC(=O)C 62a_100009818208_100000210757 [0,1,1,0,0,0|0,0,0]=2 3223 B12R0.4 CCCCOCSC(C)OC(=O)C 62a_100009818208_100011995733 [0,1,1,0,0,0|1,0,0]=3 3224 B12R0.4 CCCCOCSC(C)OC(=O)C 62a_100011995733_100009818208 [0,1,1,0,0,0|1,0,0]=3 3225 B12R0.4 CCCOCCSC(C)OC(=O)C 62a_100009818208_100011215938 [0,1,1,0,0,0|1,0,0]=3 3226 B12R0.4 CCCOCCSC(C)OC(=O)C 62a_100011215938_100009818208 [0,1,1,0,0,0|1,0,0]=3 3227 B12R0.4 CCOCCCSC(C)OC(=O)C 62a_100009818208_100012232248 [0,1,1,0,0,0|1,0,0]=3 3228 B12R0.4 CCOCCCSC(C)OC(=O)C 62a_100012232248_100009818208 [0,1,1,0,0,0|1,0,0]=3 3229 B12R0.4 COCCCCSC(C)OC(=O)C 62a_100000730899_100009818208 [0,1,1,0,0,0|1,0,0]=3 3230 B12R0.4 COCCCCSC(C)OC(=O)C 62a_100009818208_100000730899 [0,1,1,0,0,0|1,0,0]=3 3231 B12R0.4 COCCOCSC(C)OC(=O)C 62a_100000231047_100009818208 [0,1,1,0,0,0|2,0,0]=4 3232 B12R0.4 COCCOCSC(C)OC(=O)C 62a_100009818208_100000231047 [0,1,1,0,0,0|2,0,0]=4 3233 B12R0.46 C=C(C)C(=O)C(C)CCCCCC 1458a_100000185857_100011215978 [0,1,1,0,0,0|2,0,0]=4 3234 B12R0.46 CCCCCCN(C)C(C)C(=O)C 2230a_106256046315_100009814033 [0,1,1,0,0,0|2,0,0]=4 3235 B12R0.46 CCCCCCN(C)C(C)C(=O)C 269982a_106256046315_100009814033 [0,1,1,0,0,0|2,0,0]=4 3236 B12R0.113 C#CC(C)OC(C)CCCCCC 34a_100000210265_200000035995 [0,1,1,0,0,0|1,0,1]=4 3237 B12R0.113 C#C[C@@H](C)OC(C)CCCCCC 34a_100009815206_100011215978 [0,1,1,0,0,0|1,0,1]=4 3238 B12R0.113 C#C[C@@H](C)OC(C)CCCCCC 7a_100009815206_100011215978 [0,1,1,0,0,0|1,0,1]=4 3239 B12R0.113 C=CC(=O)NC(C)CCCCCC 1626a_100000210919_100000185746 [0,1,1,0,0,0|1,0,1]=4 3240 B12R0.113 C=CC(=O)NC(C)CCCCCC 240690a_100000210919_200121576911 [0,1,1,0,0,0|1,0,1]=4 3241 B12R0.113 C=CC(C)OC(C)CCCCCC 34a_100000695699_100011215978 [0,1,1,0,0,0|1,0,1]=4 3242 B12R0.113 CCCCCCC(C)NC(=O)CC 11a_100000210919_100000210414 [0,1,1,0,0,0|1,0,0]=3 3243 B12R0.113 CCCCCCC(C)NC(=O)CC 1626a_100000210919_100000210414 [0,1,1,0,0,0|1,0,0]=3 3244 B12R0.113 CCCCCCC(C)NC(=O)CC 240690a_100000210919_100000210414 [0,1,1,0,0,0|1,0,0]=3 3245 B12R0.113 CCCCCCC(C)NC(=O)CC 527a_100000210919_100000210414 [0,1,1,0,0,0|1,0,0]=3 3246 B12R0.113 CCCCCCC(C)NC(=O)CO 240690a_100000210919_100000210174 [0,1,1,0,0,0|1,0,0]=3 3247 B12R0.113 CCCCCCC(C)NC(=O)CO 527a_100000210919_100000210174 [0,1,1,0,0,0|1,0,0]=3 3248 B12R0.113 CCCCCCC(C)NC(=O)NC 2708a_100000210919_106832991635 [0,1,1,0,0,0|1,0,0]=3 3249 B12R0.113 CCCCCCC(C)NC(=O)NC 2708a_100102657272_100000210919 [0,1,1,0,0,0|1,0,0]=3 3250 B12R0.113 CCCCCCC(C)NC(=O)NC 273464a_100000210919_100102657272 [0,1,1,0,0,0|1,0,0]=3 3251 B12R0.113 CCCCCCC(C)NC(=O)NC 273464a_100102657272_100000210919 [0,1,1,0,0,0|1,0,0]=3 3252 B12R0.113 CCCCCCC(C)NC(=O)NC 512a_100000210919_100102657272 [0,1,1,0,0,0|1,0,0]=3 3253 B12R0.113 CCCCCCC(C)NC(=O)NC 512a_106832991638_100000210919 [0,1,1,0,0,0|1,0,0]=3 3254 B12R0.113 CCCCCCC(C)OC(C)C#N 34a_100011218135_100011215978 [0,1,1,0,0,0|1,0,1]=4 3255 B12R0.113 CCCCCCC(C)OC(C)C#N 7a_100000210265_100000703298 [0,1,1,0,0,0|1,0,1]=4 3256 B12R0.113 CCCCCCC(C)OC(C)CC 34a_100000210265_100011215416 [0,1,1,0,0,0|1,0,1]=4 3257 B12R0.113 CCCCCCC(C)OC(C)CC 7a_100000210228_100011215978 [0,1,1,0,0,0|1,0,1]=4 3258 B12R0.113 CCCCCCC(C)OC(C)CC 7a_100000210265_100000758301 [0,1,1,0,0,0|1,0,1]=4 3259 B12R0.113 CCCCCCC(C)OC(C)CF 34a_100016041109_100011215978 [0,1,1,0,0,0|1,0,1]=4 3260 B12R0.113 CCCCCCC(C)OC(C)CF 7a_100016041109_100011215978 [0,1,1,0,0,0|1,0,1]=4 3261 B12R0.113 CCCCCCC(C)OC(C)CN 34a_100000210904_100011215978 [0,1,1,0,0,0|1,0,1]=4 3262 B12R0.113 CCCCCCC(C)OC(C)CO 34a_100000210265_100012180447 [0,1,1,0,0,0|0,0,2]=4 3263 B12R0.113 CCCCCCC(C)OC(C)CO 7a_100000210265_100012180447 [0,1,1,0,0,0|0,0,2]=4 3264 B12R0.113 CCCCCCN(C)CC(=O)CC 269982a_106256046315_100000747405 [0,1,1,0,0,0|2,0,0]=4 3265 B12R0.113 CCCCCCN(C)CC(=O)NC 2230a_100000189611_100000210314 [0,1,1,0,0,0|2,0,0]=4 3266 B12R0.113 CCCCCCN(C)CC(=O)NC 2230a_106256046315_100000183359 [0,1,1,0,0,0|2,0,0]=4 3267 B12R0.113 CCCCCCN(C)CC(=O)NC 269982a_106256046315_100000183359 [0,1,1,0,0,0|2,0,0]=4 3268 B12R0.113 CCCCCCN(C)CC(=O)OC 2230a_100000198492_100000210314 [0,1,1,0,0,0|2,0,0]=4 3269 B12R0.113 CCCCCCN(C)CC(=O)OC 2230a_106256046315_100000747449 [0,1,1,0,0,0|2,0,0]=4 3270 B12R0.113 CCCCCCN(C)CC(=O)OC 269982a_106256046315_100000747449 [0,1,1,0,0,0|2,0,0]=4 3271 B12R0.113 CCCCCNC(C)CC(=O)OC 2230a_100000209983_100009817358 [0,1,1,0,0,0|2,0,0]=4 3272 B12R0.113 CCCCCOC(C)CC(=O)OC 34a_100000210253_100009817358 [0,1,1,0,0,0|2,0,0]=4 3273 B12R0.113 CCCCCOC(C)CC(=O)OC 7a_100000210253_100009817358 [0,1,1,0,0,0|2,0,0]=4 3274 B12R0.113 CCCCCSC(C)CC(=O)OC 62a_100000210326_100009817358 [0,1,1,0,0,0|2,0,0]=4 3275 B12R0.113 CCCCCSC(C)CC(=O)OC 62a_100009817358_100000210326 [0,1,1,0,0,0|2,0,0]=4 3276 B12R0.125 CCCCCCC(C)NS(=O)(=O)C 40a_100000210919_100000738038 [0,1,1,0,0,0|2,0,0]=4 3277 B12R0.125 CCCCCCC(C)OC(C)(C)C 34a_100000210265_100000210625 [0,1,1,0,0,0|1,0,1]=4 3278 B12R0.125 CCCCCCC(C)OC(C)(C)C 34a_100015890283_100011215978 [0,1,1,0,0,0|1,0,1]=4 3279 B12R0.125 CCCCCCC(C)OC(C)(C)C 7a_100015890283_100011215978 [0,1,1,0,0,0|1,0,1]=4 3280 B12R0.141 CC(=O)OC(C)C(=O)CCCCO 1458a_100000695505_100009818208 [0,1,1,0,0,0|1,0,1]=4 3281 B12R0.141 CC(=O)OC(C)N(C)CCCCO 269982a_100000717598_100009818208 [0,1,1,0,0,0|2,0,0]=4 3282 B12R0.141 CC(=O)O[C@@H](C)C(=O)CCCCF 1458a_100009816467_100000729493 [0,1,1,0,0,0|1,0,1]=4 3283 B12R0.141 CC(=O)O[C@@H](C)C(=O)CCCCO 1458a_100009816467_100000210776 [0,1,1,0,0,0|1,0,1]=4 3284 B12R0.141 CCCCCC(=O)C(C)OC(=O)C 1458a_100000212188_100009818208 [0,1,1,0,0,0|0,0,1]=3 3285 B12R0.141 CCCCCC(=O)[C@@H](C)NC(=O)C 1458a_100011504603_100000210326 [0,1,1,0,0,0|1,0,1]=4 3286 B12R0.141 CCCCCC(=O)[C@H](C)OC(=O)C 1458a_100009816467_100000210326 [0,1,1,0,0,0|0,0,1]=3 3287 B12R0.141 CCCCCN(C)C(C)OC(=O)C 269982a_100000223495_100009818208 [0,1,1,0,0,0|1,0,0]=3 3288 B12R0.141 CCCCNC(=O)[C@H](C)OC(=O)C 11a_100000102301_100009816467 [0,1,1,0,0,0|1,0,1]=4 3289 B12R0.141 CCCCNC(=O)[C@H](C)OC(=O)C 1626a_100000102301_100009816467 [0,1,1,0,0,0|1,0,1]=4 3290 B12R0.141 CCCCNC(=O)[C@H](C)OC(=O)C 240690a_100000102301_100009816467 [0,1,1,0,0,0|1,0,1]=4 3291 B12R0.141 CCCCNC(=O)[C@H](C)OC(=O)C 527a_100000102301_100009816467 [0,1,1,0,0,0|1,0,1]=4 3292 B12R0.141 CCCOCC(=O)C(C)OC(=O)C 1458a_100000745993_100009818208 [0,1,1,0,0,0|1,0,1]=4 3293 B12R0.141 CCCSCC(=O)C(C)OC(=O)C 1458a_100000217233_100009818208 [0,1,1,0,0,0|1,0,1]=4 3294 B12R0.141 CCOCCC(=O)C(C)OC(=O)C 1458a_100000749530_100009818208 [0,1,1,0,0,0|1,0,1]=4 3295 B12R0.141 CCOCCC(=O)[C@H](C)OC(=O)C 1458a_100009816467_100011215890 [0,1,1,0,0,0|1,0,1]=4 3296 B12R0.141 CCSCCC(=O)C(C)OC(=O)C 1458a_100000230768_100009818208 [0,1,1,0,0,0|1,0,1]=4 3297 B12R0.141 CCSCCC(=O)[C@H](C)OC(=O)C 1458a_100009816467_100000757381 [0,1,1,0,0,0|1,0,1]=4 3298 B12R0.141 COCCCC(=O)C(C)OC(=O)C 1458a_100000741012_100009818208 [0,1,1,0,0,0|1,0,1]=4 3299 B12R0.141 COCCCC(=O)[C@H](C)OC(=O)C 1458a_100009816467_100000740836 [0,1,1,0,0,0|1,0,1]=4 3300 B12R0.141 COCCCN(C)C(C)OC(=O)C 269982a_100000224831_100009818208 [0,1,1,0,0,0|2,0,0]=4 3301 B12R0.141 CSCCCC(=O)C(C)OC(=O)C 1458a_100000173376_100009818208 [0,1,1,0,0,0|1,0,1]=4 3302 B12R0.202 CCCCCCC(CC)OC(C)C 34a_100011215785_100000210206 [0,1,1,0,0,0|1,0,1]=4 3303 B12R0.202 CCCCCCC(CC)OC(C)C 7a_100011215785_100000210206 [0,1,1,0,0,0|1,0,1]=4 3304 B12R0.270 CC(=O)CCCSC(C)OC(=O)C 62a_100009818208_100011215641 [0,1,1,0,0,0|1,0,1]=4 3305 B12R0.270 CC(=O)CCCSC(C)OC(=O)C 62a_100011215641_100009818208 [0,1,1,0,0,0|1,0,1]=4 3306 B12R0.270 CC(=O)OC(C)SCCCC(C)C 62a_100009818208_100011214892 [0,1,1,0,0,0|1,0,0]=3 3307 B12R0.270 CC(=O)OC(C)SCCCC(C)C 62a_100011214892_100009818208 [0,1,1,0,0,0|1,0,0]=3 3308 B12R0.270 CC(=O)OC(C)SCCCC(C)O 62a_100009818208_200000718107 [0,1,1,0,0,0|1,0,0]=3 3309 B12R0.270 CC(=O)OC(C)SCCCC(C)O 62a_200000718107_100009818208 [0,1,1,0,0,0|1,0,0]=3 3310 B12R0.270 CC(=O)OC(C)SCCCN(C)C 62a_100009818208_100000757444 [0,1,1,0,0,0|2,0,0]=4 3311 B12R0.270 CC(=O)OC(C)SCCOC(C)C 62a_100000211751_100009818208 [0,1,1,0,0,0|2,0,0]=4 3312 B12R0.270 CC(=O)OC(C)SCCOC(C)C 62a_100009818208_100000211751 [0,1,1,0,0,0|2,0,0]=4 3313 B12R0.270 CC(=O)OC(C)SCCSC(C)C 62a_100000730970_100009818208 [0,1,1,0,0,0|2,0,0]=4 3314 B12R0.270 CC(=O)OC(C)SCCSC(C)C 62a_100009818208_100000730970 [0,1,1,0,0,0|2,0,0]=4 3315 B12R0.272 CCCC(=O)CSC(C)OC(=O)C 62a_100000747444_100009818208 [0,1,1,0,0,0|1,0,1]=4 3316 B12R0.272 CCCC(=O)CSC(C)OC(=O)C 62a_100009818208_100000747444 [0,1,1,0,0,0|1,0,1]=4 3317 B12R0.272 CCCC(C)CSC(C)OC(=O)C 62a_100009818208_100011216630 [0,1,1,0,0,0|1,0,0]=3 3318 B12R0.272 CCCC(C)CSC(C)OC(=O)C 62a_100011216630_100009818208 [0,1,1,0,0,0|1,0,0]=3 3319 B12R0.272 COCC(O)CSC(C)OC(=O)C 62a_100009818208_100011215053 [0,1,1,0,0,0|2,0,0]=4 3320 B12R0.272 COCC(O)CSC(C)OC(=O)C 62a_100011215053_100009818208 [0,1,1,0,0,0|2,0,0]=4 3321 B12R0.598 CCCCCCC(C)(C)OC(C)C 7a_200011995690_100000210206 [0,1,1,0,0,0|1,0,1]=4 3322 B12R0.598 CCCCCOC(C)(C)CC(=O)C 7a_100000210262_100000210326 [0,1,1,0,0,0|2,0,0]=4 3323 B12R0.1 C#CCC(=O)CCCCCCCC 1458a_100000210188_100000184674 [0,1,1,0,0,0|1,0,1]=4 3324 B12R0.1 C#CCC(=O)CCCCCCCC 1458a_100011220946_100000210759 [0,1,1,0,0,0|1,0,1]=4 3325 B12R0.1 C#CCC(=O)NCCCCCCC 1626a_100000229938_100011220946 [0,1,1,0,0,0|1,0,1]=4 3326 B12R0.1 C#CCC(=O)NCCCCCCC 527a_100000229938_100011220946 [0,1,1,0,0,0|1,0,1]=4 3327 B12R0.1 C=CCC(=O)CCCCCCCC 1458a_100000210188_100000210623 [0,1,1,0,0,0|1,0,1]=4 3328 B12R0.1 C=CCC(=O)CCCCCCCC 1458a_100000210193_100000210759 [0,1,1,0,0,0|1,0,1]=4 3329 B12R0.1 C=CCC(=O)NCCCCCCC 11a_100000229938_100000210193 [0,1,1,0,0,0|1,0,1]=4 3330 B12R0.1 C=CCC(=O)NCCCCCCC 1626a_100000229938_100000210193 [0,1,1,0,0,0|1,0,1]=4 3331 B12R0.1 C=CCC(=O)NCCCCCCC 240690a_100000229938_100000210193 [0,1,1,0,0,0|1,0,1]=4 3332 B12R0.1 C=CCC(=O)NCCCCCCC 527a_100000229938_100000210193 [0,1,1,0,0,0|1,0,1]=4 3333 B12R0.1 CC#CC(=O)CCCCCCCC 1458a_100000763181_100000210759 [0,1,1,0,0,0|1,0,1]=4 3334 B12R0.1 CC=CC(=O)CCCCCCCC 1458a_100000210699_100000210759 [0,1,1,0,0,0|1,0,1]=4 3335 B12R0.1 CC=CC(=O)NCCCCCCC 11a_100000229938_100000210699 [0,1,1,0,0,0|1,0,1]=4 3336 B12R0.1 CC=CC(=O)NCCCCCCC 1626a_100000229938_100000210699 [0,1,1,0,0,0|1,0,1]=4 3337 B12R0.1 CC=CC(=O)NCCCCCCC 240690a_100000229938_100000210699 [0,1,1,0,0,0|1,0,1]=4 3338 B12R0.1 CCCC(=O)CCCCCCCO 1458a_100000211992_100000760002 [0,1,1,0,0,0|2,0,0]=4 3339 B12R0.1 CCCC(=O)CCCCCCCO 1458a_100011219782_100000210303 [0,1,1,0,0,0|2,0,0]=4 3340 B12R0.1 CCCC(=O)CCCCCCOC 1458a_100000211992_100011998445 [0,1,1,0,0,0|2,0,0]=4 3341 B12R0.1 CCCC(=O)NCCCCCCO 240690a_100000686447_100000211992 [0,1,1,0,0,0|2,0,0]=4 3342 B12R0.1 CCCC(=O)NCCCCCCO 527a_100000686447_100000211992 [0,1,1,0,0,0|2,0,0]=4 3343 B12R0.1 CCCC(=O)NCCCCCOC 11a_100000747528_100000211992 [0,1,1,0,0,0|2,0,0]=4 3344 B12R0.1 CCCC(=O)NCCCCCOC 1626a_100000747528_100000211992 [0,1,1,0,0,0|2,0,0]=4 3345 B12R0.1 CCCC(=O)NCCCCCOC 240690a_100000747528_100000211992 [0,1,1,0,0,0|2,0,0]=4 3346 B12R0.1 CCCC(=O)NCCCCCOC 527a_100000747528_100000211992 [0,1,1,0,0,0|2,0,0]=4 3347 B12R0.1 CCCC(=O)OCNCCCCO 2230a_100000750430_100000034017 [0,1,1,0,0,0|2,0,0]=4 3348 B12R0.1 CCCC(=O)OCNCCCCO 34a_100000750430_100000034017 [0,1,1,0,0,0|2,0,0]=4 3349 B12R0.1 CCCC(=O)OCNCCCOC 34a_100150723488_100000034017 [0,1,1,0,0,0|2,0,0]=4 3350 B12R0.1 CCCC(=O)OCNCCCSC 2230a_100000749238_100000034017 [0,1,1,0,0,0|2,0,0]=4 3351 B12R0.1 CCCC(=O)OCNCCOCC 2230a_102516460346_100000034017 [0,1,1,0,0,0|2,0,0]=4 3352 B12R0.1 CCCC(=O)OCNCCOCC 34a_102516460346_100000034017 [0,1,1,0,0,0|2,0,0]=4 3353 B12R0.1 CCCC(=O)OCNCCSCC 2230a_100000106463_100000034017 [0,1,1,0,0,0|2,0,0]=4 3354 B12R0.1 CCCC(=O)OCOCCCCBr 34a_100011216708_100000034017 [0,1,1,0,0,0|2,0,0]=4 3355 B12R0.1 CCCC(=O)OCOCCCCCl 34a_100000210776_100000034017 [0,1,1,0,0,0|2,0,0]=4 3356 B12R0.1 CCCC(=O)OCOCCCCF 34a_100011995726_100000034017 [0,1,1,0,0,0|2,0,0]=4 3357 B12R0.1 CCCC(=O)OCOCCCCI 34a_200012148704_100000034017 [0,1,1,0,0,0|2,0,0]=4 3358 B12R0.1 CCCC(=O)OCOCCCCN 34a_100000750430_100000034017 [0,1,1,0,0,0|2,0,0]=4 3359 B12R0.1 CCCC(=O)OCOCCCNC 34a_100000213112_100000034017 [0,1,1,0,0,0|2,0,0]=4 3360 B12R0.1 CCCC(=O)OCOCCCOC 34a_100000740835_100000034017 [0,1,1,0,0,0|2,0,0]=4 3361 B12R0.1 CCCC(=O)OCOCCCSC 34a_100000690336_100000034017 [0,1,1,0,0,0|2,0,0]=4 3362 B12R0.1 CCCC(=O)OCOCCOCC 34a_100000210136_100000034017 [0,1,1,0,0,0|2,0,0]=4 3363 B12R0.1 CCCC(=O)OCOCCSCC 34a_100000212035_100000034017 [0,1,1,0,0,0|2,0,0]=4 3364 B12R0.1 CCCC(=O)OCSCCCCF 62a_100000729493_100000034017 [0,1,1,0,0,0|2,0,0]=4 3365 B12R0.1 CCCC(=O)OCSCCCCO 62a_100000210776_100000034017 [0,1,1,0,0,0|2,0,0]=4 3366 B12R0.1 CCCC(=O)OCSCCCOC 62a_100000709357_100000034017 [0,1,1,0,0,0|2,0,0]=4 3367 B12R0.1 CCCC(=O)OCSCCOCC 62a_100000210147_100000034017 [0,1,1,0,0,0|2,0,0]=4 3368 B12R0.1 CCCC(=O)OCSCCSCC 62a_100000757381_100000034017 [0,1,1,0,0,0|2,0,0]=4 3369 B12R0.1 CCCCCCC=CC(=O)CCC 1458a_200015324643_100000210303 [0,1,1,0,0,0|1,0,1]=4 3370 B12R0.1 CCCCCCC=CC(=O)CCF 1458a_200015324643_100011217306 [0,1,1,0,0,0|1,0,1]=4 3371 B12R0.1 CCCCCCC=CC(=O)CCO 1458a_200015324643_100000211926 [0,1,1,0,0,0|1,0,1]=4 3372 B12R0.1 CCCCCCC=CC(=O)NCC 11a_100015525214_200015324643 [0,1,1,0,0,0|1,0,1]=4 3373 B12R0.1 CCCCCCC=CC(=O)NCC 240690a_100015525214_200015324643 [0,1,1,0,0,0|1,0,1]=4 3374 B12R0.1 CCCCCCCCC(=O)CC#N 1458a_100000210188_100011214920 [0,1,1,0,0,0|1,0,1]=4 3375 B12R0.1 CCCCCCCCC(=O)CC#N 1458a_100051588842_100000210759 [0,1,1,0,0,0|1,0,1]=4 3376 B12R0.1 CCCCCCCCC(=O)CCC 1458a_100000210188_100000210303 [0,1,1,0,0,0|1,0,0]=3 3377 B12R0.1 CCCCCCCCC(=O)CCC 1458a_100000211992_100000210759 [0,1,1,0,0,0|1,0,0]=3 3378 B12R0.1 CCCCCCCCC(=O)CCF 1458a_100000210188_100011217306 [0,1,1,0,0,0|1,0,0]=3 3379 B12R0.1 CCCCCCCCC(=O)CCO 1458a_100000210188_100000211926 [0,1,1,0,0,0|1,0,0]=3 3380 B12R0.1 CCCCCCCCC(=O)CCO 1458a_100011216618_100000210759 [0,1,1,0,0,0|1,0,0]=3 3381 B12R0.1 CCCCCCCCC(=O)COC 1458a_100000210968_100000210759 [0,1,1,0,0,0|1,0,0]=3 3382 B12R0.1 CCCCCCCCC(=O)CSC 1458a_100000184570_100000210759 [0,1,1,0,0,0|1,0,0]=3 3383 B12R0.1 CCCCCCCCC(=O)NCC 11a_100015525214_100000210188 [0,1,1,0,0,0|1,0,0]=3 3384 B12R0.1 CCCCCCCCC(=O)NCC 240690a_100015525214_100000210188 [0,1,1,0,0,0|1,0,0]=3 3385 B12R0.1 CCCCCCCCC(=O)NCC 527a_100015525214_100000210188 [0,1,1,0,0,0|1,0,0]=3 3386 B12R0.1 CCCCCCCCC(=O)NNC 22a_100016993582_100000210188 [0,1,1,0,0,0|2,0,0]=4 3387 B12R0.1 CCCCCCCNC(=O)CC#N 1626a_100000229938_100051588842 [0,1,1,0,0,0|1,0,1]=4 3388 B12R0.1 CCCCCCCNC(=O)CC#N 240690a_100000229938_100051588842 [0,1,1,0,0,0|1,0,1]=4 3389 B12R0.1 CCCCCCCNC(=O)CCC 11a_100000229938_100000211992 [0,1,1,0,0,0|1,0,0]=3 3390 B12R0.1 CCCCCCCNC(=O)CCC 1626a_100000229938_100000211992 [0,1,1,0,0,0|1,0,0]=3 3391 B12R0.1 CCCCCCCNC(=O)CCC 240690a_100000229938_100000211992 [0,1,1,0,0,0|1,0,0]=3 3392 B12R0.1 CCCCCCCNC(=O)CCC 527a_100000229938_100000211992 [0,1,1,0,0,0|1,0,0]=3 3393 B12R0.1 CCCCCCCNC(=O)CCO 240690a_100000229938_100011216618 [0,1,1,0,0,0|1,0,0]=3 3394 B12R0.1 CCCCCCCNC(=O)COC 11a_100000229938_100000210968 [0,1,1,0,0,0|1,0,0]=3 3395 B12R0.1 CCCCCCCNC(=O)COC 1626a_100000229938_100000210968 [0,1,1,0,0,0|1,0,0]=3 3396 B12R0.1 CCCCCCCNC(=O)COC 240690a_100000229938_100000210968 [0,1,1,0,0,0|1,0,0]=3 3397 B12R0.1 CCCCCCCNC(=O)COC 527a_100000229938_100000210968 [0,1,1,0,0,0|1,0,0]=3 3398 B12R0.1 CCCCCCCNC(=O)CSC 11a_100000229938_100000184570 [0,1,1,0,0,0|1,0,0]=3 3399 B12R0.1 CCCCCCCNC(=O)CSC 1626a_100000229938_100000184570 [0,1,1,0,0,0|1,0,0]=3 3400 B12R0.1 CCCCCCCNC(=O)CSC 240690a_100000229938_100000184570 [0,1,1,0,0,0|1,0,0]=3 3401 B12R0.1 CCCCCCCNC(=O)CSC 527a_100000229938_100000184570 [0,1,1,0,0,0|1,0,0]=3 3402 B12R0.1 CCCCCCCNC(=O)NCC 2708a_100000229938_100015525214 [0,1,1,0,0,0|1,0,0]=3 3403 B12R0.1 CCCCCCCNC(=O)NCC 2708a_100015525214_100000229938 [0,1,1,0,0,0|1,0,0]=3 3404 B12R0.1 CCCCCCCNC(=O)NCC 273464a_100000229938_100015525214 [0,1,1,0,0,0|1,0,0]=3 3405 B12R0.1 CCCCCCCNC(=O)NCC 273464a_100015525214_100000229938 [0,1,1,0,0,0|1,0,0]=3 3406 B12R0.1 CCCCCCCNC(=O)NCC 512a_100000229938_100015525214 [0,1,1,0,0,0|1,0,0]=3 3407 B12R0.1 CCCCCCCNC(=O)NCC 512a_100015525214_100000229938 [0,1,1,0,0,0|1,0,0]=3 3408 B12R0.1 CCCCCCCNC(=O)NNC 273464a_100000229938_100016993582 [0,1,1,0,0,0|2,0,0]=4 3409 B12R0.1 CCCCCCCNC(=O)NNC 512a_100000229938_100016993582 [0,1,1,0,0,0|2,0,0]=4 3410 B12R0.1 CCCCCCCNC(=O)NNC 512a_100016993582_100000229938 [0,1,1,0,0,0|2,0,0]=4 3411 B12R0.1 CCCCCCCOC(C)CCBr 34a_100012276601_100000210614 [0,1,1,0,0,0|1,0,1]=4 3412 B12R0.1 CCCCCCCOC(C)CCC 34a_100000210272_100000766640 [0,1,1,0,0,0|1,0,1]=4 3413 B12R0.1 CCCCCCCOC(C)CCC 34a_100000764384_100000210614 [0,1,1,0,0,0|1,0,1]=4 3414 B12R0.1 CCCCCCCOC(C)CCC 7a_100000210272_100000766640 [0,1,1,0,0,0|1,0,1]=4 3415 B12R0.1 CCCCCCCOC(C)CCC 7a_100000764384_100000210614 [0,1,1,0,0,0|1,0,1]=4 3416 B12R0.1 CCCCCCCOC(C)CCO 34a_100000210272_100009893172 [0,1,1,0,0,0|1,0,1]=4 3417 B12R0.1 CCCCCCCOC(C)CCO 7a_100000210272_100009893172 [0,1,1,0,0,0|1,0,1]=4 3418 B12R0.1 CCCCCCCOC(C)COC 34a_100000210272_100000765312 [0,1,1,0,0,0|1,0,1]=4 3419 B12R0.1 CCCCCCCOC(C)COC 7a_100000210272_100000765312 [0,1,1,0,0,0|1,0,1]=4 3420 B12R0.1 CCCCCCCO[C@H](C)COC 34a_100011934205_100000210614 [0,1,1,0,0,0|1,0,1]=4 3421 B12R0.1 CCCCCCNCC(=O)CCC 2230a_100000210581_100000747444 [0,1,1,0,0,0|2,0,0]=4 3422 B12R0.1 CCCCCCNCC(=O)NCC 2230a_100000210581_100000183381 [0,1,1,0,0,0|2,0,0]=4 3423 B12R0.1 CCCCCCNCC(=O)NCC 2230a_100016988866_100000210314 [0,1,1,0,0,0|2,0,0]=4 3424 B12R0.1 CCCCCCNCC(=O)OCC 2230a_100000210581_100000188475 [0,1,1,0,0,0|2,0,0]=4 3425 B12R0.1 CCCCCCOCC(=O)CCC 7a_100000210259_100000747444 [0,1,1,0,0,0|2,0,0]=4 3426 B12R0.1 CCCCCCOCC(=O)NCC 34a_100000210259_100000183381 [0,1,1,0,0,0|2,0,0]=4 3427 B12R0.1 CCCCCCOCC(=O)NCC 7a_100000210259_100000183381 [0,1,1,0,0,0|2,0,0]=4 3428 B12R0.1 CCCCCCOCC(=O)OCC 34a_100000210259_100000188475 [0,1,1,0,0,0|2,0,0]=4 3429 B12R0.1 CCCCCCOCC(=O)OCC 7a_100000210259_100000188475 [0,1,1,0,0,0|2,0,0]=4 3430 B12R0.1 CCCCCCSCC(=O)CCC 62a_100000210314_100000747444 [0,1,1,0,0,0|2,0,0]=4 3431 B12R0.1 CCCCCCSCC(=O)CCC 62a_100000747444_100000210757 [0,1,1,0,0,0|2,0,0]=4 3432 B12R0.1 CCCCCCSCC(=O)NCC 62a_100000183381_100000210757 [0,1,1,0,0,0|2,0,0]=4 3433 B12R0.1 CCCCCCSCC(=O)NCC 62a_100000210314_100000183381 [0,1,1,0,0,0|2,0,0]=4 3434 B12R0.1 CCCCCCSCC(=O)OCC 62a_100000188475_100000210757 [0,1,1,0,0,0|2,0,0]=4 3435 B12R0.1 CCCCCCSCC(=O)OCC 62a_100000210314_100000188475 [0,1,1,0,0,0|2,0,0]=4 3436 B12R0.1 CCCCCNCCC(=O)NCC 2230a_100000209983_100000737597 [0,1,1,0,0,0|2,0,0]=4 3437 B12R0.1 CCCCCNCCC(=O)NCC 34a_100025743525_100000718602 [0,1,1,0,0,0|2,0,0]=4 3438 B12R0.1 CCCCCNCCC(=O)OCC 2230a_100000209983_100011206558 [0,1,1,0,0,0|2,0,0]=4 3439 B12R0.1 CCCCCNCOC(=O)CCC 2230a_100000209983_100000034017 [0,1,1,0,0,0|1,0,0]=3 3440 B12R0.1 CCCCCOCCC(=O)NCC 7a_100000210253_100000737597 [0,1,1,0,0,0|2,0,0]=4 3441 B12R0.1 CCCCCOCCC(=O)OCC 34a_100000210253_100000765890 [0,1,1,0,0,0|2,0,0]=4 3442 B12R0.1 CCCCCOCCC(=O)OCC 7a_100000210253_100011206558 [0,1,1,0,0,0|2,0,0]=4 3443 B12R0.1 CCCCCOCOC(=O)CCC 34a_100000210253_100000034017 [0,1,1,0,0,0|1,0,0]=3 3444 B12R0.1 CCCCCSCCC(=O)NCC 62a_100000210326_100000737597 [0,1,1,0,0,0|2,0,0]=4 3445 B12R0.1 CCCCCSCCC(=O)NCC 62a_100000737597_100000210326 [0,1,1,0,0,0|2,0,0]=4 3446 B12R0.1 CCCCCSCCC(=O)OCC 62a_100000210326_100000765890 [0,1,1,0,0,0|2,0,0]=4 3447 B12R0.1 CCCCCSCCC(=O)OCC 62a_100000765890_100000210326 [0,1,1,0,0,0|2,0,0]=4 3448 B12R0.1 CCCCCSCOC(=O)CCC 62a_100000210326_100000034017 [0,1,1,0,0,0|1,0,0]=3 3449 B12R0.1 CCCCCSCOC(=O)OCC 62a_100000210326_100000075025 [0,1,1,0,0,0|1,0,0]=3 3450 B12R0.1 CCCCNCCCC(=O)OCC 2230a_100000102301_100009991533 [0,1,1,0,0,0|2,0,0]=4 3451 B12R0.1 CCCCNCCCC(=O)OCC 7a_106832991798_100011215271 [0,1,1,0,0,0|2,0,0]=4 3452 B12R0.1 CCCCNCCNC(=O)OCC 7a_106832991798_200011445536 [0,1,1,0,0,0|2,0,0]=4 3453 B12R0.1 CCCCOCCCC(=O)OCC 34a_100000210227_100009991533 [0,1,1,0,0,0|2,0,0]=4 3454 B12R0.1 CCCCOCCCC(=O)OCC 7a_100000210227_100011215271 [0,1,1,0,0,0|2,0,0]=4 3455 B12R0.1 CCCCOCCCC(=O)OCC 7a_100012001163_100000210211 [0,1,1,0,0,0|2,0,0]=4 3456 B12R0.1 CCCCOCCNC(=O)OCC 34a_100000158857_100000210210 [0,1,1,0,0,0|2,0,0]=4 3457 B12R0.1 CCCCOCCNC(=O)OCC 7a_100000210227_200011445536 [0,1,1,0,0,0|2,0,0]=4 3458 B12R0.1 CCCCSCCCC(=O)OCC 62a_100000210211_100009991533 [0,1,1,0,0,0|2,0,0]=4 3459 B12R0.1 CCCCSCCCC(=O)OCC 62a_100009991533_100000210210 [0,1,1,0,0,0|2,0,0]=4 3460 B12R0.1 CCCCSCCNC(=O)CCC 11a_100025743550_100000211992 [0,1,1,0,0,0|2,0,0]=4 3461 B12R0.1 CCCCSCCNC(=O)CCC 1626a_100025743550_100000211992 [0,1,1,0,0,0|2,0,0]=4 3462 B12R0.1 CCCCSCCNC(=O)CCC 240690a_100025743550_100000211992 [0,1,1,0,0,0|2,0,0]=4 3463 B12R0.1 CCCCSCCNC(=O)CCC 527a_100025743550_100000211992 [0,1,1,0,0,0|2,0,0]=4 3464 B12R0.1 CCCCSCCNC(=O)CCO 240690a_100025743550_100011216618 [0,1,1,0,0,0|2,0,0]=4 3465 B12R0.1 CCCCSCCNC(=O)COC 11a_100025743550_100000210968 [0,1,1,0,0,0|2,0,0]=4 3466 B12R0.1 CCCCSCCNC(=O)COC 1626a_100025743550_100000210968 [0,1,1,0,0,0|2,0,0]=4 3467 B12R0.1 CCCCSCCNC(=O)COC 240690a_100025743550_100000210968 [0,1,1,0,0,0|2,0,0]=4 3468 B12R0.1 CCCCSCCNC(=O)COC 527a_100025743550_100000210968 [0,1,1,0,0,0|2,0,0]=4 3469 B12R0.1 CCCCSCCNC(=O)CSC 11a_100025743550_100000184570 [0,1,1,0,0,0|2,0,0]=4 3470 B12R0.1 CCCCSCCNC(=O)CSC 1626a_100025743550_100000184570 [0,1,1,0,0,0|2,0,0]=4 3471 B12R0.1 CCCCSCCNC(=O)CSC 240690a_100025743550_100000184570 [0,1,1,0,0,0|2,0,0]=4 3472 B12R0.1 CCCCSCCNC(=O)CSC 527a_100025743550_100000184570 [0,1,1,0,0,0|2,0,0]=4 3473 B12R0.1 CCCCSCCNC(=O)NCC 2708a_100015525214_100025743550 [0,1,1,0,0,0|2,0,0]=4 3474 B12R0.1 CCCCSCCNC(=O)NCC 2708a_100025743550_100015525214 [0,1,1,0,0,0|2,0,0]=4 3475 B12R0.1 CCCCSCCNC(=O)NCC 273464a_100015525214_100025743550 [0,1,1,0,0,0|2,0,0]=4 3476 B12R0.1 CCCCSCCNC(=O)NCC 273464a_100025743550_100015525214 [0,1,1,0,0,0|2,0,0]=4 3477 B12R0.1 CCCCSCCNC(=O)NCC 512a_100015525214_100025743550 [0,1,1,0,0,0|2,0,0]=4 3478 B12R0.1 CCCCSCCNC(=O)NCC 512a_100025743550_100015525214 [0,1,1,0,0,0|2,0,0]=4 3479 B12R0.1 CCCCSCCNC(=O)OCC 62a_100000210211_200011445536 [0,1,1,0,0,0|2,0,0]=4 3480 B12R0.1 CCCOCCCCC(=O)OCC 34a_100000210258_100000750268 [0,1,1,0,0,0|2,0,0]=4 3481 B12R0.1 CCCOCCCNC(=O)CCC 1626a_100011217757_100000211992 [0,1,1,0,0,0|2,0,0]=4 3482 B12R0.1 CCCOCCCNC(=O)CCC 240690a_100011217757_100000211992 [0,1,1,0,0,0|2,0,0]=4 3483 B12R0.1 CCCOCCCNC(=O)CCC 527a_100011217757_100000211992 [0,1,1,0,0,0|2,0,0]=4 3484 B12R0.1 CCCOCCCNC(=O)CCO 240690a_100011217757_100011216618 [0,1,1,0,0,0|2,0,0]=4 3485 B12R0.1 CCCOCCCNC(=O)COC 1626a_100011217757_100000210968 [0,1,1,0,0,0|2,0,0]=4 3486 B12R0.1 CCCOCCCNC(=O)COC 240690a_100011217757_100000210968 [0,1,1,0,0,0|2,0,0]=4 3487 B12R0.1 CCCOCCCNC(=O)COC 527a_100011217757_100000210968 [0,1,1,0,0,0|2,0,0]=4 3488 B12R0.1 CCCOCCCNC(=O)CSC 1626a_100011217757_100000184570 [0,1,1,0,0,0|2,0,0]=4 3489 B12R0.1 CCCOCCCNC(=O)CSC 240690a_100011217757_100000184570 [0,1,1,0,0,0|2,0,0]=4 3490 B12R0.1 CCCOCCCNC(=O)CSC 527a_100011217757_100000184570 [0,1,1,0,0,0|2,0,0]=4 3491 B12R0.1 CCCOCCCNC(=O)NCC 2708a_100011217757_100015525214 [0,1,1,0,0,0|2,0,0]=4 3492 B12R0.1 CCCOCCCNC(=O)NCC 2708a_100015525214_100011217757 [0,1,1,0,0,0|2,0,0]=4 3493 B12R0.1 CCCOCCCNC(=O)NCC 273464a_100011217757_100015525214 [0,1,1,0,0,0|2,0,0]=4 3494 B12R0.1 CCCOCCCNC(=O)NCC 273464a_100015525214_100011217757 [0,1,1,0,0,0|2,0,0]=4 3495 B12R0.1 CCCOCCCNC(=O)NCC 512a_100011217757_100015525214 [0,1,1,0,0,0|2,0,0]=4 3496 B12R0.1 CCCOCCCNC(=O)NCC 512a_100015525214_100011217757 [0,1,1,0,0,0|2,0,0]=4 3497 B12R0.1 CCCSCCCCC(=O)OCC 62a_100000210303_100000750268 [0,1,1,0,0,0|2,0,0]=4 3498 B12R0.1 CCCSCCCCC(=O)OCC 62a_100000750268_100000210303 [0,1,1,0,0,0|2,0,0]=4 3499 B12R0.1 CCNC(=O)CCCCCCCO 240690a_100015525214_100011219782 [0,1,1,0,0,0|2,0,0]=4 3500 B12R0.1 CCNC(=O)NCCCCCCO 2708a_100015525214_100000686447 [0,1,1,0,0,0|2,0,0]=4 3501 B12R0.1 CCNC(=O)NCCCCCCO 273464a_100000686447_100015525214 [0,1,1,0,0,0|2,0,0]=4 3502 B12R0.1 CCNC(=O)NCCCCCCO 273464a_100015525214_100000686447 [0,1,1,0,0,0|2,0,0]=4 3503 B12R0.1 CCNC(=O)NCCCCCCO 512a_100000686447_100015525214 [0,1,1,0,0,0|2,0,0]=4 3504 B12R0.1 CCNC(=O)NCCCCCCO 512a_100015525214_100000686447 [0,1,1,0,0,0|2,0,0]=4 3505 B12R0.1 CCNC(=O)NCCCCCOC 2708a_100000747528_100015525214 [0,1,1,0,0,0|2,0,0]=4 3506 B12R0.1 CCNC(=O)NCCCCCOC 2708a_100015525214_100000747528 [0,1,1,0,0,0|2,0,0]=4 3507 B12R0.1 CCNC(=O)NCCCCCOC 273464a_100000747528_100015525214 [0,1,1,0,0,0|2,0,0]=4 3508 B12R0.1 CCNC(=O)NCCCCCOC 273464a_100015525214_100000747528 [0,1,1,0,0,0|2,0,0]=4 3509 B12R0.1 CCNC(=O)NCCCCCOC 512a_100000747528_100015525214 [0,1,1,0,0,0|2,0,0]=4 3510 B12R0.1 CCNC(=O)NCCCCCOC 512a_100015525214_100000747528 [0,1,1,0,0,0|2,0,0]=4 3511 B12R0.1 CCNCCCCCC(=O)OCC 2230a_100015525214_100000755133 [0,1,1,0,0,0|2,0,0]=4 3512 B12R0.1 CCOC(=O)CCCCCCNC 2230a_106832991635_100009814379 [0,1,1,0,0,0|2,0,0]=4 3513 B12R0.1 CCOC(=O)CCCCCCNC 34a_100102657272_100009814379 [0,1,1,0,0,0|2,0,0]=4 3514 B12R0.1 CCOC(=O)CCCCCCNC 7a_106832991635_100009814379 [0,1,1,0,0,0|2,0,0]=4 3515 B12R0.1 CCOC(=O)CCCCCCOC 34a_100138415774_100009814379 [0,1,1,0,0,0|2,0,0]=4 3516 B12R0.1 CCOC(=O)CCCCCCSC 62a_200000210301_100009814379 [0,1,1,0,0,0|2,0,0]=4 3517 B12R0.1 CCOC(=O)CCCCCCS[13CH3] 62a_200025704644_100009814379 [0,1,1,0,0,0|2,0,0]=4 3518 B12R0.1 CCOC(=O)CCCCCSCC 62a_100000210202_100000755133 [0,1,1,0,0,0|2,0,0]=4 3519 B12R0.1 CCOC(=O)CCCCCSCC 62a_100000755133_100000210202 [0,1,1,0,0,0|2,0,0]=4 3520 B12R0.1 CCOC(=O)OCSCCCCF 62a_100000729493_100000075025 [0,1,1,0,0,0|2,0,0]=4 3521 B12R0.1 CCOC(=O)OCSCCCCO 62a_100000210776_100000075025 [0,1,1,0,0,0|2,0,0]=4 3522 B12R0.1 CCOC(=O)OCSCCCOC 62a_100000709357_100000075025 [0,1,1,0,0,0|2,0,0]=4 3523 B12R0.1 CCOC(=O)OCSCCSCC 62a_100000757381_100000075025 [0,1,1,0,0,0|2,0,0]=4 3524 B12R0.1 CCOCCCCCC(=O)OCC 34a_100121572206_100000755133 [0,1,1,0,0,0|2,0,0]=4 3525 B12R0.1 CCOCCCCCC(=O)OCC 7a_100011214988_100000210202 [0,1,1,0,0,0|2,0,0]=4 3526 B12R0.1 CCOCCSCOC(=O)OCC 62a_100000210147_100000075025 [0,1,1,0,0,0|2,0,0]=4 3527 B12R0.1 COCC(=O)CCCCCCCO 1458a_100000210968_100000760002 [0,1,1,0,0,0|2,0,0]=4 3528 B12R0.1 COCC(=O)NCCCCCCO 240690a_100000686447_100000210968 [0,1,1,0,0,0|2,0,0]=4 3529 B12R0.1 COCC(=O)NCCCCCCO 527a_100000686447_100000210968 [0,1,1,0,0,0|2,0,0]=4 3530 B12R0.1 COCCCCCCC(=O)CCO 1458a_100011216618_100011998445 [0,1,1,0,0,0|2,0,0]=4 3531 B12R0.1 COCCCCCCC(=O)COC 1458a_100000210968_100011998445 [0,1,1,0,0,0|2,0,0]=4 3532 B12R0.1 COCCCCCCC(=O)CSC 1458a_100000184570_100011998445 [0,1,1,0,0,0|2,0,0]=4 3533 B12R0.1 COCCCCCNC(=O)CCO 240690a_100000747528_100011216618 [0,1,1,0,0,0|2,0,0]=4 3534 B12R0.1 COCCCCCNC(=O)COC 11a_100000747528_100000210968 [0,1,1,0,0,0|2,0,0]=4 3535 B12R0.1 COCCCCCNC(=O)COC 1626a_100000747528_100000210968 [0,1,1,0,0,0|2,0,0]=4 3536 B12R0.1 COCCCCCNC(=O)COC 240690a_100000747528_100000210968 [0,1,1,0,0,0|2,0,0]=4 3537 B12R0.1 COCCCCCNC(=O)COC 527a_100000747528_100000210968 [0,1,1,0,0,0|2,0,0]=4 3538 B12R0.1 COCCCCCNC(=O)CSC 11a_100000747528_100000184570 [0,1,1,0,0,0|2,0,0]=4 3539 B12R0.1 COCCCCCNC(=O)CSC 1626a_100000747528_100000184570 [0,1,1,0,0,0|2,0,0]=4 3540 B12R0.1 COCCCCCNC(=O)CSC 240690a_100000747528_100000184570 [0,1,1,0,0,0|2,0,0]=4 3541 B12R0.1 COCCCCCNC(=O)CSC 527a_100000747528_100000184570 [0,1,1,0,0,0|2,0,0]=4 3542 B12R0.1 CSCC(=O)CCCCCCCO 1458a_100000184570_100000760002 [0,1,1,0,0,0|2,0,0]=4 3543 B12R0.1 CSCC(=O)NCCCCCCO 240690a_100000686447_100000184570 [0,1,1,0,0,0|2,0,0]=4 3544 B12R0.1 CSCC(=O)NCCCCCCO 527a_100000686447_100000184570 [0,1,1,0,0,0|2,0,0]=4 3545 B12R0.1 O=C(CCF)CCCCCCCO 1458a_100011219782_100011217306 [0,1,1,0,0,0|2,0,0]=4 3546 B12R0.1 O=C(CCO)CCCCCCCO 1458a_100011216618_100000760002 [0,1,1,0,0,0|2,0,0]=4 3547 B12R0.1 O=C(CCO)CCCCCCCO 1458a_100011219782_100000211926 [0,1,1,0,0,0|2,0,0]=4 3548 B12R0.1 O=C(CCO)NCCCCCCO 240690a_100000686447_100011216618 [0,1,1,0,0,0|2,0,0]=4 3549 B12R0.49 CCCCCCCC(=O)C(=O)NC 1458a_100011218921_100000210614 [0,1,1,0,0,0|2,0,0]=4 3550 B12R0.49 CCCCCCCC(C)C(=O)CC 1458a_100000210414_200011218727 [0,1,1,0,0,0|1,0,0]=3 3551 B12R0.49 CCCCCCCC(C)C(=O)CO 1458a_100000210174_200011218727 [0,1,1,0,0,0|2,0,0]=4 3552 B12R0.49 CCCCCCCN(C)C(=O)CC 11a_100000228206_100000210414 [0,1,1,0,0,0|1,0,0]=3 3553 B12R0.49 CCCCCCCN(C)C(=O)CC 1626a_100000228206_100000210414 [0,1,1,0,0,0|1,0,0]=3 3554 B12R0.49 CCCCCCCN(C)C(=O)CC 240690a_100000228206_100000210414 [0,1,1,0,0,0|1,0,0]=3 3555 B12R0.49 CCCCCCCN(C)C(=O)CC 527a_100000228206_100000210414 [0,1,1,0,0,0|1,0,0]=3 3556 B12R0.49 CCCCCCCN(C)C(=O)CO 240690a_100000228206_100000210174 [0,1,1,0,0,0|2,0,0]=4 3557 B12R0.49 CCCCCCCN(C)C(=O)CO 527a_100000228206_100000210174 [0,1,1,0,0,0|2,0,0]=4 3558 B12R0.49 CCCCCCCN(C)C(=O)NC 2708a_100102657272_100000228206 [0,1,1,0,0,0|2,0,0]=4 3559 B12R0.49 CCCCCCCN(C)C(=O)NC 273464a_100102657272_100000228206 [0,1,1,0,0,0|2,0,0]=4 3560 B12R0.49 CCCCCCNC(C)C(=O)CC 2230a_100000210581_100000742827 [0,1,1,0,0,0|2,0,0]=4 3561 B12R0.49 CCCCCCOC(C)C(=O)CC 7a_100000210259_100000742827 [0,1,1,0,0,0|2,0,0]=4 3562 B12R0.49 CCCCCCSC(C)C(=O)CC 62a_100000210314_100000742827 [0,1,1,0,0,0|2,0,0]=4 3563 B12R0.49 CCCCCCSC(C)C(=O)CC 62a_100000742827_100000210757 [0,1,1,0,0,0|2,0,0]=4 3564 B12R0.57 C#CC(CC)OCCCCCCC 34a_100000758843_100000210614 [0,1,1,0,0,0|1,0,1]=4 3565 B12R0.57 C#CC(CC)OCCCCCCC 7a_100000758843_100000210614 [0,1,1,0,0,0|1,0,1]=4 3566 B12R0.57 C=CC(CC)OCCCCCCC 34a_100000766422_100000210614 [0,1,1,0,0,0|1,0,1]=4 3567 B12R0.57 C=CC(CC)OCCCCCCC 7a_100000766422_100000210614 [0,1,1,0,0,0|1,0,1]=4 3568 B12R0.57 CCCCCCCOC(CC)CC 7a_100000210272_100000210505 [0,1,1,0,0,0|1,0,1]=4 3569 B12R0.57 CCCCCCCOC(CC)CC 7a_100000688536_100000210614 [0,1,1,0,0,0|1,0,1]=4 3570 B12R0.102 CCCCC(=O)CCOC(=O)NC 1458a_100000210183_200011997002 [0,1,1,0,0,0|1,0,1]=4 3571 B12R0.102 CCCCC(C)COCC(=O)CC 7a_100011995851_100000747405 [0,1,1,0,0,0|2,0,0]=4 3572 B12R0.102 CCCCC(C)SCOC(=O)OC 62a_200011215066_100000139417 [0,1,1,0,0,0|2,0,0]=4 3573 B12R0.102 CCCCN(C)CCNC(=O)CC 1626a_200000754967_100000210414 [0,1,1,0,0,0|2,0,0]=4 3574 B12R0.102 CCCCN(C)CCNC(=O)CC 240690a_200000754967_100000210414 [0,1,1,0,0,0|2,0,0]=4 3575 B12R0.102 CCCCN(C)CCNC(=O)CC 527a_200000754967_100000210414 [0,1,1,0,0,0|2,0,0]=4 3576 B12R0.102 CCCCN(C)CCOC(=O)NC 269982a_100000207549_200011997002 [0,1,1,0,0,0|2,0,0]=4 3577 B12R0.142 CCCCCC(=O)CNC(=O)CC 1458a_100000194589_100000210326 [0,1,1,0,0,0|1,0,1]=4 3578 B12R0.142 CCCCCC(C)CCC(=O)CC 1458a_100000034243_100000210202 [0,1,1,0,0,0|1,0,0]=3 3579 B12R0.142 CCCCCC(C)CCC(=O)CF 1458a_100000034243_100015361967 [0,1,1,0,0,0|2,0,0]=4 3580 B12R0.142 CCCCCC(C)CCC(=O)NC 11a_106832991635_100000034243 [0,1,1,0,0,0|2,0,0]=4 3581 B12R0.142 CCCCCC(C)CCC(=O)NC 1626a_100102657272_100000034243 [0,1,1,0,0,0|2,0,0]=4 3582 B12R0.142 CCCCCC(C)CCC(=O)NC 240690a_100102657272_100000034243 [0,1,1,0,0,0|2,0,0]=4 3583 B12R0.142 CCCCCC(C)CCC(=O)NC 527a_100102657272_100000034243 [0,1,1,0,0,0|2,0,0]=4 3584 B12R0.142 CCCCCC(C)OCC(=O)CC 34a_100000725409_200011218191 [0,1,1,0,0,0|2,0,0]=4 3585 B12R0.142 CCCCCC(C)OCC(=O)CC 7a_100011215632_100000747405 [0,1,1,0,0,0|2,0,0]=4 3586 B12R0.142 CCCCCC(C)SCC(=O)CC 62a_100000747405_200011218191 [0,1,1,0,0,0|2,0,0]=4 3587 B12R0.142 CCCCCC(C)SCC(=O)CC 62a_200011218191_100000747405 [0,1,1,0,0,0|2,0,0]=4 3588 B12R0.142 CCCCCN(C)CCC(=O)CC 1458a_100016987678_100000210202 [0,1,1,0,0,0|2,0,0]=4 3589 B12R0.183 CCC(=O)COCCCC(C)CC 7a_100011216074_100000747405 [0,1,1,0,0,0|2,0,0]=4 3590 B12R0.183 CCC(=O)COCCOC(=O)CC 7a_200000031056_100000747405 [0,1,1,0,0,0|1,0,1]=4 3591 B12R0.183 CCC(=O)NCCNCC(C)CC 270004a_100132302217_100000243153 [0,1,1,0,0,0|2,0,0]=4 3592 B12R0.183 CCC(=O)NCCNCC(C)CC 34a_100132302217_100000748023 [0,1,1,0,0,0|2,0,0]=4 3593 B12R0.183 CCC(=O)NCCNCC(O)CC 34a_100132302217_100011218378 [0,1,1,0,0,0|2,0,0]=4 3594 B12R0.183 CCC(=O)NCCNC[C@@H](C)CC 34a_100132302217_100009816398 [0,1,1,0,0,0|2,0,0]=4 3595 B12R0.183 CCC(=O)NCCOCC(C)CC 34a_200000158885_100000748023 [0,1,1,0,0,0|2,0,0]=4 3596 B12R0.183 CCC(=O)NCCOCC(C)CC 7a_200000158885_100000748023 [0,1,1,0,0,0|2,0,0]=4 3597 B12R0.183 CCC(=O)NCCOCC(O)CC 34a_200000158885_100011218378 [0,1,1,0,0,0|2,0,0]=4 3598 B12R0.183 CCC(=O)NCCOCC(O)CC 7a_200000158885_100011218378 [0,1,1,0,0,0|2,0,0]=4 3599 B12R0.183 CCC(=O)NCCOC[C@@H](C)CC 34a_200000158885_100009816398 [0,1,1,0,0,0|2,0,0]=4 3600 B12R0.183 CCC(=O)NCCOC[C@@H](C)CC 7a_200000158885_100009816398 [0,1,1,0,0,0|2,0,0]=4 3601 B12R0.183 CCC(=O)OCCOCC(C)CC 7a_200000031056_100000748023 [0,1,1,0,0,0|1,0,0]=3 3602 B12R0.183 CCC(=O)OCCOCC(O)CC 7a_200000031056_100011218378 [0,1,1,0,0,0|1,0,0]=3 3603 B12R0.183 CCC(=O)OCCOCC(O)CO 7a_200000031056_100011219619 [0,1,1,0,0,0|2,0,0]=4 3604 B12R0.183 CCC(=O)OCCOC[C@@H](C)CC 7a_200000031056_100009816398 [0,1,1,0,0,0|1,0,0]=3 3605 B12R0.183 CCC(=O)OCCOC[C@@H](C)CO 7a_200000031056_100000059175 [0,1,1,0,0,0|2,0,0]=4 3606 B12R0.183 CCC(=O)OCCOC[C@@H](O)CF 7a_200000031056_100015614560 [0,1,1,0,0,0|2,0,0]=4 3607 B12R0.183 CCC(=O)OCCOC[C@@H](O)CO 7a_200000031056_100009815848 [0,1,1,0,0,0|2,0,0]=4 3608 B12R0.183 CCC(C)COCCOC(=O)OC 34a_100010262106_100000748023 [0,1,1,0,0,0|2,0,0]=4 3609 B12R0.183 CCC(C)CSCCOC(=O)NC 62a_100000748023_200011997002 [0,1,1,0,0,0|2,0,0]=4 3610 B12R0.183 CCC(C)CSCCOC(=O)NC 62a_200011997002_100000748023 [0,1,1,0,0,0|2,0,0]=4 3611 B12R0.183 CCC(O)COCCOC(=O)OC 34a_100010262106_100011218378 [0,1,1,0,0,0|2,0,0]=4 3612 B12R0.183 CCC(O)CSCCOC(=O)NC 62a_100011218378_200011997002 [0,1,1,0,0,0|2,0,0]=4 3613 B12R0.183 CCC(O)CSCCOC(=O)NC 62a_200011997002_100011218378 [0,1,1,0,0,0|2,0,0]=4 3614 B12R0.183 CC[C@H](C)COCCOC(=O)NC 7a_100009816381_200011997002 [0,1,1,0,0,0|2,0,0]=4 3615 B12R0.183 CC[C@H](C)COCCOC(=O)OC 34a_100010262106_100009816398 [0,1,1,0,0,0|2,0,0]=4 3616 B12R0.183 CC[C@H](C)CSCCOC(=O)NC 62a_100009816398_200011997002 [0,1,1,0,0,0|2,0,0]=4 3617 B12R0.183 CC[C@H](C)CSCCOC(=O)NC 62a_200011997002_100009816398 [0,1,1,0,0,0|2,0,0]=4 3618 B12R0.184 C=C(C)CCOCCOC(=O)CC 7a_200000031056_100000730704 [0,1,1,0,0,0|1,0,1]=4 3619 B12R0.184 CC(C)CCCCCCC(=O)CF 1458a_100000040743_100015361967 [0,1,1,0,0,0|2,0,0]=4 3620 B12R0.184 CC(C)CCCCCNC(=O)CO 240690a_100011290863_100000210174 [0,1,1,0,0,0|2,0,0]=4 3621 B12R0.184 CC(C)CCCCCNC(=O)CO 527a_100011290863_100000210174 [0,1,1,0,0,0|2,0,0]=4 3622 B12R0.184 CCC(=O)CCCCCCC(C)C 1458a_100000040743_100000210202 [0,1,1,0,0,0|1,0,0]=3 3623 B12R0.184 CCC(=O)COCCCCC(C)C 34a_100000725409_100011216152 [0,1,1,0,0,0|2,0,0]=4 3624 B12R0.184 CCC(=O)COCCCCC(C)C 7a_100011214890_100000747405 [0,1,1,0,0,0|2,0,0]=4 3625 B12R0.184 CCC(=O)CSCCCCC(C)C 62a_100000747405_100011216152 [0,1,1,0,0,0|2,0,0]=4 3626 B12R0.184 CCC(=O)CSCCCCC(C)C 62a_100011216152_100000747405 [0,1,1,0,0,0|2,0,0]=4 3627 B12R0.184 CCC(=O)NCCCCCC(C)C 1626a_100011290863_100000210414 [0,1,1,0,0,0|1,0,0]=3 3628 B12R0.184 CCC(=O)NCCCCCC(C)C 240690a_100011290863_100000210414 [0,1,1,0,0,0|1,0,0]=3 3629 B12R0.184 CCC(=O)NCCCCCC(C)C 527a_100011290863_100000210414 [0,1,1,0,0,0|1,0,0]=3 3630 B12R0.184 CCC(=O)NCCCCCN(C)C 240690a_100020635752_100000210414 [0,1,1,0,0,0|2,0,0]=4 3631 B12R0.184 CCC(=O)NCCCOCC(C)C 11a_100000205972_100000210414 [0,1,1,0,0,0|2,0,0]=4 3632 B12R0.184 CCC(=O)NCCCOCC(C)C 1626a_100000205972_100000210414 [0,1,1,0,0,0|2,0,0]=4 3633 B12R0.184 CCC(=O)NCCCOCC(C)C 240690a_100000205972_100000210414 [0,1,1,0,0,0|2,0,0]=4 3634 B12R0.184 CCC(=O)NCCCOCC(C)C 527a_100000205972_100000210414 [0,1,1,0,0,0|2,0,0]=4 3635 B12R0.184 CCC(=O)NCCNCCC(C)C 269862a_100132302217_100000185833 [0,1,1,0,0,0|2,0,0]=4 3636 B12R0.184 CCC(=O)NCCNCCC(C)C 34a_100132302217_100000210312 [0,1,1,0,0,0|2,0,0]=4 3637 B12R0.184 CCC(=O)NCCNCCC(C)O 34a_100132302217_100012276601 [0,1,1,0,0,0|2,0,0]=4 3638 B12R0.184 CCC(=O)NCCOCCC(C)C 34a_200000158885_100000210312 [0,1,1,0,0,0|2,0,0]=4 3639 B12R0.184 CCC(=O)NCCOCCC(C)C 7a_200000158885_100000210626 [0,1,1,0,0,0|2,0,0]=4 3640 B12R0.184 CCC(=O)NCCOCCC(C)O 34a_200000158885_100012276601 [0,1,1,0,0,0|2,0,0]=4 3641 B12R0.184 CCC(=O)NCCOCCC(C)O 7a_200000158885_100012276601 [0,1,1,0,0,0|2,0,0]=4 3642 B12R0.184 CCC(=O)OCCOCCC(=O)C 7a_200000031056_100000053229 [0,1,1,0,0,0|1,0,1]=4 3643 B12R0.184 CCC(=O)OCCOCCC(C)C 7a_200000031056_100000210626 [0,1,1,0,0,0|1,0,0]=3 3644 B12R0.184 CCC(=O)OCCOCCC(C)O 7a_200000031056_100012276601 [0,1,1,0,0,0|1,0,0]=3 3645 B12R0.184 CCC(=O)OCCOCCN(C)C 7a_200000031056_100000755713 [0,1,1,0,0,0|2,0,0]=4 3646 B12R0.184 CCC(C)OCCCCCC(C)C 34a_100011995859_100011215416 [0,1,1,0,0,0|1,0,1]=4 3647 B12R0.184 CCC(C)OCCCCCC(C)C 7a_100000210228_100000210682 [0,1,1,0,0,0|1,0,1]=4 3648 B12R0.184 CCC(C)OCCCCCC(C)C 7a_100011995859_100000758301 [0,1,1,0,0,0|1,0,1]=4 3649 B12R0.184 CNC(=O)CCCCCCC(C)C 11a_106832991635_100000040743 [0,1,1,0,0,0|2,0,0]=4 3650 B12R0.184 CNC(=O)CCCCCCC(C)C 1626a_100102657272_100000040743 [0,1,1,0,0,0|2,0,0]=4 3651 B12R0.184 CNC(=O)CCCCCCC(C)C 240690a_100102657272_100000040743 [0,1,1,0,0,0|2,0,0]=4 3652 B12R0.184 CNC(=O)CCCCCCC(C)C 527a_100102657272_100000040743 [0,1,1,0,0,0|2,0,0]=4 3653 B12R0.184 CNC(=O)NCCCCCC(C)C 2708a_100011290863_106832991635 [0,1,1,0,0,0|2,0,0]=4 3654 B12R0.184 CNC(=O)NCCCCCC(C)C 2708a_100102657272_100011290863 [0,1,1,0,0,0|2,0,0]=4 3655 B12R0.184 CNC(=O)NCCCCCC(C)C 273464a_100011290863_100102657272 [0,1,1,0,0,0|2,0,0]=4 3656 B12R0.184 CNC(=O)NCCCCCC(C)C 273464a_100102657272_100011290863 [0,1,1,0,0,0|2,0,0]=4 3657 B12R0.184 CNC(=O)NCCCCCC(C)C 512a_100011290863_100102657272 [0,1,1,0,0,0|2,0,0]=4 3658 B12R0.184 CNC(=O)NCCCCCC(C)C 512a_106832991638_100011290863 [0,1,1,0,0,0|2,0,0]=4 3659 B12R0.184 CNC(=O)OCCOCCC(C)Br 34a_100009893172_200011997002 [0,1,1,0,0,0|2,0,0]=4 3660 B12R0.184 CNC(=O)OCCOCCC(C)C 34a_100000210254_200011997002 [0,1,1,0,0,0|2,0,0]=4 3661 B12R0.184 CNC(=O)OCCOCCC(C)C 7a_100000210254_200011997002 [0,1,1,0,0,0|2,0,0]=4 3662 B12R0.184 CNC(=O)OCCOCC[C@@H](C)N 34a_100000706166_200011997002 [0,1,1,0,0,0|2,0,0]=4 3663 B12R0.184 CNC(=O)OCCSCCC(C)C 62a_100000210312_200011997002 [0,1,1,0,0,0|2,0,0]=4 3664 B12R0.184 CNC(=O)OCCSCCC(C)C 62a_200011997002_100000210312 [0,1,1,0,0,0|2,0,0]=4 3665 B12R0.184 CNC(=O)OCCSCCC(C)O 62a_100012276601_200011997002 [0,1,1,0,0,0|2,0,0]=4 3666 B12R0.184 CNC(=O)OCCSCCC(C)O 62a_200011997002_100012276601 [0,1,1,0,0,0|2,0,0]=4 3667 B12R0.184 COC(=O)OCCOCCC(C)C 34a_100010262106_100000210312 [0,1,1,0,0,0|2,0,0]=4 3668 B12R0.184 COC(=O)OCCOCCC(C)O 34a_100010262106_100012276601 [0,1,1,0,0,0|2,0,0]=4 3669 B12R0.184 COC(=O)OCSCCCC(C)C 62a_100011214892_100000139417 [0,1,1,0,0,0|2,0,0]=4 3670 B12R0.184 COC(=O)OCSCCCC(C)O 62a_200000718107_100000139417 [0,1,1,0,0,0|2,0,0]=4 3671 B12R0.248 C#CCCCCCCCC(=O)CC 1458a_100000087357_100000210202 [0,1,1,0,0,0|1,0,1]=4 3672 B12R0.248 C#CCCCCCCCC(=O)CC 1458a_100000210414_100153394163 [0,1,1,0,0,0|1,0,1]=4 3673 B12R0.248 C#CCCCCCOCC(=O)CC 34a_100000725409_100012094781 [0,1,1,0,0,0|0,0,2]=4 3674 B12R0.248 C#CCCCCCOCC(=O)CC 7a_100000766912_100000747405 [0,1,1,0,0,0|0,0,2]=4 3675 B12R0.248 C#CCCCOCCOC(=O)CC 7a_200000031056_100011215417 [0,1,1,0,0,0|0,0,2]=4 3676 B12R0.248 C=CC(=O)OCCCCCCNC 2230a_106832991635_100009894100 [0,1,1,0,0,0|0,0,2]=4 3677 B12R0.248 C=CC(=O)OCCCCCCNC 34a_100102657272_100009894100 [0,1,1,0,0,0|0,0,2]=4 3678 B12R0.248 C=CC(=O)OCCCCCCNC 7a_106832991635_100009894100 [0,1,1,0,0,0|0,0,2]=4 3679 B12R0.248 C=CC(=O)OCCCCCCOC 34a_100138415774_100009894100 [0,1,1,0,0,0|0,0,2]=4 3680 B12R0.248 C=CC(=O)OCCCCCCSC 62a_100009894100_200000210301 [0,1,1,0,0,0|0,0,2]=4 3681 B12R0.248 C=CC(=O)OCCCCCCSC 62a_200000210301_100009894100 [0,1,1,0,0,0|0,0,2]=4 3682 B12R0.248 C=CC(=O)OCCCCCCS[13CH3] 62a_100009894100_200025704644 [0,1,1,0,0,0|0,0,2]=4 3683 B12R0.248 C=CC(=O)OCCCCCCS[13CH3] 62a_200025704644_100009894100 [0,1,1,0,0,0|0,0,2]=4 3684 B12R0.248 C=CC(=O)OCCCCCOCC 7a_200011023508_100000210202 [0,1,1,0,0,0|0,0,2]=4 3685 B12R0.248 C=CC(=O)OCCNCCCCC 2230a_100000209983_100009813456 [0,1,1,0,0,0|0,0,2]=4 3686 B12R0.248 C=CC(=O)OCCOCCCCC 34a_100000210253_100009813456 [0,1,1,0,0,0|0,0,2]=4 3687 B12R0.248 C=CC(=O)OCCOCCCCC 7a_100000210253_100009813456 [0,1,1,0,0,0|0,0,2]=4 3688 B12R0.248 C=CC(=O)OCCSCCCCC 62a_100000210326_100009813456 [0,1,1,0,0,0|0,0,2]=4 3689 B12R0.248 C=CC(=O)OCCSCCCCC 62a_100009813456_100000210326 [0,1,1,0,0,0|0,0,2]=4 3690 B12R0.248 C=CCCCCCCCC(=O)CC 1458a_100000210414_100012355270 [0,1,1,0,0,0|1,0,1]=4 3691 B12R0.248 C=CCCCCCCCC(=O)CC 1458a_100011216160_100000210202 [0,1,1,0,0,0|1,0,1]=4 3692 B12R0.248 C=CCCCCCOCC(=O)CC 34a_100000725409_100000700193 [0,1,1,0,0,0|0,0,2]=4 3693 B12R0.248 C=CCCCCCOCC(=O)CC 7a_100011216702_100000747405 [0,1,1,0,0,0|0,0,2]=4 3694 B12R0.248 C=CCCCOCCOC(=O)CC 7a_200000031056_100000757094 [0,1,1,0,0,0|0,0,2]=4 3695 B12R0.248 CC/C=C/CCCOCC(=O)CC 7a_100016287902_100000747405 [0,1,1,0,0,0|0,0,2]=4 3696 B12R0.248 CC/C=C\COCCOC(=O)CC 7a_200000031056_100103147603 [0,1,1,0,0,0|0,0,2]=4 3697 B12R0.248 CCC#CCOCCOC(=O)CC 7a_200000031056_100009813939 [0,1,1,0,0,0|0,0,2]=4 3698 B12R0.248 CCC(=O)CCCCCCCCO 1458a_100000210414_100000033203 [0,1,1,0,0,0|1,0,0]=3 3699 B12R0.248 CCC(=O)COCCCCCCBr 7a_100011215345_100000747405 [0,1,1,0,0,0|1,0,0]=3 3700 B12R0.248 CCC(=O)COCCCCCCCl 7a_100000766143_100000747405 [0,1,1,0,0,0|1,0,0]=3 3701 B12R0.248 CCC(=O)COCCCCCCF 34a_100000725409_100015922095 [0,1,1,0,0,0|1,0,0]=3 3702 B12R0.248 CCC(=O)COCCCCCCF 7a_100000732779_100000747405 [0,1,1,0,0,0|1,0,0]=3 3703 B12R0.248 CCC(=O)COCCCCCCO 34a_100000725409_100000766143 [0,1,1,0,0,0|1,0,0]=3 3704 B12R0.248 CCC(=O)COCCOCCOC 1458a_100011214951_100000210202 [0,1,1,0,0,0|2,0,0]=4 3705 B12R0.248 CCC(=O)COCCOCCOC 34a_100000725409_100000695917 [0,1,1,0,0,0|2,0,0]=4 3706 B12R0.248 CCC(=O)COCCOCCOC 7a_100011215163_100000747405 [0,1,1,0,0,0|2,0,0]=4 3707 B12R0.248 CCC(=O)CSCCCCCCF 62a_100000747405_100015922095 [0,1,1,0,0,0|1,1,0]=4 3708 B12R0.248 CCC(=O)CSCCCCCCF 62a_100015922095_100000747405 [0,1,1,0,0,0|1,1,0]=4 3709 B12R0.248 CCC(=O)CSCCCCCCO 62a_100000747405_100000766143 [0,1,1,0,0,0|1,1,0]=4 3710 B12R0.248 CCC(=O)CSCCCCCCO 62a_100000766143_100000747405 [0,1,1,0,0,0|1,1,0]=4 3711 B12R0.248 CCC(=O)NCCCCCCCO 240690a_100011996573_100000210414 [0,1,1,0,0,0|1,0,0]=3 3712 B12R0.248 CCC(=O)NCCCOCCCO 240690a_100011310245_100000210414 [0,1,1,0,0,0|2,0,0]=4 3713 B12R0.248 CCC(=O)NCCCOCCOC 1626a_100000206027_100000210414 [0,1,1,0,0,0|2,0,0]=4 3714 B12R0.248 CCC(=O)NCCCOCCOC 240690a_100000206027_100000210414 [0,1,1,0,0,0|2,0,0]=4 3715 B12R0.248 CCC(=O)NCCNCCCCF 34a_100132302217_100000729493 [0,1,1,0,0,0|2,0,0]=4 3716 B12R0.248 CCC(=O)NCCNCCCCO 34a_100132302217_100011216708 [0,1,1,0,0,0|2,0,0]=4 3717 B12R0.248 CCC(=O)NCCNCCCOC 34a_100132302217_100000740836 [0,1,1,0,0,0|2,0,0]=4 3718 B12R0.248 CCC(=O)NCCOCCCCF 34a_200000158885_100000729493 [0,1,1,0,0,0|2,0,0]=4 3719 B12R0.248 CCC(=O)NCCOCCCCF 7a_200000158885_100000729493 [0,1,1,0,0,0|2,0,0]=4 3720 B12R0.248 CCC(=O)NCCOCCCCO 34a_200000158885_100011216708 [0,1,1,0,0,0|2,0,0]=4 3721 B12R0.248 CCC(=O)NCCOCCCCO 7a_200000158885_100000210776 [0,1,1,0,0,0|2,0,0]=4 3722 B12R0.248 CCC(=O)NCCOCCCOC 34a_200000158885_100000740836 [0,1,1,0,0,0|2,0,0]=4 3723 B12R0.248 CCC(=O)NCCOCCCOC 7a_200000158885_100000740836 [0,1,1,0,0,0|2,0,0]=4 3724 B12R0.248 CCC(=O)OCCOCCCC#N 7a_200000031056_100000687738 [0,1,1,0,0,0|1,0,1]=4 3725 B12R0.248 CCC(=O)OCCOCCCC=O 7a_200000031056_200011292268 [0,1,1,0,0,0|1,0,1]=4 3726 B12R0.248 CCC(=O)OCCOCCCCF 7a_200000031056_100000729493 [0,1,1,0,0,0|1,0,0]=3 3727 B12R0.248 CCC(=O)OCCOCCCCO 7a_200000031056_100000210776 [0,1,1,0,0,0|1,0,0]=3 3728 B12R0.248 CCC(=O)OCCOCCCOC 7a_200000031056_100000740836 [0,1,1,0,0,0|1,0,0]=3 3729 B12R0.248 CCC(C)OCCCCCCCBr 34a_100000760002_100011215416 [0,1,1,0,0,0|1,0,1]=4 3730 B12R0.248 CCC(C)OCCCCCCCBr 7a_100000760002_100000758301 [0,1,1,0,0,0|1,0,1]=4 3731 B12R0.248 CCC(C)OCCCCCCCN 34a_100011996573_100011215416 [0,1,1,0,0,0|1,0,1]=4 3732 B12R0.248 CCC(C)OCCCCCCCO 7a_100000210228_100000760002 [0,1,1,0,0,0|1,0,1]=4 3733 B12R0.248 CCC(C)OCCCCCCOC 34a_200012092642_100011215416 [0,1,1,0,0,0|1,0,1]=4 3734 B12R0.248 CCC(C)OCCCCCCOC 7a_100000210228_100011998445 [0,1,1,0,0,0|1,0,1]=4 3735 B12R0.248 CCC(C)OCCCCCCOC 7a_200012092642_100000758301 [0,1,1,0,0,0|1,0,1]=4 3736 B12R0.248 CCCC#CCCOCC(=O)CC 7a_100000042726_100000747405 [0,1,1,0,0,0|0,0,2]=4 3737 B12R0.248 CCCC/C=C/COCC(=O)CC 7a_200016272032_100000747405 [0,1,1,0,0,0|0,0,2]=4 3738 B12R0.248 CCCCC#CCCCC(=O)CC 1458a_100000210414_200000047210 [0,1,1,0,0,0|1,0,1]=4 3739 B12R0.248 CCCCC#CCOCC(=O)CC 7a_200000034558_100000747405 [0,1,1,0,0,0|0,0,2]=4 3740 B12R0.248 CCCCC/C=C/CCC(=O)CC 1458a_200015255902_100000210202 [0,1,1,0,0,0|1,0,1]=4 3741 B12R0.248 CCCCCC/C=C/CC(=O)CC 1458a_100020681715_100000210202 [0,1,1,0,0,0|1,0,1]=4 3742 B12R0.248 CCCCCCC=NNC(=O)CC 4a_100000183195_100000234349 [0,1,1,0,0,0|1,0,1]=4 3743 B12R0.248 CCCCCCCC=CC(=O)CC 1458a_200015332781_100000210202 [0,1,1,0,0,0|1,0,0]=3 3744 B12R0.248 CCCCCCCC=CC(=O)CF 1458a_200015332781_100015361967 [0,1,1,0,0,0|2,0,0]=4 3745 B12R0.248 CCCCCCCC=CC(=O)NC 11a_106832991635_200015332781 [0,1,1,0,0,0|2,0,0]=4 3746 B12R0.248 CCCCCCCC=CC(=O)NC 1626a_100102657272_200015332781 [0,1,1,0,0,0|2,0,0]=4 3747 B12R0.248 CCCCCCCC=CC(=O)NC 240690a_100102657272_200015332781 [0,1,1,0,0,0|2,0,0]=4 3748 B12R0.248 CCCCCCCCCC(=O)CC 1458a_100000210414_100000210670 [0,1,1,0,0,0|1,0,0]=3 3749 B12R0.248 CCCCCCCCCC(=O)CC 1458a_100000210558_100000210202 [0,1,1,0,0,0|1,0,0]=3 3750 B12R0.248 CCCCCCCCCC(=O)CF 1458a_100000210558_100015361967 [0,1,1,0,0,0|2,0,0]=4 3751 B12R0.248 CCCCCCCCCC(=O)CO 1458a_100000210174_100000210670 [0,1,1,0,0,0|2,0,0]=4 3752 B12R0.248 CCCCCCCCCC(=O)NC 11a_106832991635_100000210558 [0,1,1,0,0,0|2,0,0]=4 3753 B12R0.248 CCCCCCCCCC(=O)NC 1626a_100102657272_100000210558 [0,1,1,0,0,0|2,0,0]=4 3754 B12R0.248 CCCCCCCCCC(=O)NC 240690a_100102657272_100000210558 [0,1,1,0,0,0|2,0,0]=4 3755 B12R0.248 CCCCCCCCCC(=O)NC 527a_100102657272_100000210558 [0,1,1,0,0,0|2,0,0]=4 3756 B12R0.248 CCCCCCCCNC(=O)CC 11a_100000229939_100000210414 [0,1,1,0,0,0|1,0,0]=3 3757 B12R0.248 CCCCCCCCNC(=O)CC 1626a_100000229939_100000210414 [0,1,1,0,0,0|1,0,0]=3 3758 B12R0.248 CCCCCCCCNC(=O)CC 240690a_100000229939_100000210414 [0,1,1,0,0,0|1,0,0]=3 3759 B12R0.248 CCCCCCCCNC(=O)CC 527a_100000229939_100000210414 [0,1,1,0,0,0|1,0,0]=3 3760 B12R0.248 CCCCCCCCNC(=O)CO 240690a_100000229939_100000210174 [0,1,1,0,0,0|2,0,0]=4 3761 B12R0.248 CCCCCCCCNC(=O)CO 527a_100000229939_100000210174 [0,1,1,0,0,0|2,0,0]=4 3762 B12R0.248 CCCCCCCCNC(=O)NC 2708a_100000229939_106832991635 [0,1,1,0,0,0|2,0,0]=4 3763 B12R0.248 CCCCCCCCNC(=O)NC 2708a_100102657272_100000229939 [0,1,1,0,0,0|2,0,0]=4 3764 B12R0.248 CCCCCCCCNC(=O)NC 273464a_100000229939_100102657272 [0,1,1,0,0,0|2,0,0]=4 3765 B12R0.248 CCCCCCCCNC(=O)NC 273464a_100102657272_100000229939 [0,1,1,0,0,0|2,0,0]=4 3766 B12R0.248 CCCCCCCCNC(=O)NC 512a_100000229939_100102657272 [0,1,1,0,0,0|2,0,0]=4 3767 B12R0.248 CCCCCCCCNC(=O)NC 512a_106832991638_100000229939 [0,1,1,0,0,0|2,0,0]=4 3768 B12R0.248 CCCCCCCCOC(C)CC 34a_100000210232_100011215416 [0,1,1,0,0,0|1,0,1]=4 3769 B12R0.248 CCCCCCCCOC(C)CC 7a_100000210228_100000210759 [0,1,1,0,0,0|1,0,1]=4 3770 B12R0.248 CCCCCCCCOC(C)CC 7a_100000210232_100000758301 [0,1,1,0,0,0|1,0,1]=4 3771 B12R0.248 CCCCCCCNCC(=O)NC 2230a_100000229938_100000183359 [0,1,1,0,0,0|2,0,0]=4 3772 B12R0.248 CCCCCCCNCC(=O)NC 2230a_100000693194_100000210681 [0,1,1,0,0,0|2,0,0]=4 3773 B12R0.248 CCCCCCCNCC(=O)OC 2230a_100000229938_100000747449 [0,1,1,0,0,0|2,0,0]=4 3774 B12R0.248 CCCCCCCOCC(=O)CC 34a_100000725409_100000210614 [0,1,1,0,0,0|0,0,0]=2 3775 B12R0.248 CCCCCCCOCC(=O)CC 7a_100000210272_100000747405 [0,1,1,0,0,0|0,0,0]=2 3776 B12R0.248 CCCCCCCOCC(=O)NC 34a_100000210272_100000183359 [0,1,1,0,0,0|1,0,0]=3 3777 B12R0.248 CCCCCCCOCC(=O)NC 34a_100000750040_100000210614 [0,1,1,0,0,0|1,0,0]=3 3778 B12R0.248 CCCCCCCOCC(=O)NC 7a_100000210272_100000183359 [0,1,1,0,0,0|1,0,0]=3 3779 B12R0.248 CCCCCCCOCC(=O)OC 34a_100000210272_100000747449 [0,1,1,0,0,0|1,0,0]=3 3780 B12R0.248 CCCCCCCOCC(=O)OC 7a_100000210272_100000747449 [0,1,1,0,0,0|1,0,0]=3 3781 B12R0.248 CCCCCCCOCC(C)CC 34a_100000210272_100000748023 [0,1,1,0,0,0|1,0,1]=4 3782 B12R0.248 CCCCCCCOCC(C)CC 7a_100000210272_100000748023 [0,1,1,0,0,0|1,0,1]=4 3783 B12R0.248 CCCCCCCOCC(O)CC 34a_100000210272_100011218378 [0,1,1,0,0,0|0,0,2]=4 3784 B12R0.248 CCCCCCCOCC(O)CC 7a_100000210272_100011218378 [0,1,1,0,0,0|0,0,2]=4 3785 B12R0.248 CCCCCCCOC[C@@H](C)CC 34a_100000210272_100009816398 [0,1,1,0,0,0|1,0,1]=4 3786 B12R0.248 CCCCCCCOC[C@@H](C)CC 7a_100000210272_100009816398 [0,1,1,0,0,0|1,0,1]=4 3787 B12R0.248 CCCCCCCOC[C@@H](C)CC 7a_100009816381_100000210614 [0,1,1,0,0,0|1,0,1]=4 3788 B12R0.248 CCCCCCCSCC(=O)CC 62a_100000210614_100000747405 [0,1,1,0,0,0|0,1,0]=3 3789 B12R0.248 CCCCCCCSCC(=O)CC 62a_100000747405_100000210316 [0,1,1,0,0,0|0,1,0]=3 3790 B12R0.248 CCCCCCCSCC(=O)NC 62a_100000183359_100000210316 [0,1,1,0,0,0|1,1,0]=4 3791 B12R0.248 CCCCCCCSCC(=O)NC 62a_100000210614_100000183359 [0,1,1,0,0,0|1,1,0]=4 3792 B12R0.248 CCCCCCCSCC(=O)OC 62a_100000210614_100000747449 [0,1,1,0,0,0|1,1,0]=4 3793 B12R0.248 CCCCCCCSCC(=O)OC 62a_100000747449_100000210316 [0,1,1,0,0,0|1,1,0]=4 3794 B12R0.248 CCCCCCNCCC(=O)NC 2230a_100000210581_100000737683 [0,1,1,0,0,0|2,0,0]=4 3795 B12R0.248 CCCCCCNCCC(=O)NC 2230a_100000738227_100000210314 [0,1,1,0,0,0|2,0,0]=4 3796 B12R0.248 CCCCCCNCCC(=O)NC 34a_100000738227_100000210314 [0,1,1,0,0,0|2,0,0]=4 3797 B12R0.248 CCCCCCNCCC(=O)OC 2230a_100000210581_100000204255 [0,1,1,0,0,0|2,0,0]=4 3798 B12R0.248 CCCCCCOCCC(=O)NC 34a_100000210259_100012179268 [0,1,1,0,0,0|2,0,0]=4 3799 B12R0.248 CCCCCCOCCC(=O)NC 34a_100000754576_100000210314 [0,1,1,0,0,0|2,0,0]=4 3800 B12R0.248 CCCCCCOCCC(=O)NC 7a_100000210259_100000737683 [0,1,1,0,0,0|2,0,0]=4 3801 B12R0.248 CCCCCCOCCC(=O)OC 34a_100000210259_100000742370 [0,1,1,0,0,0|2,0,0]=4 3802 B12R0.248 CCCCCCOCCC(=O)OC 7a_100000210259_100000204255 [0,1,1,0,0,0|2,0,0]=4 3803 B12R0.248 CCCCCCSCCC(=O)NC 62a_100000210314_100000737683 [0,1,1,0,0,0|2,0,0]=4 3804 B12R0.248 CCCCCCSCCC(=O)NC 62a_100000737683_100000210757 [0,1,1,0,0,0|2,0,0]=4 3805 B12R0.248 CCCCCCSCCC(=O)OC 62a_100000204255_100000210757 [0,1,1,0,0,0|2,0,0]=4 3806 B12R0.248 CCCCCCSCCC(=O)OC 62a_100000210314_100000204255 [0,1,1,0,0,0|2,0,0]=4 3807 B12R0.248 CCCCCCSCOC(=O)OC 62a_100000210314_100000139417 [0,1,1,0,0,0|1,0,0]=3 3808 B12R0.248 CCCCCNCCCC(=O)NC 2230a_100000209983_100000741757 [0,1,1,0,0,0|2,0,0]=4 3809 B12R0.248 CCCCCNCCCC(=O)NC 2230a_100000740002_100000210326 [0,1,1,0,0,0|2,0,0]=4 3810 B12R0.248 CCCCCNCCCC(=O)NC 34a_100000740002_100000718602 [0,1,1,0,0,0|2,0,0]=4 3811 B12R0.248 CCCCCNCCCC(=O)OC 2230a_100000209983_100011218270 [0,1,1,0,0,0|2,0,0]=4 3812 B12R0.248 CCCCCNCCNC(=O)CC 34a_100132302217_100000718602 [0,1,1,0,0,0|1,0,0]=3 3813 B12R0.248 CCCCCNCCNC(=O)NC 34a_100015205895_100000718602 [0,1,1,0,0,0|2,0,0]=4 3814 B12R0.248 CCCCCNCCOC(C)CC 34a_100000224656_100011215416 [0,1,1,0,0,0|1,0,1]=4 3815 B12R0.248 CCCCCOCCCC(=O)NC 34a_100000210253_100000741757 [0,1,1,0,0,0|2,0,0]=4 3816 B12R0.248 CCCCCOCCCC(=O)NC 7a_100000210253_100000741757 [0,1,1,0,0,0|2,0,0]=4 3817 B12R0.248 CCCCCOCCCC(=O)OC 34a_100000210253_100000742333 [0,1,1,0,0,0|2,0,0]=4 3818 B12R0.248 CCCCCOCCCC(=O)OC 7a_100000210253_100011218270 [0,1,1,0,0,0|2,0,0]=4 3819 B12R0.248 CCCCCOCCNC(=O)CC 34a_200000158885_100000718602 [0,1,1,0,0,0|1,0,0]=3 3820 B12R0.248 CCCCCOCCNC(=O)CC 7a_200000158885_100000210326 [0,1,1,0,0,0|1,0,0]=3 3821 B12R0.248 CCCCCOCCNC(=O)OC 34a_100000757965_100000718602 [0,1,1,0,0,0|2,0,0]=4 3822 B12R0.248 CCCCCOCCOC(=O)CC 7a_200000031056_100000210326 [0,1,1,0,0,0|0,0,0]=2 3823 B12R0.248 CCCCCOCCOC(=O)NC 34a_100000210253_200011997002 [0,1,1,0,0,0|1,0,0]=3 3824 B12R0.248 CCCCCOCCOC(=O)NC 7a_100000210253_200011997002 [0,1,1,0,0,0|1,0,0]=3 3825 B12R0.248 CCCCCOCCOC(=O)OC 34a_100010262106_100000718602 [0,1,1,0,0,0|1,0,0]=3 3826 B12R0.248 CCCCCOCCOC(C)CC 34a_100011215259_100011215416 [0,1,1,0,0,0|1,0,1]=4 3827 B12R0.248 CCCCCOCCOC(C)CC 7a_100011215259_100000758301 [0,1,1,0,0,0|1,0,1]=4 3828 B12R0.248 CCCCCSCCCC(=O)NC 62a_100000210326_100000741757 [0,1,1,0,0,0|2,0,0]=4 3829 B12R0.248 CCCCCSCCCC(=O)NC 62a_100000741757_100000210326 [0,1,1,0,0,0|2,0,0]=4 3830 B12R0.248 CCCCCSCCCC(=O)OC 62a_100000210326_100011218270 [0,1,1,0,0,0|2,0,0]=4 3831 B12R0.248 CCCCCSCCCC(=O)OC 62a_100011218270_100000210326 [0,1,1,0,0,0|2,0,0]=4 3832 B12R0.248 CCCCCSCCOC(=O)NC 62a_100000210326_200011997002 [0,1,1,0,0,0|1,0,0]=3 3833 B12R0.248 CCCCCSCCOC(=O)NC 62a_200011997002_100000210326 [0,1,1,0,0,0|1,0,0]=3 3834 B12R0.248 CCCCNCCCCC(=O)OC 2230a_100000102301_100000204269 [0,1,1,0,0,0|2,0,0]=4 3835 B12R0.248 CCCCNCCCCC(=O)OC 7a_106832991798_100000204269 [0,1,1,0,0,0|2,0,0]=4 3836 B12R0.248 CCCCNCCOCC(=O)OC 2230a_100000102301_100000090808 [0,1,1,0,0,0|2,0,0]=4 3837 B12R0.248 CCCCNCCOCC(=O)OC 7a_106832991798_100000090808 [0,1,1,0,0,0|2,0,0]=4 3838 B12R0.248 CCCCOCCCCC(=O)OC 34a_100000059025_100000210210 [0,1,1,0,0,0|2,0,0]=4 3839 B12R0.248 CCCCOCCCCC(=O)OC 34a_100000210227_100000204269 [0,1,1,0,0,0|2,0,0]=4 3840 B12R0.248 CCCCOCCCCC(=O)OC 7a_100000059025_100000210211 [0,1,1,0,0,0|2,0,0]=4 3841 B12R0.248 CCCCOCCCCC(=O)OC 7a_100000210227_100000204269 [0,1,1,0,0,0|2,0,0]=4 3842 B12R0.248 CCCCOCCCNC(=O)CC 1626a_200000211371_100000210414 [0,1,1,0,0,0|1,0,0]=3 3843 B12R0.248 CCCCOCCCNC(=O)CC 240690a_200000211371_100000210414 [0,1,1,0,0,0|1,0,0]=3 3844 B12R0.248 CCCCOCCCNC(=O)CC 527a_200000211371_100000210414 [0,1,1,0,0,0|1,0,0]=3 3845 B12R0.248 CCCCOCCCNC(=O)CO 240690a_200000211371_100000210174 [0,1,1,0,0,0|2,0,0]=4 3846 B12R0.248 CCCCOCCCNC(=O)CO 527a_200000211371_100000210174 [0,1,1,0,0,0|2,0,0]=4 3847 B12R0.248 CCCCOCCCNC(=O)NC 2708a_100102657272_200000211371 [0,1,1,0,0,0|2,0,0]=4 3848 B12R0.248 CCCCOCCCNC(=O)NC 2708a_200000211371_106832991635 [0,1,1,0,0,0|2,0,0]=4 3849 B12R0.248 CCCCOCCCNC(=O)NC 273464a_100102657272_200000211371 [0,1,1,0,0,0|2,0,0]=4 3850 B12R0.248 CCCCOCCCNC(=O)NC 273464a_200000211371_100102657272 [0,1,1,0,0,0|2,0,0]=4 3851 B12R0.248 CCCCOCCCNC(=O)NC 512a_106832991638_200000211371 [0,1,1,0,0,0|2,0,0]=4 3852 B12R0.248 CCCCOCCCNC(=O)NC 512a_200000211371_100102657272 [0,1,1,0,0,0|2,0,0]=4 3853 B12R0.248 CCCCOCCCOC(C)CC 34a_200011215613_100011215416 [0,1,1,0,0,0|1,0,1]=4 3854 B12R0.248 CCCCOCCCOC(C)CC 7a_200011215613_100000758301 [0,1,1,0,0,0|1,0,1]=4 3855 B12R0.248 CCCCOCCOCC(=O)CC 1458a_100011216887_100000210202 [0,1,1,0,0,0|1,0,0]=3 3856 B12R0.248 CCCCOCCOCC(=O)CC 34a_100000725409_100000743108 [0,1,1,0,0,0|1,0,0]=3 3857 B12R0.248 CCCCOCCOCC(=O)CC 7a_100000210238_100000747405 [0,1,1,0,0,0|1,0,0]=3 3858 B12R0.248 CCCCOCCOCC(=O)CF 1458a_100011216887_100015361967 [0,1,1,0,0,0|2,0,0]=4 3859 B12R0.248 CCCCOCCOCC(=O)NC 11a_106832991635_100011216887 [0,1,1,0,0,0|2,0,0]=4 3860 B12R0.248 CCCCOCCOCC(=O)NC 1626a_100102657272_100011216887 [0,1,1,0,0,0|2,0,0]=4 3861 B12R0.248 CCCCOCCOCC(=O)NC 240690a_100102657272_100011216887 [0,1,1,0,0,0|2,0,0]=4 3862 B12R0.248 CCCCOCCOCC(=O)NC 34a_100000210238_100000183359 [0,1,1,0,0,0|2,0,0]=4 3863 B12R0.248 CCCCOCCOCC(=O)NC 34a_100000750040_100000743108 [0,1,1,0,0,0|2,0,0]=4 3864 B12R0.248 CCCCOCCOCC(=O)NC 527a_100102657272_100011216887 [0,1,1,0,0,0|2,0,0]=4 3865 B12R0.248 CCCCOCCOCC(=O)NC 7a_100000210238_100000183359 [0,1,1,0,0,0|2,0,0]=4 3866 B12R0.248 CCCCOCCOCC(=O)OC 34a_100000210227_100000090808 [0,1,1,0,0,0|2,0,0]=4 3867 B12R0.248 CCCCOCCOCC(=O)OC 34a_100000210238_100000747449 [0,1,1,0,0,0|2,0,0]=4 3868 B12R0.248 CCCCOCCOCC(=O)OC 7a_100000210227_100000090808 [0,1,1,0,0,0|2,0,0]=4 3869 B12R0.248 CCCCOCCOCC(=O)OC 7a_100000210238_100000747449 [0,1,1,0,0,0|2,0,0]=4 3870 B12R0.248 CCCCOCCSCC(=O)CC 62a_100000743108_100000747405 [0,1,1,0,0,0|1,1,0]=4 3871 B12R0.248 CCCCOCCSCC(=O)CC 62a_100000747405_100000743108 [0,1,1,0,0,0|1,1,0]=4 3872 B12R0.248 CCCCOCSCOC(=O)OC 62a_100011995733_100000139417 [0,1,1,0,0,0|2,0,0]=4 3873 B12R0.248 CCCCSCCCCC(=O)OC 62a_100000204269_100000210210 [0,1,1,0,0,0|2,0,0]=4 3874 B12R0.248 CCCCSCCCCC(=O)OC 62a_100000210211_100000204269 [0,1,1,0,0,0|2,0,0]=4 3875 B12R0.248 CCCCSCCOCC(=O)CC 7a_200000230436_100000747405 [0,1,1,0,0,0|1,0,0]=3 3876 B12R0.248 CCCCSCCOCC(=O)NC 34a_200000230436_100000183359 [0,1,1,0,0,0|2,0,0]=4 3877 B12R0.248 CCCCSCCOCC(=O)NC 7a_200000230436_100000183359 [0,1,1,0,0,0|2,0,0]=4 3878 B12R0.248 CCCCSCCOCC(=O)OC 34a_200000230436_100000747449 [0,1,1,0,0,0|2,0,0]=4 3879 B12R0.248 CCCCSCCOCC(=O)OC 62a_100000090808_100000210210 [0,1,1,0,0,0|2,0,0]=4 3880 B12R0.248 CCCCSCCOCC(=O)OC 62a_100000210211_100000090808 [0,1,1,0,0,0|2,0,0]=4 3881 B12R0.248 CCCCSCCOCC(=O)OC 7a_200000230436_100000747449 [0,1,1,0,0,0|2,0,0]=4 3882 B12R0.248 CCCOCCCCCC(=O)OC 34a_100000074720_100000210303 [0,1,1,0,0,0|2,0,0]=4 3883 B12R0.248 CCCOCCCCCC(=O)OC 34a_100000210258_100009816466 [0,1,1,0,0,0|2,0,0]=4 3884 B12R0.248 CCCOCCCCCC(=O)OC 7a_100000074720_100000210303 [0,1,1,0,0,0|2,0,0]=4 3885 B12R0.248 CCCOCCSCOC(=O)OC 62a_100011215938_100000139417 [0,1,1,0,0,0|2,0,0]=4 3886 B12R0.248 CCCSCCCCCC(=O)OC 62a_100000210303_100009816466 [0,1,1,0,0,0|2,0,0]=4 3887 B12R0.248 CCCSCCCCCC(=O)OC 62a_100009816466_100000210303 [0,1,1,0,0,0|2,0,0]=4 3888 B12R0.248 CCNCCCCCCC(=O)OC 2230a_100015525214_100009815986 [0,1,1,0,0,0|2,0,0]=4 3889 B12R0.248 CCOCCCCCCC(=O)OC 34a_100009863599_100000210202 [0,1,1,0,0,0|2,0,0]=4 3890 B12R0.248 CCOCCCCCCC(=O)OC 34a_100121572206_100009815986 [0,1,1,0,0,0|2,0,0]=4 3891 B12R0.248 CCOCCCCCCC(=O)OC 7a_100009863599_100000210202 [0,1,1,0,0,0|2,0,0]=4 3892 B12R0.248 CCOCCCSCOC(=O)OC 62a_100012232248_100000139417 [0,1,1,0,0,0|2,0,0]=4 3893 B12R0.248 CCOCCNCCNC(=O)CC 34a_100132302217_100000210147 [0,1,1,0,0,0|2,0,0]=4 3894 B12R0.248 CCOCCNCCOC(=O)NC 34a_102516460346_200011997002 [0,1,1,0,0,0|2,0,0]=4 3895 B12R0.248 CCOCCOCCNC(=O)CC 11a_100102712874_100000210414 [0,1,1,0,0,0|2,0,0]=4 3896 B12R0.248 CCOCCOCCNC(=O)CC 1626a_100102712874_100000210414 [0,1,1,0,0,0|2,0,0]=4 3897 B12R0.248 CCOCCOCCNC(=O)CC 240690a_100102712874_100000210414 [0,1,1,0,0,0|2,0,0]=4 3898 B12R0.248 CCOCCOCCNC(=O)CC 34a_200000158885_100000210147 [0,1,1,0,0,0|2,0,0]=4 3899 B12R0.248 CCOCCOCCNC(=O)CC 527a_100102712874_100000210414 [0,1,1,0,0,0|2,0,0]=4 3900 B12R0.248 CCOCCOCCNC(=O)CC 7a_200000158885_100011215890 [0,1,1,0,0,0|2,0,0]=4 3901 B12R0.248 CCOCCOCCOC(=O)CC 7a_200000031056_100011215890 [0,1,1,0,0,0|1,0,0]=3 3902 B12R0.248 CCOCCOCCOC(=O)NC 34a_100000210136_200011997002 [0,1,1,0,0,0|2,0,0]=4 3903 B12R0.248 CCOCCOCCOC(=O)NC 7a_100000210136_200011997002 [0,1,1,0,0,0|2,0,0]=4 3904 B12R0.248 CCOCCOCCOC(=O)OC 34a_100010262106_100000210147 [0,1,1,0,0,0|2,0,0]=4 3905 B12R0.248 CCOCCSCCOC(=O)NC 62a_100000210147_200011997002 [0,1,1,0,0,0|2,0,0]=4 3906 B12R0.248 CCOCCSCCOC(=O)NC 62a_200011997002_100011215890 [0,1,1,0,0,0|2,0,0]=4 3907 B12R0.248 CCSCCCCCCC(=O)OC 62a_100000210202_100009815986 [0,1,1,0,0,0|2,0,0]=4 3908 B12R0.248 CCSCCCCCCC(=O)OC 62a_100009815986_100000210202 [0,1,1,0,0,0|2,0,0]=4 3909 B12R0.248 CCSCCNCCNC(=O)CC 34a_100132302217_100000757381 [0,1,1,0,0,0|2,0,0]=4 3910 B12R0.248 CCSCCOCCNC(=O)CC 34a_200000158885_100000757381 [0,1,1,0,0,0|2,0,0]=4 3911 B12R0.248 CCSCCOCCNC(=O)CC 7a_200000158885_100000757381 [0,1,1,0,0,0|2,0,0]=4 3912 B12R0.248 CCSCCOCCOC(=O)CC 7a_200000031056_100000757381 [0,1,1,0,0,0|1,0,0]=3 3913 B12R0.248 CCSCCOCCOC(=O)NC 34a_100000212035_200011997002 [0,1,1,0,0,0|2,0,0]=4 3914 B12R0.248 CCSCCOCCOC(=O)NC 7a_100000212035_200011997002 [0,1,1,0,0,0|2,0,0]=4 3915 B12R0.248 CCSCCOCCOC(=O)OC 34a_100010262106_100000757381 [0,1,1,0,0,0|2,0,0]=4 3916 B12R0.248 CCSCCSCCOC(=O)NC 62a_100000757381_200011997002 [0,1,1,0,0,0|2,0,0]=4 3917 B12R0.248 CCSCCSCCOC(=O)NC 62a_200011997002_100000757381 [0,1,1,0,0,0|2,0,0]=4 3918 B12R0.248 CNC(=O)CCCCCCCCO 240690a_100102657272_100000015970 [0,1,1,0,0,0|2,0,0]=4 3919 B12R0.248 CNC(=O)COCCCCCCBr 34a_100011215345_100000183359 [0,1,1,0,0,0|2,0,0]=4 3920 B12R0.248 CNC(=O)COCCCCCCBr 7a_100011215345_100000183359 [0,1,1,0,0,0|2,0,0]=4 3921 B12R0.248 CNC(=O)COCCCCCCCl 34a_100000766143_100000183359 [0,1,1,0,0,0|2,0,0]=4 3922 B12R0.248 CNC(=O)COCCCCCCCl 7a_100000766143_100000183359 [0,1,1,0,0,0|2,0,0]=4 3923 B12R0.248 CNC(=O)COCCCCCCF 34a_100000732779_100000183359 [0,1,1,0,0,0|2,0,0]=4 3924 B12R0.248 CNC(=O)COCCCCCCF 34a_100000750040_100015922095 [0,1,1,0,0,0|2,0,0]=4 3925 B12R0.248 CNC(=O)COCCCCCCF 7a_100000732779_100000183359 [0,1,1,0,0,0|2,0,0]=4 3926 B12R0.248 CNC(=O)COCCCCCCN 34a_100000686447_100000183359 [0,1,1,0,0,0|2,0,0]=4 3927 B12R0.248 CNC(=O)COCCCCCCO 34a_100000750040_100000766143 [0,1,1,0,0,0|2,0,0]=4 3928 B12R0.248 CNC(=O)NCCCCCCCO 2708a_100011996573_106832991635 [0,1,1,0,0,0|2,0,0]=4 3929 B12R0.248 CNC(=O)NCCCCCCCO 2708a_100102657272_100011996573 [0,1,1,0,0,0|2,0,0]=4 3930 B12R0.248 CNC(=O)NCCCCCCCO 273464a_100011996573_100102657272 [0,1,1,0,0,0|2,0,0]=4 3931 B12R0.248 CNC(=O)NCCCCCCCO 273464a_100102657272_100011996573 [0,1,1,0,0,0|2,0,0]=4 3932 B12R0.248 CNC(=O)NCCCCCCCO 512a_100011996573_100102657272 [0,1,1,0,0,0|2,0,0]=4 3933 B12R0.248 CNC(=O)NCCCCCCCO 512a_106832991638_100011996573 [0,1,1,0,0,0|2,0,0]=4 3934 B12R0.248 CNC(=O)OCCNCCCCO 34a_100000750430_200011997002 [0,1,1,0,0,0|2,0,0]=4 3935 B12R0.248 CNC(=O)OCCNCCCOC 34a_100150723488_200011997002 [0,1,1,0,0,0|2,0,0]=4 3936 B12R0.248 CNC(=O)OCCOCCCCBr 34a_100011216708_200011997002 [0,1,1,0,0,0|2,0,0]=4 3937 B12R0.248 CNC(=O)OCCOCCCCCl 34a_100000210776_200011997002 [0,1,1,0,0,0|2,0,0]=4 3938 B12R0.248 CNC(=O)OCCOCCCCCl 7a_100000210776_200011997002 [0,1,1,0,0,0|2,0,0]=4 3939 B12R0.248 CNC(=O)OCCOCCCCF 34a_100011995726_200011997002 [0,1,1,0,0,0|2,0,0]=4 3940 B12R0.248 CNC(=O)OCCOCCCCF 7a_100011995726_200011997002 [0,1,1,0,0,0|2,0,0]=4 3941 B12R0.248 CNC(=O)OCCOCCCCI 34a_200012148704_200011997002 [0,1,1,0,0,0|2,0,0]=4 3942 B12R0.248 CNC(=O)OCCOCCCCN 34a_100000750430_200011997002 [0,1,1,0,0,0|2,0,0]=4 3943 B12R0.248 CNC(=O)OCCOCCCOC 34a_100000740835_200011997002 [0,1,1,0,0,0|2,0,0]=4 3944 B12R0.248 CNC(=O)OCCOCCCSC 34a_100000690336_200011997002 [0,1,1,0,0,0|2,0,0]=4 3945 B12R0.248 CNC(=O)OCCOCCCSC 7a_100000690336_200011997002 [0,1,1,0,0,0|2,0,0]=4 3946 B12R0.248 CNC(=O)OCCSCCCCF 62a_100000729493_200011997002 [0,1,1,0,0,0|2,0,0]=4 3947 B12R0.248 CNC(=O)OCCSCCCCF 62a_200011997002_100000729493 [0,1,1,0,0,0|2,0,0]=4 3948 B12R0.248 CNC(=O)OCCSCCCCO 62a_100000210776_200011997002 [0,1,1,0,0,0|2,0,0]=4 3949 B12R0.248 CNC(=O)OCCSCCCCO 62a_200011997002_100000210776 [0,1,1,0,0,0|2,0,0]=4 3950 B12R0.248 CNC(=O)OCCSCCCOC 62a_100000709357_200011997002 [0,1,1,0,0,0|2,0,0]=4 3951 B12R0.248 CNC(=O)OCCSCCCOC 62a_200011997002_100000709357 [0,1,1,0,0,0|2,0,0]=4 3952 B12R0.248 CNCCCCCCCC(=O)OC 2230a_106832991635_100010004213 [0,1,1,0,0,0|2,0,0]=4 3953 B12R0.248 CNCCCCCCCC(=O)OC 34a_100102657272_100010004213 [0,1,1,0,0,0|2,0,0]=4 3954 B12R0.248 CNCCCCCCCC(=O)OC 7a_106832991635_100010004213 [0,1,1,0,0,0|2,0,0]=4 3955 B12R0.248 CNCCCCCOCC(=O)NC 34a_100000722520_100000183359 [0,1,1,0,0,0|2,0,0]=4 3956 B12R0.248 CNCCCCCOCC(=O)OC 34a_100000722520_100000747449 [0,1,1,0,0,0|2,0,0]=4 3957 B12R0.248 CNCCCOCCOC(=O)NC 34a_100000213112_200011997002 [0,1,1,0,0,0|2,0,0]=4 3958 B12R0.248 COC(=O)CCCCCCCO[13CH3] 34a_100011022521_200025704644 [0,1,1,0,0,0|2,0,0]=4 3959 B12R0.248 COC(=O)CCCCCCCO[13CH3] 7a_100011022521_200025704644 [0,1,1,0,0,0|2,0,0]=4 3960 B12R0.248 COC(=O)CCCCCCCSC 62a_100010004213_200000210301 [0,1,1,0,0,0|2,0,0]=4 3961 B12R0.248 COC(=O)CCCCCCCSC 62a_200000210301_100010004213 [0,1,1,0,0,0|2,0,0]=4 3962 B12R0.248 COC(=O)CCCCCCCS[13CH3] 62a_100010004213_200025704644 [0,1,1,0,0,0|2,0,0]=4 3963 B12R0.248 COC(=O)CCCCCCCS[13CH3] 62a_200025704644_100010004213 [0,1,1,0,0,0|2,0,0]=4 3964 B12R0.248 COC(=O)COCCCCCCBr 34a_100011215345_100000747449 [0,1,1,0,0,0|2,0,0]=4 3965 B12R0.248 COC(=O)COCCCCCCBr 7a_100011215345_100000747449 [0,1,1,0,0,0|2,0,0]=4 3966 B12R0.248 COC(=O)COCCCCCCCl 34a_100000766143_100000747449 [0,1,1,0,0,0|2,0,0]=4 3967 B12R0.248 COC(=O)COCCCCCCCl 7a_100000766143_100000747449 [0,1,1,0,0,0|2,0,0]=4 3968 B12R0.248 COC(=O)COCCCCCCF 34a_100000732779_100000747449 [0,1,1,0,0,0|2,0,0]=4 3969 B12R0.248 COC(=O)COCCCCCCF 7a_100000732779_100000747449 [0,1,1,0,0,0|2,0,0]=4 3970 B12R0.248 COC(=O)COCCCCCCN 34a_100000686447_100000747449 [0,1,1,0,0,0|2,0,0]=4 3971 B12R0.248 COC(=O)OCCOCCCCF 34a_100010262106_100000729493 [0,1,1,0,0,0|2,0,0]=4 3972 B12R0.248 COC(=O)OCCOCCCCO 34a_100010262106_100011216708 [0,1,1,0,0,0|2,0,0]=4 3973 B12R0.248 COC(=O)OCSCCCCCF 62a_100000729378_100000139417 [0,1,1,0,0,0|2,0,0]=4 3974 B12R0.248 COC(=O)OCSCCCCCO 62a_100000746330_100000139417 [0,1,1,0,0,0|2,0,0]=4 3975 B12R0.248 COCCCCCCCC(=O)OC 34a_100011022521_200000210301 [0,1,1,0,0,0|2,0,0]=4 3976 B12R0.248 COCCCCCCCC(=O)OC 34a_100138415774_100010004213 [0,1,1,0,0,0|2,0,0]=4 3977 B12R0.248 COCCCCCCCC(=O)OC 7a_100011022521_200000210301 [0,1,1,0,0,0|2,0,0]=4 3978 B12R0.248 COCCCCSCOC(=O)OC 62a_100000730899_100000139417 [0,1,1,0,0,0|2,0,0]=4 3979 B12R0.248 COCCCOCCOC(=O)OC 34a_100010262106_100000740836 [0,1,1,0,0,0|2,0,0]=4 3980 B12R0.248 O=C(CO)CCCCCCCCO 1458a_100000210174_100000033203 [0,1,1,0,0,0|2,0,0]=4 3981 B12R0.248 O=C(CO)NCCCCCCCO 240690a_100011996573_100000210174 [0,1,1,0,0,0|2,0,0]=4 3982 B12R0.251 C=C(C)C(=O)CCCCCCCC 1458a_100000185857_100000210759 [0,1,1,0,0,0|1,0,1]=4 3983 B12R0.251 C=C(C)C(=O)NCCCCCCC 11a_100000229938_100000185857 [0,1,1,0,0,0|1,0,1]=4 3984 B12R0.251 C=C(C)C(=O)NCCCCCCC 1626a_100000229938_100000185857 [0,1,1,0,0,0|1,0,1]=4 3985 B12R0.251 C=C(C)C(=O)OCCCCOCC 7a_100000065474_100000210202 [0,1,1,0,0,0|1,0,1]=4 3986 B12R0.251 C=C(C)C(=O)OCCCOCCC 7a_100000032641_100000210303 [0,1,1,0,0,0|1,0,1]=4 3987 B12R0.251 C=C(C)C(=O)OCCNCCCC 2230a_100000102301_100009816335 [0,1,1,0,0,0|1,0,1]=4 3988 B12R0.251 C=C(C)C(=O)OCCNCCCC 7a_106832991798_100009816335 [0,1,1,0,0,0|1,0,1]=4 3989 B12R0.251 C=C(C)C(=O)OCCOCCCC 34a_100000210227_100009816335 [0,1,1,0,0,0|1,0,1]=4 3990 B12R0.251 C=C(C)C(=O)OCCOCCCC 7a_100000210227_100009816335 [0,1,1,0,0,0|1,0,1]=4 3991 B12R0.251 C=C(C)C(=O)OCCSCCCC 62a_100000210211_100009816335 [0,1,1,0,0,0|1,0,1]=4 3992 B12R0.251 C=C(C)C(=O)OCCSCCCC 62a_100009816335_100000210210 [0,1,1,0,0,0|1,0,1]=4 3993 B12R0.251 CC(C)C(=O)CCCCCCCO 1458a_100000210198_100000760002 [0,1,1,0,0,0|2,0,0]=4 3994 B12R0.251 CC(C)C(=O)CCCCCCCO 1458a_100011219782_100000210206 [0,1,1,0,0,0|2,0,0]=4 3995 B12R0.251 CC(C)C(=O)NCCCCCCO 240690a_100000686447_100000210198 [0,1,1,0,0,0|2,0,0]=4 3996 B12R0.251 CC(C)C(=O)NCCCCCCO 527a_100000686447_100000210198 [0,1,1,0,0,0|2,0,0]=4 3997 B12R0.251 CC(C)C(=O)OCSCCCCF 62a_100000139345_100000729493 [0,1,1,0,0,0|2,0,0]=4 3998 B12R0.251 CC(C)C(=O)OCSCCCCF 62a_100000729493_100000139345 [0,1,1,0,0,0|2,0,0]=4 3999 B12R0.251 CC(C)C(=O)OCSCCCCO 62a_100000139345_100000210776 [0,1,1,0,0,0|2,0,0]=4 4000 B12R0.251 CC(C)C(=O)OCSCCCCO 62a_100000210776_100000139345 [0,1,1,0,0,0|2,0,0]=4 4001 B12R0.251 CC(F)C(=O)CCCCCCCO 1458a_100000062450_100000760002 [0,1,1,0,0,0|2,0,0]=4 4002 B12R0.251 CC(F)C(=O)NCCCCCCO 240690a_100000686447_100000062450 [0,1,1,0,0,0|2,0,0]=4 4003 B12R0.251 CC(F)C(=O)NCCCCCCO 527a_100000686447_100000062450 [0,1,1,0,0,0|2,0,0]=4 4004 B12R0.251 CCCCCCC=CC(=O)C(C)C 1458a_200015324643_100000210206 [0,1,1,0,0,0|1,0,1]=4 4005 B12R0.251 CCCCCCCCC(=O)C(C)C 1458a_100000210188_100000210206 [0,1,1,0,0,0|1,0,0]=3 4006 B12R0.251 CCCCCCCCC(=O)C(C)C 1458a_100000210198_100000210759 [0,1,1,0,0,0|1,0,0]=3 4007 B12R0.251 CCCCCCCCC(=O)C(C)F 1458a_100000062450_100000210759 [0,1,1,0,0,0|1,0,0]=3 4008 B12R0.251 CCCCCCCCC(=O)C(O)O 1458a_100000233687_100000210759 [0,1,1,0,0,0|2,0,0]=4 4009 B12R0.251 CCCCCCCCC(=O)N(C)C 11a_100102631434_100000210188 [0,1,1,0,0,0|2,0,0]=4 4010 B12R0.251 CCCCCCCCC(=O)N(C)C 1626a_100102631434_100000210188 [0,1,1,0,0,0|2,0,0]=4 4011 B12R0.251 CCCCCCCCC(=O)N(C)C 240690a_100102631434_100000210188 [0,1,1,0,0,0|2,0,0]=4 4012 B12R0.251 CCCCCCCCC(=O)N(C)C 527a_100102631434_100000210188 [0,1,1,0,0,0|2,0,0]=4 4013 B12R0.251 CCCCCCCCC(=O)[C@@H](C)O 1458a_100000717761_100000210759 [0,1,1,0,0,0|1,0,0]=3 4014 B12R0.251 CCCCCCCCC(=O)[C@H](C)O 1458a_217856618621_100000210759 [0,1,1,0,0,0|1,0,0]=3 4015 B12R0.251 CCCCCCCNC(=O)C(C)C 11a_100000229938_100000210198 [0,1,1,0,0,0|1,0,0]=3 4016 B12R0.251 CCCCCCCNC(=O)C(C)C 1626a_100000229938_100000210198 [0,1,1,0,0,0|1,0,0]=3 4017 B12R0.251 CCCCCCCNC(=O)C(C)C 240690a_100000229938_100000210198 [0,1,1,0,0,0|1,0,0]=3 4018 B12R0.251 CCCCCCCNC(=O)C(C)C 527a_100000229938_100000210198 [0,1,1,0,0,0|1,0,0]=3 4019 B12R0.251 CCCCCCCNC(=O)C(C)F 11a_100000229938_100000062450 [0,1,1,0,0,0|1,0,0]=3 4020 B12R0.251 CCCCCCCNC(=O)C(C)F 1626a_100000229938_100000062450 [0,1,1,0,0,0|1,0,0]=3 4021 B12R0.251 CCCCCCCNC(=O)C(C)F 240690a_100000229938_100000062450 [0,1,1,0,0,0|1,0,0]=3 4022 B12R0.251 CCCCCCCNC(=O)C(C)F 527a_100000229938_100000062450 [0,1,1,0,0,0|1,0,0]=3 4023 B12R0.251 CCCCCCCNC(=O)C(F)F 11a_100000229938_100000210393 [0,1,1,0,0,0|2,0,0]=4 4024 B12R0.251 CCCCCCCNC(=O)C(F)F 1626a_100000229938_100000210393 [0,1,1,0,0,0|2,0,0]=4 4025 B12R0.251 CCCCCCCNC(=O)C(F)F 240690a_100000229938_100000210393 [0,1,1,0,0,0|2,0,0]=4 4026 B12R0.251 CCCCCCCNC(=O)C(F)F 527a_100000229938_100000210393 [0,1,1,0,0,0|2,0,0]=4 4027 B12R0.251 CCCCCCCNC(=O)C(O)O 240690a_100000229938_100000233687 [0,1,1,0,0,0|2,0,0]=4 4028 B12R0.251 CCCCCCCNC(=O)N(C)C 2708a_100000229938_100102631434 [0,1,1,0,0,0|2,0,0]=4 4029 B12R0.251 CCCCCCCNC(=O)[C@@H](C)O 240690a_100000229938_100000717761 [0,1,1,0,0,0|1,0,0]=3 4030 B12R0.251 CCCCCCCNC(=O)[C@H](C)O 1626a_100000229938_217856618621 [0,1,1,0,0,0|1,0,0]=3 4031 B12R0.251 CCCCCCCNC(=O)[C@H](C)O 240690a_100000229938_217856618621 [0,1,1,0,0,0|1,0,0]=3 4032 B12R0.251 CCCCCCCOC(C)C(C)C 7a_100000748068_100000210614 [0,1,1,0,0,0|1,0,1]=4 4033 B12R0.251 CCCCCCNCC(=O)C(C)C 2230a_100000210581_100000753385 [0,1,1,0,0,0|2,0,0]=4 4034 B12R0.251 CCCCCCOCC(=O)C(C)C 34a_100000210259_100000753385 [0,1,1,0,0,0|2,0,0]=4 4035 B12R0.251 CCCCCCOCC(=O)C(C)C 7a_100000210259_100000753385 [0,1,1,0,0,0|2,0,0]=4 4036 B12R0.251 CCCCCCSCC(=O)C(C)C 62a_100000210314_100000753385 [0,1,1,0,0,0|2,0,0]=4 4037 B12R0.251 CCCCCCSCC(=O)C(C)C 62a_100000753385_100000210757 [0,1,1,0,0,0|2,0,0]=4 4038 B12R0.251 CCCCCSCOC(=O)C(C)C 62a_100000139345_100000210326 [0,1,1,0,0,0|1,0,0]=3 4039 B12R0.251 CCCCCSCOC(=O)C(C)C 62a_100000210326_100000139345 [0,1,1,0,0,0|1,0,0]=3 4040 B12R0.251 CCCCNCCNC(=O)C(C)C 2230a_100000752568_100000210211 [0,1,1,0,0,0|2,0,0]=4 4041 B12R0.251 CCCCNCCNC(=O)C(C)C 34a_100000752568_100000210210 [0,1,1,0,0,0|2,0,0]=4 4042 B12R0.251 CCCCSCCNC(=O)C(C)C 11a_100025743550_100000210198 [0,1,1,0,0,0|2,0,0]=4 4043 B12R0.251 CCCCSCCNC(=O)C(C)C 1626a_100025743550_100000210198 [0,1,1,0,0,0|2,0,0]=4 4044 B12R0.251 CCCCSCCNC(=O)C(C)C 240690a_100025743550_100000210198 [0,1,1,0,0,0|2,0,0]=4 4045 B12R0.251 CCCCSCCNC(=O)C(C)C 527a_100025743550_100000210198 [0,1,1,0,0,0|2,0,0]=4 4046 B12R0.251 CCCCSCCNC(=O)C(C)F 11a_100025743550_100000062450 [0,1,1,0,0,0|2,0,0]=4 4047 B12R0.251 CCCCSCCNC(=O)C(C)F 1626a_100025743550_100000062450 [0,1,1,0,0,0|2,0,0]=4 4048 B12R0.251 CCCCSCCNC(=O)C(C)F 240690a_100025743550_100000062450 [0,1,1,0,0,0|2,0,0]=4 4049 B12R0.251 CCCCSCCNC(=O)C(C)F 527a_100025743550_100000062450 [0,1,1,0,0,0|2,0,0]=4 4050 B12R0.251 CCCCSCCNC(=O)[C@@H](C)O 240690a_100025743550_100000717761 [0,1,1,0,0,0|2,0,0]=4 4051 B12R0.251 CCCCSCCNC(=O)[C@H](C)O 1626a_100025743550_217856618621 [0,1,1,0,0,0|2,0,0]=4 4052 B12R0.251 CCCCSCCNC(=O)[C@H](C)O 240690a_100025743550_217856618621 [0,1,1,0,0,0|2,0,0]=4 4053 B12R0.251 CCCOCCCNC(=O)C(C)C 1626a_100011217757_100000210198 [0,1,1,0,0,0|2,0,0]=4 4054 B12R0.251 CCCOCCCNC(=O)C(C)C 240690a_100011217757_100000210198 [0,1,1,0,0,0|2,0,0]=4 4055 B12R0.251 CCCOCCCNC(=O)C(C)C 527a_100011217757_100000210198 [0,1,1,0,0,0|2,0,0]=4 4056 B12R0.251 CCCOCCCNC(=O)C(C)F 1626a_100011217757_100000062450 [0,1,1,0,0,0|2,0,0]=4 4057 B12R0.251 CCCOCCCNC(=O)C(C)F 240690a_100011217757_100000062450 [0,1,1,0,0,0|2,0,0]=4 4058 B12R0.251 CCCOCCCNC(=O)C(C)F 527a_100011217757_100000062450 [0,1,1,0,0,0|2,0,0]=4 4059 B12R0.251 CCCOCCCNC(=O)[C@@H](C)O 240690a_100011217757_100000717761 [0,1,1,0,0,0|2,0,0]=4 4060 B12R0.251 CCCOCCCNC(=O)[C@H](C)O 1626a_100011217757_217856618621 [0,1,1,0,0,0|2,0,0]=4 4061 B12R0.251 CCCOCCCNC(=O)[C@H](C)O 240690a_100011217757_217856618621 [0,1,1,0,0,0|2,0,0]=4 4062 B12R0.251 CCOCCSCOC(=O)C(C)C 62a_100000139345_100011215890 [0,1,1,0,0,0|2,0,0]=4 4063 B12R0.251 CCOCCSCOC(=O)C(C)C 62a_100000210147_100000139345 [0,1,1,0,0,0|2,0,0]=4 4064 B12R0.251 CCSCCSCOC(=O)C(C)C 62a_100000139345_100000757381 [0,1,1,0,0,0|2,0,0]=4 4065 B12R0.251 CCSCCSCOC(=O)C(C)C 62a_100000757381_100000139345 [0,1,1,0,0,0|2,0,0]=4 4066 B12R0.251 COCCCCCCC(=O)C(C)C 1458a_100000210198_100011998445 [0,1,1,0,0,0|2,0,0]=4 4067 B12R0.251 COCCCCCCC(=O)C(C)F 1458a_100000062450_100011998445 [0,1,1,0,0,0|2,0,0]=4 4068 B12R0.251 COCCCCCCC(=O)[C@@H](C)O 1458a_100000717761_100011998445 [0,1,1,0,0,0|2,0,0]=4 4069 B12R0.251 COCCCCCCC(=O)[C@H](C)O 1458a_217856618621_100011998445 [0,1,1,0,0,0|2,0,0]=4 4070 B12R0.251 COCCCCCNC(=O)C(C)C 11a_100000747528_100000210198 [0,1,1,0,0,0|2,0,0]=4 4071 B12R0.251 COCCCCCNC(=O)C(C)C 1626a_100000747528_100000210198 [0,1,1,0,0,0|2,0,0]=4 4072 B12R0.251 COCCCCCNC(=O)C(C)C 240690a_100000747528_100000210198 [0,1,1,0,0,0|2,0,0]=4 4073 B12R0.251 COCCCCCNC(=O)C(C)C 527a_100000747528_100000210198 [0,1,1,0,0,0|2,0,0]=4 4074 B12R0.251 COCCCCCNC(=O)C(C)F 11a_100000747528_100000062450 [0,1,1,0,0,0|2,0,0]=4 4075 B12R0.251 COCCCCCNC(=O)C(C)F 1626a_100000747528_100000062450 [0,1,1,0,0,0|2,0,0]=4 4076 B12R0.251 COCCCCCNC(=O)C(C)F 240690a_100000747528_100000062450 [0,1,1,0,0,0|2,0,0]=4 4077 B12R0.251 COCCCCCNC(=O)C(C)F 527a_100000747528_100000062450 [0,1,1,0,0,0|2,0,0]=4 4078 B12R0.251 COCCCCCNC(=O)[C@@H](C)O 240690a_100000747528_100000717761 [0,1,1,0,0,0|2,0,0]=4 4079 B12R0.251 COCCCCCNC(=O)[C@H](C)O 1626a_100000747528_217856618621 [0,1,1,0,0,0|2,0,0]=4 4080 B12R0.251 COCCCCCNC(=O)[C@H](C)O 240690a_100000747528_217856618621 [0,1,1,0,0,0|2,0,0]=4 4081 B12R0.251 COCCCSCOC(=O)C(C)C 62a_100000139345_100000709357 [0,1,1,0,0,0|2,0,0]=4 4082 B12R0.251 COCCCSCOC(=O)C(C)C 62a_100000709357_100000139345 [0,1,1,0,0,0|2,0,0]=4 4083 B12R0.251 C[C@@H](O)C(=O)CCCCCCCO 1458a_100000717761_100000760002 [0,1,1,0,0,0|2,0,0]=4 4084 B12R0.251 C[C@@H](O)C(=O)NCCCCCCO 240690a_100000686447_100000717761 [0,1,1,0,0,0|2,0,0]=4 4085 B12R0.251 C[C@H](O)C(=O)CCCCCCCO 1458a_217856618621_100000760002 [0,1,1,0,0,0|2,0,0]=4 4086 B12R0.251 C[C@H](O)C(=O)NCCCCCCO 240690a_100000686447_217856618621 [0,1,1,0,0,0|2,0,0]=4 4087 B12R0.276 CCC(=O)OCCOC(C)CCO 7a_200000031056_100009893172 [0,1,1,0,0,0|2,0,0]=4 4088 B12R0.276 CCC(=O)OCCOC(C)COC 7a_200000031056_100000765312 [0,1,1,0,0,0|2,0,0]=4 4089 B12R0.276 CCCC(C)CCCOC(C)CC 34a_100011713154_100011215416 [0,1,1,0,0,0|1,0,1]=4 4090 B12R0.276 CCCC(C)CCCOC(C)CC 7a_100011713154_100000758301 [0,1,1,0,0,0|1,0,1]=4 4091 B12R0.276 CCCC(C)CCOCC(=O)CC 7a_100011217855_100000747405 [0,1,1,0,0,0|2,0,0]=4 4092 B12R0.276 CCCC(C)CSCOC(=O)OC 62a_100011216630_100000139417 [0,1,1,0,0,0|2,0,0]=4 4093 B12R0.276 CCCC(C)NCCNC(=O)CC 270004a_100132302217_100000211909 [0,1,1,0,0,0|2,0,0]=4 4094 B12R0.276 CCCC(C)NCCNC(=O)CC 34a_100132302217_100000766640 [0,1,1,0,0,0|2,0,0]=4 4095 B12R0.276 CCCC(C)OCCNC(=O)CC 34a_200000158885_100000766640 [0,1,1,0,0,0|2,0,0]=4 4096 B12R0.276 CCCC(C)OCCNC(=O)CC 7a_200000158885_100000766640 [0,1,1,0,0,0|2,0,0]=4 4097 B12R0.276 CCCC(C)OCCOC(=O)CC 7a_200000031056_100000766640 [0,1,1,0,0,0|1,0,0]=3 4098 B12R0.276 CCCC(C)OCCOC(=O)NC 34a_100000764384_200011997002 [0,1,1,0,0,0|2,0,0]=4 4099 B12R0.276 CCCC(C)OCCOC(=O)NC 7a_100000764384_200011997002 [0,1,1,0,0,0|2,0,0]=4 4100 B12R0.276 CCCC(C)OCCOC(=O)OC 34a_100010262106_100000766640 [0,1,1,0,0,0|2,0,0]=4 4101 B12R0.276 CCCC(C)SCCOC(=O)NC 62a_100000766640_200011997002 [0,1,1,0,0,0|2,0,0]=4 4102 B12R0.276 CCCC(C)SCCOC(=O)NC 62a_200011997002_100000766640 [0,1,1,0,0,0|2,0,0]=4 4103 B12R0.312 CCCCCCCNS(=O)(=O)CC 270084a_100000229938_100000211323 [0,1,1,0,0,0|2,0,0]=4 4104 B12R0.312 CCCCCCCNS(=O)(=O)CC 274078a_100000229938_100000211323 [0,1,1,0,0,0|2,0,0]=4 4105 B12R0.312 CCCCCCCNS(=O)(=O)CC 40a_100000229938_100000053943 [0,1,1,0,0,0|2,0,0]=4 4106 B12R0.312 CCCCCCCOC(C)(C)CC 7a_100000210230_100000210614 [0,1,1,0,0,0|1,0,1]=4 4107 B12R0.312 CCCCCCCOC(C)(C)CC 7a_100000210272_100000210677 [0,1,1,0,0,0|1,0,1]=4 4108 B12R0.47 C=CCCNC(C)CCCCCC 2230a_100000210919_100000754431 [0,1,1,0,0,0|2,0,0]=4 4109 B12R0.47 C=CCCNC(C)CCCCCC 2230a_100015191253_100011215978 [0,1,1,0,0,0|2,0,0]=4 4110 B12R0.47 C=CCCNC(C)CCCCCC 270004a_100015191253_100000210826 [0,1,1,0,0,0|2,0,0]=4 4111 B12R0.47 C=CCCNC(C)CCCCCC 34a_100000210919_100000754431 [0,1,1,0,0,0|2,0,0]=4 4112 B12R0.47 C=CCCOC(C)CCCCCC 34a_100000210265_100000754431 [0,1,1,0,0,0|2,0,0]=4 4113 B12R0.47 C=CCCOC(C)CCCCCC 34a_100011205117_100011215978 [0,1,1,0,0,0|2,0,0]=4 4114 B12R0.47 C=CCCOC(C)CCCCCC 7a_100000210265_100000754431 [0,1,1,0,0,0|2,0,0]=4 4115 B12R0.47 C=CCCSC(C)CCCCCC 62a_100000754431_100011215978 [0,1,1,0,0,0|2,0,0]=4 4116 B12R0.47 C=CCCSC(C)CCCCCC 62a_100011215978_100000754431 [0,1,1,0,0,0|2,0,0]=4 4117 B12R0.47 CCCCCCN(C)CCCC=O 2230a_106256046315_200011292268 [0,1,1,0,0,0|2,0,0]=4 4118 B12R0.47 CCCCCCN(C)CCCC=O 269982a_106256046315_200011292268 [0,1,1,0,0,0|2,0,0]=4 4119 B12R0.111 C=CC(CCCCCC)OCC=O 34a_200011215977_200009817547 [0,1,1,0,0,0|2,0,0]=4 4120 B12R0.111 C=CC(CCCCCC)OCC=O 7a_200011215977_200015260668 [0,1,1,0,0,0|2,0,0]=4 4121 B12R0.111 CCCCCCC(CC)OCC=O 34a_100011215785_200009817547 [0,1,1,0,0,0|2,0,0]=4 4122 B12R0.111 CCCCCCC(CC)OCC=O 7a_100011215785_200015260668 [0,1,1,0,0,0|2,0,0]=4 4123 B12R0.111 CCCCCCC(CCCC)OC 34a_200011216055_200000210301 [0,1,1,0,0,0|1,0,1]=4 4124 B12R0.111 CCCCCCC(CCCC)OC 7a_200011216055_200000210301 [0,1,1,0,0,0|1,0,1]=4 4125 B12R0.111 CCCCCCC(CCCC)O[13CH3] 34a_200011216055_200025704644 [0,1,1,0,0,0|1,0,1]=4 4126 B12R0.111 CCCCCCC(CCCC)O[13CH3] 7a_200011216055_200025704644 [0,1,1,0,0,0|1,0,1]=4 4127 B12R0.114 C=CCC(=O)C(O)CCCCCC 1458a_100011215828_100000210623 [0,1,1,0,0,0|1,0,1]=4 4128 B12R0.206 C=CCCC(C)NCCCCCC 270004a_100000210581_100000762624 [0,1,1,0,0,0|2,0,0]=4 4129 B12R0.206 C=CCCC(C)OCCCCCC 34a_100000765329_100000210314 [0,1,1,0,0,0|2,0,0]=4 4130 B12R0.206 C=CCCC(C)OCCCCCC 7a_100000765329_100000210314 [0,1,1,0,0,0|2,0,0]=4 4131 B12R0.206 CCCCCCCC(C)OCC=O 34a_200011215852_200009817547 [0,1,1,0,0,0|2,0,0]=4 4132 B12R0.206 CCCCCCCC(C)OCC=O 7a_200011215852_200015260668 [0,1,1,0,0,0|2,0,0]=4 4133 B12R0.206 CCCCCCCC(C)SCC=O 62a_200011218727_200015260668 [0,1,1,0,0,0|2,0,0]=4 4134 B12R0.206 CCCCCCCC(C)SCC=O 62a_200015260668_200011218727 [0,1,1,0,0,0|2,0,0]=4 4135 B12R0.255 CCCCCCC(=O)CCC(=O)N 1458a_100011215257_100000210757 [0,1,1,0,0,0|0,0,2]=4 4136 B12R0.255 CCCCCCC(C)NCC(=O)N 2230a_100000210919_100000747473 [0,1,1,0,0,0|2,0,0]=4 4137 B12R0.255 CCCCCCC(C)NCC(=O)N 2230a_100000711301_100011215978 [0,1,1,0,0,0|2,0,0]=4 4138 B12R0.255 CCCCCCC(C)NCC(=O)N 34a_100000210919_100000187820 [0,1,1,0,0,0|2,0,0]=4 4139 B12R0.255 CCCCCCC(C)NCC(=O)O 269956a_100016091260_100011215978 [0,1,1,0,0,0|2,0,0]=4 4140 B12R0.255 CCCCCCC(C)NCC(=O)[O-] 34a_100000210919_100020667443 [0,1,1,0,0,0|2,0,0]=4 4141 B12R0.255 CCCCCCC(C)OCC(=O)C 34a_100000211253_100011215978 [0,1,1,0,0,0|2,0,0]=4 4142 B12R0.255 CCCCCCC(C)OCC(=O)N 34a_100000210265_100000187820 [0,1,1,0,0,0|2,0,0]=4 4143 B12R0.255 CCCCCCC(C)OCC(=O)N 7a_100000210265_100000187820 [0,1,1,0,0,0|2,0,0]=4 4144 B12R0.255 CCCCCCC(C)OCC(=O)[O-] 34a_100000210265_100020667443 [0,1,1,0,0,0|2,0,0]=4 4145 B12R0.255 CCCCCCC(C)SCC(=O)N 62a_100000747473_100011215978 [0,1,1,0,0,0|2,0,0]=4 4146 B12R0.255 CCCCCCC(C)SCC(=O)N 62a_100011215978_100000747473 [0,1,1,0,0,0|2,0,0]=4 4147 B12R0.255 CCCCCCC(C)SCC(=O)[O-] 62a_100011215978_100020667443 [0,1,1,0,0,0|2,0,0]=4 4148 B12R0.255 CCCCCCC(C)SCC(=O)[O-] 62a_100020667443_100011215978 [0,1,1,0,0,0|2,0,0]=4 4149 B12R0.255 CCCCCCN(C)CCC(=O)C 269982a_106256046315_100000053229 [0,1,1,0,0,0|2,0,0]=4 4150 B12R0.255 CCCCCCN(C)CCC(=O)N 2230a_100000730477_100000210314 [0,1,1,0,0,0|2,0,0]=4 4151 B12R0.255 CCCCCCN(C)CCC(=O)N 2230a_106256046315_100000744528 [0,1,1,0,0,0|2,0,0]=4 4152 B12R0.255 CCCCCCN(C)CCC(=O)N 269982a_106256046315_100000744528 [0,1,1,0,0,0|2,0,0]=4 4153 B12R0.255 CCCCNCC(O)COC(=O)C 7a_106832991798_200000139349 [0,1,1,0,0,0|2,0,0]=4 4154 B12R0.255 CCCCOCC(O)COC(=O)C 34a_100000210227_200000139349 [0,1,1,0,0,0|2,0,0]=4 4155 B12R0.255 CCCCOCC(O)COC(=O)C 7a_100000210227_200000139349 [0,1,1,0,0,0|2,0,0]=4 4156 B12R0.255 CCCCSCC(O)COC(=O)C 62a_100000210211_200000139349 [0,1,1,0,0,0|2,0,0]=4 4157 B12R0.255 CCCCSCC(O)COC(=O)C 62a_200000139349_100000210210 [0,1,1,0,0,0|2,0,0]=4 4158 B12R0.585 CCCCCCC(C)(C)OCC=O 7a_200011995690_200015260668 [0,1,1,0,0,0|2,0,0]=4 4159 B12R0.233 CCCCCC(=O)CCCC(=O)C 1458a_100000212188_100011215641 [0,1,1,0,0,0|1,0,1]=4 4160 B12R0.233 CCCCCC(=O)CCCC(=O)N 1458a_100000212188_100102525003 [0,1,1,0,0,0|1,0,1]=4 4161 B12R0.233 CCCCCC(=O)CNCC(=O)O 269956a_100016091260_200012276598 [0,1,1,0,0,0|1,0,1]=4 4162 B12R0.233 CCCCCC(C)NCCC(=O)N 2230a_100000211957_100000744528 [0,1,1,0,0,0|2,0,0]=4 4163 B12R0.233 CCCCCC(C)NOCC(=O)O 269956a_100000106656_200011218191 [0,1,1,0,0,0|2,0,0]=4 4164 B12R0.233 CCCCCC(C)OCCC(=O)C 34a_100000759926_200011218191 [0,1,1,0,0,0|2,0,0]=4 4165 B12R0.233 CCCCCC(C)OCCC(=O)C 7a_100000759926_200011218191 [0,1,1,0,0,0|2,0,0]=4 4166 B12R0.233 CCCCCC(C)OCCC(=O)C 7a_100011215632_100000053229 [0,1,1,0,0,0|2,0,0]=4 4167 B12R0.233 CCCCCC(C)OCCC(=O)N 34a_100000757172_200011218191 [0,1,1,0,0,0|2,0,0]=4 4168 B12R0.233 CCCCCC(C)OCCC(=O)N 34a_100011215632_100000731001 [0,1,1,0,0,0|2,0,0]=4 4169 B12R0.233 CCCCCC(C)OCCC(=O)N 7a_100000757172_200011218191 [0,1,1,0,0,0|2,0,0]=4 4170 B12R0.233 CCCCCC(C)OCCC(=O)N 7a_100011215632_100000744528 [0,1,1,0,0,0|2,0,0]=4 4171 B12R0.233 CCCCCC(C)SCCC(=O)C 62a_100000053229_200011218191 [0,1,1,0,0,0|2,0,0]=4 4172 B12R0.233 CCCCCC(C)SCCC(=O)C 62a_200011218191_100000053229 [0,1,1,0,0,0|2,0,0]=4 4173 B12R0.233 CCCCCC(C)SCCC(=O)N 62a_100000744528_200011218191 [0,1,1,0,0,0|2,0,0]=4 4174 B12R0.233 CCCCCC(C)SCCC(=O)N 62a_200011218191_100000744528 [0,1,1,0,0,0|2,0,0]=4 4175 B12R0.233 CCCCCN(C)CCCC(=O)C 269982a_100000223495_100011215641 [0,1,1,0,0,0|2,0,0]=4 4176 B12R0.233 CCCCCN(C)CCCC(=O)N 269982a_100000223495_100102525003 [0,1,1,0,0,0|2,0,0]=4 4177 B12R0.233 CCCCCN(C)CCCC(=O)O 269956a_100000719178_100000210326 [0,1,1,0,0,0|1,0,0]=3 4178 B12R0.233 CCCCOC(C)CCCC(=O)[O-] 7a_100000761597_100000210211 [0,1,1,0,0,0|1,0,1]=4 4179 B12R0.233 CCOCCN(C)CCCC(=O)O 269956a_100000719178_100000210147 [0,1,1,0,0,0|2,0,0]=4 4180 B12R0.233 CCSCCN(C)CCCC(=O)O 269956a_100000719178_100000757381 [0,1,1,0,0,0|2,0,0]=4 4181 B12R0.233 CN(CCCCF)CCCC(=O)O 269956a_100000719178_100000729493 [0,1,1,0,0,0|2,0,0]=4 4182 B12R0.233 CN(CCCCO)CCCC(=O)O 269956a_100000719178_100000210776 [0,1,1,0,0,0|2,0,0]=4 4183 B12R0.233 COCCCN(C)CCCC(=O)O 269956a_100000719178_100000740836 [0,1,1,0,0,0|2,0,0]=4 4184 B12R0.234 C#CCCCCCCCCC(=O)C 1458a_100000029693_200000210301 [0,1,1,0,0,0|1,0,1]=4 4185 B12R0.234 C#CCCCCCCCCC(=O)[13CH3] 1458a_100000029693_200025704644 [0,1,1,0,0,0|1,0,1]=4 4186 B12R0.234 C#CCCCCCCNCC(=O)O 269956a_100016091260_100012276617 [0,1,1,0,0,0|0,0,2]=4 4187 B12R0.234 C=C(Br)CCOCCCCCCC 34a_100009813270_100000210614 [0,1,1,0,0,0|2,0,0]=4 4188 B12R0.234 C=C(C)CCNCCCCCCC 2230a_100000229938_100000730704 [0,1,1,0,0,0|2,0,0]=4 4189 B12R0.234 C=C(C)CCOCCCCCCC 34a_100000210272_100000730704 [0,1,1,0,0,0|2,0,0]=4 4190 B12R0.234 C=C(C)CCOCCCCCCC 34a_100000764851_100000210614 [0,1,1,0,0,0|2,0,0]=4 4191 B12R0.234 C=C(C)CCOCCCCCCC 7a_100000210272_100000730704 [0,1,1,0,0,0|2,0,0]=4 4192 B12R0.234 C=C(C)CCSCCCCCCC 62a_100000210614_100000730704 [0,1,1,0,0,0|2,0,0]=4 4193 B12R0.234 C=C(C)CCSCCCCCCC 62a_100000730704_100000210316 [0,1,1,0,0,0|2,0,0]=4 4194 B12R0.234 C=C(C)CNCCCCCCCC 2230a_100000229939_100000748629 [0,1,1,0,0,0|2,0,0]=4 4195 B12R0.234 C=C(C)CNCCCCCCCC 34a_100000229939_100000748629 [0,1,1,0,0,0|2,0,0]=4 4196 B12R0.234 C=C(C)COCCCCCCCC 34a_100000210232_100000748629 [0,1,1,0,0,0|2,0,0]=4 4197 B12R0.234 C=C(C)COCCCCCCCC 34a_100000210245_100000210759 [0,1,1,0,0,0|2,0,0]=4 4198 B12R0.234 C=C(C)COCCCCCCCC 7a_100000210232_100000748629 [0,1,1,0,0,0|2,0,0]=4 4199 B12R0.234 C=C(C)CSCCCCCCCC 62a_100000210759_100000211660 [0,1,1,0,0,0|2,0,0]=4 4200 B12R0.234 C=C(C)CSCCCCCCCC 62a_100000748629_100000210317 [0,1,1,0,0,0|2,0,0]=4 4201 B12R0.234 C=C(F)CNCCCCCCCC 2230a_100000229939_100009893438 [0,1,1,0,0,0|2,0,0]=4 4202 B12R0.234 C=C(F)CNCCCCCCCC 34a_100000229939_100009893438 [0,1,1,0,0,0|2,0,0]=4 4203 B12R0.234 C=C(F)COCCCCCCCC 34a_100000210232_100009893438 [0,1,1,0,0,0|2,0,0]=4 4204 B12R0.234 C=C(F)COCCCCCCCC 34a_200010262243_100000210759 [0,1,1,0,0,0|2,0,0]=4 4205 B12R0.234 C=C(F)COCCCCCCCC 7a_100000210232_100000042424 [0,1,1,0,0,0|2,0,0]=4 4206 B12R0.234 C=C(F)CSCCCCCCCC 62a_100000042424_100000210317 [0,1,1,0,0,0|2,0,0]=4 4207 B12R0.234 C=C(F)CSCCCCCCCC 62a_100000210759_100000042424 [0,1,1,0,0,0|2,0,0]=4 4208 B12R0.234 C=CCCCCCCCCC(=O)C 1458a_100000070787_100011933949 [0,1,1,0,0,0|1,0,1]=4 4209 B12R0.234 C=CCCCCCCCCC(=O)C 1458a_100000211349_200000210301 [0,1,1,0,0,0|1,0,1]=4 4210 B12R0.234 C=CCCCCCCCCC(=O)[13CH3] 1458a_100000211349_200025704644 [0,1,1,0,0,0|1,0,1]=4 4211 B12R0.234 C=CCCCCCCNCC(=O)O 269956a_100016091260_100011215473 [0,1,1,0,0,0|0,0,2]=4 4212 B12R0.234 CC#CCCCCCCCC(=O)C 1458a_100000066323_200000210301 [0,1,1,0,0,0|1,0,1]=4 4213 B12R0.234 CC#CCCCCCCCC(=O)[13CH3] 1458a_100000066323_200025704644 [0,1,1,0,0,0|1,0,1]=4 4214 B12R0.234 CC(=O)CCCCCCCCCF 1458a_200009909015_200000210301 [0,1,1,0,0,0|1,0,0]=3 4215 B12R0.234 CC(=O)CCCCCCCCCO 1458a_100000070787_100009813782 [0,1,1,0,0,0|1,0,0]=3 4216 B12R0.234 CC(=O)CCCCNCCCCO 34a_100000750430_100009817362 [0,1,1,0,0,0|2,0,0]=4 4217 B12R0.234 CC(=O)CCCCOCCCCBr 34a_100011216708_100009817362 [0,1,1,0,0,0|2,0,0]=4 4218 B12R0.234 CC(=O)CCCCOCCCCCl 34a_100000210776_100009817362 [0,1,1,0,0,0|2,0,0]=4 4219 B12R0.234 CC(=O)CCCCOCCCCCl 7a_100000210776_100000735457 [0,1,1,0,0,0|2,0,0]=4 4220 B12R0.234 CC(=O)CCCCOCCCCF 34a_100011995726_100009817362 [0,1,1,0,0,0|2,0,0]=4 4221 B12R0.234 CC(=O)CCCCOCCCCF 7a_100011995726_100000735457 [0,1,1,0,0,0|2,0,0]=4 4222 B12R0.234 CC(=O)CCCCOCCCCI 34a_200012148704_100009817362 [0,1,1,0,0,0|2,0,0]=4 4223 B12R0.234 CC(=O)CCCCOCCCCN 34a_100000750430_100009817362 [0,1,1,0,0,0|2,0,0]=4 4224 B12R0.234 CC(=O)CCCCSCCCCF 62a_100000729493_100000735457 [0,1,1,0,0,0|2,0,0]=4 4225 B12R0.234 CC(=O)CCCCSCCCCF 62a_100000735457_100000729493 [0,1,1,0,0,0|2,0,0]=4 4226 B12R0.234 CC(=O)CCCCSCCCCO 62a_100000210776_100000735457 [0,1,1,0,0,0|2,0,0]=4 4227 B12R0.234 CC(=O)CCCCSCCCCO 62a_100000735457_100000210776 [0,1,1,0,0,0|2,0,0]=4 4228 B12R0.234 CC(=O)CCCNCCCCCO 34a_100000762737_100000685027 [0,1,1,0,0,0|2,0,0]=4 4229 B12R0.234 CC(=O)CCCOCCCCCBr 34a_100000746331_100000685027 [0,1,1,0,0,0|2,0,0]=4 4230 B12R0.234 CC(=O)CCCOCCCCCBr 7a_100000746331_100011215641 [0,1,1,0,0,0|2,0,0]=4 4231 B12R0.234 CC(=O)CCCOCCCCCCl 34a_100000746330_100000685027 [0,1,1,0,0,0|2,0,0]=4 4232 B12R0.234 CC(=O)CCCOCCCCCCl 7a_100000746330_100011215641 [0,1,1,0,0,0|2,0,0]=4 4233 B12R0.234 CC(=O)CCCOCCCCCF 34a_100000759063_100000729378 [0,1,1,0,0,0|2,0,0]=4 4234 B12R0.234 CC(=O)CCCOCCCCCF 7a_100000759063_100000729378 [0,1,1,0,0,0|2,0,0]=4 4235 B12R0.234 CC(=O)CCCOCCCCCI 34a_200012148887_100000685027 [0,1,1,0,0,0|2,0,0]=4 4236 B12R0.234 CC(=O)CCCOCCCCCI 7a_200012148887_100011215641 [0,1,1,0,0,0|2,0,0]=4 4237 B12R0.234 CC(=O)CCCOCCCCCN 34a_100000762737_100000685027 [0,1,1,0,0,0|2,0,0]=4 4238 B12R0.234 CC(=O)CCCOCCCCCO 34a_100000759063_100000746330 [0,1,1,0,0,0|2,0,0]=4 4239 B12R0.234 CC(=O)CCCOCCCCCO 7a_100000759063_100000746330 [0,1,1,0,0,0|2,0,0]=4 4240 B12R0.234 CC(=O)CCCSCCCCCF 62a_100000729378_100011215641 [0,1,1,0,0,0|2,0,0]=4 4241 B12R0.234 CC(=O)CCCSCCCCCF 62a_100011215641_100000729378 [0,1,1,0,0,0|2,0,0]=4 4242 B12R0.234 CC(=O)CCCSCCCCCO 62a_100000746330_100011215641 [0,1,1,0,0,0|2,0,0]=4 4243 B12R0.234 CC(=O)CCCSCCCCCO 62a_100011215641_100000746330 [0,1,1,0,0,0|2,0,0]=4 4244 B12R0.234 CC(=O)CCOCCCCCCBr 7a_100011215345_100000053229 [0,1,1,0,0,0|2,0,0]=4 4245 B12R0.234 CC(=O)CCOCCCCCCCl 7a_100000766143_100000053229 [0,1,1,0,0,0|2,0,0]=4 4246 B12R0.234 CC(=O)CCOCCCCCCF 34a_100000759926_100015922095 [0,1,1,0,0,0|2,0,0]=4 4247 B12R0.234 CC(=O)CCOCCCCCCF 7a_100000732779_100000053229 [0,1,1,0,0,0|2,0,0]=4 4248 B12R0.234 CC(=O)CCOCCCCCCF 7a_100000759926_100015922095 [0,1,1,0,0,0|2,0,0]=4 4249 B12R0.234 CC(=O)CCOCCCCCCO 34a_100000759926_100000766143 [0,1,1,0,0,0|2,0,0]=4 4250 B12R0.234 CC(=O)CCOCCCCCCO 7a_100000759926_100000766143 [0,1,1,0,0,0|2,0,0]=4 4251 B12R0.234 CC(=O)CCSCCCCCCF 62a_100000053229_100015922095 [0,1,1,0,0,0|2,0,0]=4 4252 B12R0.234 CC(=O)CCSCCCCCCF 62a_100015922095_100000053229 [0,1,1,0,0,0|2,0,0]=4 4253 B12R0.234 CC(=O)CCSCCCCCCO 62a_100000053229_100000766143 [0,1,1,0,0,0|2,0,0]=4 4254 B12R0.234 CC(=O)CCSCCCCCCO 62a_100000766143_100000053229 [0,1,1,0,0,0|2,0,0]=4 4255 B12R0.234 CC(=O)COCCCCCCCO 34a_100000211253_100000760002 [0,1,1,0,0,0|2,0,0]=4 4256 B12R0.234 CC(=O)NCCCCCCCCO 240690a_102515433106_100015343762 [0,1,1,0,0,0|2,0,0]=4 4257 B12R0.234 CCC#CCCCCCCC(=O)C 1458a_100000070787_200000036426 [0,1,1,0,0,0|1,0,1]=4 4258 B12R0.234 CCCCCC#CCNCC(=O)O 269956a_100016091260_100009816472 [0,1,1,0,0,0|0,0,2]=4 4259 B12R0.234 CCCCCCCCC=CC(=O)C 1458a_100015345288_200000210301 [0,1,1,0,0,0|1,0,1]=4 4260 B12R0.234 CCCCCCCCC=CC(=O)[13CH3] 1458a_100015345288_200025704644 [0,1,1,0,0,0|1,0,1]=4 4261 B12R0.234 CCCCCCCCCCC(=O)C 1458a_100000070787_100000210319 [0,1,1,0,0,0|1,0,0]=3 4262 B12R0.234 CCCCCCCCCCC(=O)C 1458a_100000210375_200000210301 [0,1,1,0,0,0|1,0,0]=3 4263 B12R0.234 CCCCCCCCCCC(=O)[13CH3] 1458a_100000210375_200025704644 [0,1,1,0,0,0|1,0,0]=3 4264 B12R0.234 CCCCCCCCCNC(=O)C 11a_100000212291_100015343762 [0,1,1,0,0,0|1,0,0]=3 4265 B12R0.234 CCCCCCCCCNC(=O)C 1626a_100000212291_100015343762 [0,1,1,0,0,0|1,0,0]=3 4266 B12R0.234 CCCCCCCCCNC(=O)C 240690a_100000212291_100015343762 [0,1,1,0,0,0|1,0,0]=3 4267 B12R0.234 CCCCCCCCCNC(=O)C 527a_100000212291_100103153847 [0,1,1,0,0,0|1,0,0]=3 4268 B12R0.234 CCCCCCCCNCC(=O)N 2230a_100000229939_100000747473 [0,1,1,0,0,0|1,0,0]=3 4269 B12R0.234 CCCCCCCCNCC(=O)N 2230a_100000711301_100000210759 [0,1,1,0,0,0|1,0,0]=3 4270 B12R0.234 CCCCCCCCNCC(=O)N 34a_100000229939_100000187820 [0,1,1,0,0,0|1,0,0]=3 4271 B12R0.234 CCCCCCCCNCC(=O)O 269956a_100016091260_100000210759 [0,1,1,0,0,0|0,0,0]=2 4272 B12R0.234 CCCCCCCCNCC(=O)[O-] 34a_100000229939_100020667443 [0,1,1,0,0,0|0,0,1]=3 4273 B12R0.234 CCCCCCCCNCC(C)O 2230a_100000210904_100000210759 [0,1,1,0,0,0|1,0,1]=4 4274 B12R0.234 CCCCCCCCNCC(C)O 2230a_100000229939_100011218427 [0,1,1,0,0,0|1,0,1]=4 4275 B12R0.234 CCCCCCCCNCC(C)O 34a_100000210904_100000210759 [0,1,1,0,0,0|1,0,1]=4 4276 B12R0.234 CCCCCCCCNCC(C)O 34a_100000229939_100011218427 [0,1,1,0,0,0|1,0,1]=4 4277 B12R0.234 CCCCCCCCNC[C@@H](C)O 2230a_100000229939_100009817552 [0,1,1,0,0,0|1,0,1]=4 4278 B12R0.234 CCCCCCCCNC[C@@H](C)O 34a_100000229939_100009817552 [0,1,1,0,0,0|1,0,1]=4 4279 B12R0.234 CCCCCCCCNC[N+](=O)[O-] 34a_100000229939_100000761209 [0,1,1,0,0,0|1,0,1]=4 4280 B12R0.234 CCCCCCCCOCC(=O)C 1458a_100000759886_200000210301 [0,1,1,0,0,0|1,0,0]=3 4281 B12R0.234 CCCCCCCCOCC(=O)C 34a_100000211253_100000210759 [0,1,1,0,0,0|1,0,0]=3 4282 B12R0.234 CCCCCCCCOCC(=O)N 34a_100000210232_100000187820 [0,1,1,0,0,0|1,0,0]=3 4283 B12R0.234 CCCCCCCCOCC(=O)N 7a_100000210232_100000187820 [0,1,1,0,0,0|1,0,0]=3 4284 B12R0.234 CCCCCCCCOCC(=O)[13CH3] 1458a_100000759886_200025704644 [0,1,1,0,0,0|1,0,0]=3 4285 B12R0.234 CCCCCCCCOCC(=O)[O-] 34a_100000210232_100020667443 [0,1,1,0,0,0|0,0,1]=3 4286 B12R0.234 CCCCCCCCOCC(C)O 34a_100000210232_100011218427 [0,1,1,0,0,0|1,0,1]=4 4287 B12R0.234 CCCCCCCCOCC(C)O 7a_100000210232_100011218427 [0,1,1,0,0,0|1,0,1]=4 4288 B12R0.234 CCCCCCCCOC[C@@H](C)O 34a_100000210232_100009817552 [0,1,1,0,0,0|1,0,1]=4 4289 B12R0.234 CCCCCCCCOC[C@@H](C)O 7a_100000210232_100009817552 [0,1,1,0,0,0|1,0,1]=4 4290 B12R0.234 CCCCCCCCOC[N+](=O)[O-] 34a_100000210232_100000761209 [0,1,1,0,0,0|1,0,1]=4 4291 B12R0.234 CCCCCCCCSCC(=O)N 62a_100000210759_100000747473 [0,1,1,0,0,0|1,0,0]=3 4292 B12R0.234 CCCCCCCCSCC(=O)N 62a_100000747473_100000210317 [0,1,1,0,0,0|1,0,0]=3 4293 B12R0.234 CCCCCCCCSCC(=O)[O-] 62a_100000210759_100020667443 [0,1,1,0,0,0|0,0,1]=3 4294 B12R0.234 CCCCCCCCSCC(=O)[O-] 62a_100020667443_100000210317 [0,1,1,0,0,0|0,0,1]=3 4295 B12R0.234 CCCCCCCCSCC(C)O 62a_100000210759_100011218427 [0,1,1,0,0,0|1,0,1]=4 4296 B12R0.234 CCCCCCCCSCC(C)O 62a_100011218427_100000210317 [0,1,1,0,0,0|1,0,1]=4 4297 B12R0.234 CCCCCCCCSC[C@@H](C)O 62a_100000210759_100009817552 [0,1,1,0,0,0|1,0,1]=4 4298 B12R0.234 CCCCCCCCSC[C@@H](C)O 62a_100009817552_100000210317 [0,1,1,0,0,0|1,0,1]=4 4299 B12R0.234 CCCCCCCCSC[N+](=O)[O-] 62a_100000210759_100000761209 [0,1,1,0,0,0|1,0,1]=4 4300 B12R0.234 CCCCCCCNCCC(=O)N 2230a_100000229938_100000744528 [0,1,1,0,0,0|1,0,0]=3 4301 B12R0.234 CCCCCCCNCCC(C)O 2230a_100000229938_100012276601 [0,1,1,0,0,0|1,0,1]=4 4302 B12R0.234 CCCCCCCNCCC(C)O 2230a_200000755665_100000210681 [0,1,1,0,0,0|1,0,1]=4 4303 B12R0.234 CCCCCCCNOCC(=O)O 269956a_100000106656_100000210614 [0,1,1,0,0,0|1,0,0]=3 4304 B12R0.234 CCCCCCCOCCC(=O)C 34a_100000759926_100000210614 [0,1,1,0,0,0|1,0,0]=3 4305 B12R0.234 CCCCCCCOCCC(=O)C 7a_100000210272_100000053229 [0,1,1,0,0,0|1,0,0]=3 4306 B12R0.234 CCCCCCCOCCC(=O)C 7a_100000759926_100000210614 [0,1,1,0,0,0|1,0,0]=3 4307 B12R0.234 CCCCCCCOCCC(=O)N 34a_100000210272_100000731001 [0,1,1,0,0,0|1,0,0]=3 4308 B12R0.234 CCCCCCCOCCC(=O)N 34a_100000757172_100000210614 [0,1,1,0,0,0|1,0,0]=3 4309 B12R0.234 CCCCCCCOCCC(=O)N 7a_100000210272_100000744528 [0,1,1,0,0,0|1,0,0]=3 4310 B12R0.234 CCCCCCCOCCC(=O)N 7a_100000757172_100000210614 [0,1,1,0,0,0|1,0,0]=3 4311 B12R0.234 CCCCCCCOCCC(C)O 34a_100000210272_100012276601 [0,1,1,0,0,0|1,0,1]=4 4312 B12R0.234 CCCCCCCOCCC(C)O 7a_100000210272_100012276601 [0,1,1,0,0,0|1,0,1]=4 4313 B12R0.234 CCCCCCCOCOC(=O)C 34a_100000210272_100009813279 [0,1,1,0,0,0|2,0,0]=4 4314 B12R0.234 CCCCCCCSCCC(=O)C 62a_100000053229_100000210316 [0,1,1,0,0,0|1,0,0]=3 4315 B12R0.234 CCCCCCCSCCC(=O)C 62a_100000210614_100000053229 [0,1,1,0,0,0|1,0,0]=3 4316 B12R0.234 CCCCCCCSCCC(=O)N 62a_100000210614_100000744528 [0,1,1,0,0,0|1,0,0]=3 4317 B12R0.234 CCCCCCCSCCC(=O)N 62a_100000744528_100000210316 [0,1,1,0,0,0|1,0,0]=3 4318 B12R0.234 CCCCCCCSCCC(C)O 62a_100000210614_100012276601 [0,1,1,0,0,0|1,0,1]=4 4319 B12R0.234 CCCCCCCSCCC(C)O 62a_100012276601_100000210316 [0,1,1,0,0,0|1,0,1]=4 4320 B12R0.234 CCCCCCCSCOC(=O)C 62a_100000076356_100000210316 [0,1,1,0,0,0|2,0,0]=4 4321 B12R0.234 CCCCCCCSCOC(=O)C 62a_100000210614_100000076356 [0,1,1,0,0,0|2,0,0]=4 4322 B12R0.234 CCCCCCNCCCC(=O)N 34a_100000739312_100000210314 [0,1,1,0,0,0|1,0,0]=3 4323 B12R0.234 CCCCCCNCCCC(C)O 2230a_100000210581_200000718107 [0,1,1,0,0,0|1,0,1]=4 4324 B12R0.234 CCCCCCNCCCS(=O)C 2230a_200000753449_100000210314 [0,1,1,0,0,0|2,0,0]=4 4325 B12R0.234 CCCCCCNCCNC(=O)C 2230a_100000209853_100000210314 [0,1,1,0,0,0|2,0,0]=4 4326 B12R0.234 CCCCCCNCCNC(=O)C 2230a_100000210581_100000189650 [0,1,1,0,0,0|2,0,0]=4 4327 B12R0.234 CCCCCCNCCNC(=O)N 2230a_100000210581_200000034859 [0,1,1,0,0,0|2,0,0]=4 4328 B12R0.234 CCCCCCNCCNC(=O)N 34a_100020590234_100000210314 [0,1,1,0,0,0|2,0,0]=4 4329 B12R0.234 CCCCCCOCCCC(=O)C 34a_100000210259_100000685027 [0,1,1,0,0,0|1,0,0]=3 4330 B12R0.234 CCCCCCOCCCC(=O)C 34a_100000759063_100000210314 [0,1,1,0,0,0|1,0,0]=3 4331 B12R0.234 CCCCCCOCCCC(=O)C 7a_100000210259_100011215641 [0,1,1,0,0,0|1,0,0]=3 4332 B12R0.234 CCCCCCOCCCC(=O)C 7a_100000759063_100000210314 [0,1,1,0,0,0|1,0,0]=3 4333 B12R0.234 CCCCCCOCCCC(=O)N 34a_100000210259_100102525003 [0,1,1,0,0,0|1,0,0]=3 4334 B12R0.234 CCCCCCOCCCC(=O)N 7a_100000210259_100102525003 [0,1,1,0,0,0|1,0,0]=3 4335 B12R0.234 CCCCCCOCCCC(C)O 34a_100000210259_200000718107 [0,1,1,0,0,0|1,0,1]=4 4336 B12R0.234 CCCCCCOCCCC(C)O 7a_100000210259_200000718107 [0,1,1,0,0,0|1,0,1]=4 4337 B12R0.234 CCCCCCOCCC[N+](=O)[O-] 34a_200000037920_100000210314 [0,1,1,0,0,0|1,0,1]=4 4338 B12R0.234 CCCCCCOCCNC(=O)C 34a_100000158858_100000210314 [0,1,1,0,0,0|2,0,0]=4 4339 B12R0.234 CCCCCCOCCNC(=O)C 7a_100000210259_100000189650 [0,1,1,0,0,0|2,0,0]=4 4340 B12R0.234 CCCCCCOCCNC(=O)N 34a_100000181757_100000210314 [0,1,1,0,0,0|2,0,0]=4 4341 B12R0.234 CCCCCCOCCNC(=O)N 7a_100000210259_200000034859 [0,1,1,0,0,0|2,0,0]=4 4342 B12R0.234 CCCCCCOCCOC(=O)C 34a_100000210259_100009814007 [0,1,1,0,0,0|2,0,0]=4 4343 B12R0.234 CCCCCCOCCOC(=O)C 7a_100000210259_100009814007 [0,1,1,0,0,0|2,0,0]=4 4344 B12R0.234 CCCCCCOCCOC(=O)N 34a_100000210259_200011214921 [0,1,1,0,0,0|2,0,0]=4 4345 B12R0.234 CCCCCCOCCOC(=O)N 7a_100000210259_200011214921 [0,1,1,0,0,0|2,0,0]=4 4346 B12R0.234 CCCCCCOCCOC(=O)N 7a_100000766696_100000210314 [0,1,1,0,0,0|2,0,0]=4 4347 B12R0.234 CCCCCCSCCCC(=O)C 62a_100000210314_100011215641 [0,1,1,0,0,0|1,0,0]=3 4348 B12R0.234 CCCCCCSCCCC(=O)C 62a_100011215641_100000210757 [0,1,1,0,0,0|1,0,0]=3 4349 B12R0.234 CCCCCCSCCCC(=O)N 62a_100000210314_100102525003 [0,1,1,0,0,0|1,0,0]=3 4350 B12R0.234 CCCCCCSCCCC(=O)N 62a_100102525003_100000210757 [0,1,1,0,0,0|1,0,0]=3 4351 B12R0.234 CCCCCCSCCCC(C)O 62a_100000210314_200000718107 [0,1,1,0,0,0|1,0,1]=4 4352 B12R0.234 CCCCCCSCCCC(C)O 62a_200000718107_100000210757 [0,1,1,0,0,0|1,0,1]=4 4353 B12R0.234 CCCCCCSCCNC(=O)C 62a_100000189650_100000210757 [0,1,1,0,0,0|2,0,0]=4 4354 B12R0.234 CCCCCCSCCNC(=O)C 62a_100000210314_100000189650 [0,1,1,0,0,0|2,0,0]=4 4355 B12R0.234 CCCCCCSCCNC(=O)N 62a_100000210314_200000034859 [0,1,1,0,0,0|2,0,0]=4 4356 B12R0.234 CCCCCCSCCNC(=O)N 62a_200000034859_100000210757 [0,1,1,0,0,0|2,0,0]=4 4357 B12R0.234 CCCCCCSCCOC(=O)C 62a_100000210314_100009814007 [0,1,1,0,0,0|2,0,0]=4 4358 B12R0.234 CCCCCCSCCOC(=O)C 62a_100009814007_100000210757 [0,1,1,0,0,0|2,0,0]=4 4359 B12R0.234 CCCCCCSCCOC(=O)N 62a_100000210314_200011214921 [0,1,1,0,0,0|2,0,0]=4 4360 B12R0.234 CCCCCCSCCOC(=O)N 62a_200011214921_100000210757 [0,1,1,0,0,0|2,0,0]=4 4361 B12R0.234 CCCCCNCCCCB(O)O 2230a_100000209983_200009817182 [0,1,1,0,0,0|1,0,1]=4 4362 B12R0.234 CCCCCNCCCCC(=O)N 34a_100000696515_100000718602 [0,1,1,0,0,0|1,0,0]=3 4363 B12R0.234 CCCCCNCCCNC(=O)C 34a_100000736810_100000718602 [0,1,1,0,0,0|2,0,0]=4 4364 B12R0.234 CCCCCNCCCSC(=O)C 2230a_100000209983_100000038929 [0,1,1,0,0,0|2,0,0]=4 4365 B12R0.234 CCCCCNCCOCC(=O)N 2230a_100000209983_100000076697 [0,1,1,0,0,0|2,0,0]=4 4366 B12R0.234 CCCCCNCCOCC(=O)N 34a_100000224656_100000187820 [0,1,1,0,0,0|2,0,0]=4 4367 B12R0.234 CCCCCNCCOCC(=O)O 269956a_100000700818_100000210326 [0,1,1,0,0,0|1,0,0]=3 4368 B12R0.234 CCCCCNCCOCC(=O)[O-] 34a_100000224656_100020667443 [0,1,1,0,0,0|1,0,1]=4 4369 B12R0.234 CCCCCOCCCCB(O)O 34a_100000210253_200009817182 [0,1,1,0,0,0|1,0,1]=4 4370 B12R0.234 CCCCCOCCCCB(O)O 7a_100000210253_200009817182 [0,1,1,0,0,0|1,0,1]=4 4371 B12R0.234 CCCCCOCCCCC(=O)C 34a_100000210253_100009817362 [0,1,1,0,0,0|1,0,0]=3 4372 B12R0.234 CCCCCOCCCCC(=O)C 7a_100000210253_100000735457 [0,1,1,0,0,0|1,0,0]=3 4373 B12R0.234 CCCCCOCCCCC(=O)N 34a_100012022536_100000718602 [0,1,1,0,0,0|1,0,0]=3 4374 B12R0.234 CCCCCOCCCCC(=O)N 7a_100012022536_100000210326 [0,1,1,0,0,0|1,0,0]=3 4375 B12R0.234 CCCCCOCCCC[N+](=O)[O-] 34a_200015379883_100000718602 [0,1,1,0,0,0|1,0,1]=4 4376 B12R0.234 CCCCCOCCCC[N+](=O)[O-] 7a_200015379883_100000210326 [0,1,1,0,0,0|1,0,1]=4 4377 B12R0.234 CCCCCOCCCNC(=O)C 34a_100000752032_100000718602 [0,1,1,0,0,0|2,0,0]=4 4378 B12R0.234 CCCCCOCCCOC(=O)C 34a_100000210253_100000042594 [0,1,1,0,0,0|2,0,0]=4 4379 B12R0.234 CCCCCOCCCOC(=O)C 7a_100000210253_100000042594 [0,1,1,0,0,0|2,0,0]=4 4380 B12R0.234 CCCCCOCCCSC(=O)C 34a_100000210253_100000038929 [0,1,1,0,0,0|2,0,0]=4 4381 B12R0.234 CCCCCOCCCSC(=O)C 7a_100000210253_100000038929 [0,1,1,0,0,0|2,0,0]=4 4382 B12R0.234 CCCCCOCCOCC(=O)N 34a_100000210253_100000076697 [0,1,1,0,0,0|2,0,0]=4 4383 B12R0.234 CCCCCOCCOCC(=O)N 34a_100011215259_100000187820 [0,1,1,0,0,0|2,0,0]=4 4384 B12R0.234 CCCCCOCCOCC(=O)N 7a_100000210253_100000076697 [0,1,1,0,0,0|2,0,0]=4 4385 B12R0.234 CCCCCOCCOCC(=O)N 7a_100011215259_100000187820 [0,1,1,0,0,0|2,0,0]=4 4386 B12R0.234 CCCCCOCCOCC(=O)[O-] 34a_100011215259_100020667443 [0,1,1,0,0,0|1,0,1]=4 4387 B12R0.234 CCCCCSCCCCB(O)O 62a_100000210326_200009817182 [0,1,1,0,0,0|1,0,1]=4 4388 B12R0.234 CCCCCSCCCCB(O)O 62a_200009817182_100000210326 [0,1,1,0,0,0|1,0,1]=4 4389 B12R0.234 CCCCCSCCCCC(=O)C 62a_100000210326_100000735457 [0,1,1,0,0,0|1,0,0]=3 4390 B12R0.234 CCCCCSCCCCC(=O)C 62a_100000735457_100000210326 [0,1,1,0,0,0|1,0,0]=3 4391 B12R0.234 CCCCCSCCCOC(=O)C 62a_100000042594_100000210326 [0,1,1,0,0,0|2,0,0]=4 4392 B12R0.234 CCCCCSCCCOC(=O)C 62a_100000210326_100000042594 [0,1,1,0,0,0|2,0,0]=4 4393 B12R0.234 CCCCCSCCCSC(=O)C 62a_100000038929_100000210326 [0,1,1,0,0,0|2,0,0]=4 4394 B12R0.234 CCCCCSCCCSC(=O)C 62a_100000210326_100000038929 [0,1,1,0,0,0|2,0,0]=4 4395 B12R0.234 CCCCCSCCOCC(=O)N 62a_100000076697_100000210326 [0,1,1,0,0,0|2,0,0]=4 4396 B12R0.234 CCCCCSCCOCC(=O)N 62a_100000210326_100000076697 [0,1,1,0,0,0|2,0,0]=4 4397 B12R0.234 CCCCNCCCCCB(O)O 2230a_100000102301_200009817188 [0,1,1,0,0,0|1,0,1]=4 4398 B12R0.234 CCCCNCCCCCB(O)O 7a_106832991798_200009817188 [0,1,1,0,0,0|1,0,1]=4 4399 B12R0.234 CCCCNCCCCCC(=O)N 2230a_100000102301_100009817443 [0,1,1,0,0,0|1,0,0]=3 4400 B12R0.234 CCCCNCCCCCC(=O)N 7a_106832991798_100009817443 [0,1,1,0,0,0|1,0,0]=3 4401 B12R0.234 CCCCNCCCCNC(=O)C 2230a_200011368371_100000210211 [0,1,1,0,0,0|2,0,0]=4 4402 B12R0.234 CCCCNCCCCNC(=O)C 34a_200011368371_100000210210 [0,1,1,0,0,0|2,0,0]=4 4403 B12R0.234 CCCCNCCCCOC(=O)C 7a_106832991798_100000033659 [0,1,1,0,0,0|2,0,0]=4 4404 B12R0.234 CCCCNCCCCSC(=O)C 2230a_100000102301_200010402107 [0,1,1,0,0,0|2,0,0]=4 4405 B12R0.234 CCCCNCCCCSC(=O)C 7a_106832991798_200010402107 [0,1,1,0,0,0|2,0,0]=4 4406 B12R0.234 CCCCOCCCCCB(O)O 34a_100000210227_200009817188 [0,1,1,0,0,0|1,0,1]=4 4407 B12R0.234 CCCCOCCCCCB(O)O 7a_100000210227_200009817188 [0,1,1,0,0,0|1,0,1]=4 4408 B12R0.234 CCCCOCCCCCC(=O)N 34a_100000123541_100000210210 [0,1,1,0,0,0|1,0,0]=3 4409 B12R0.234 CCCCOCCCCCC(=O)N 34a_100000210227_100009817443 [0,1,1,0,0,0|1,0,0]=3 4410 B12R0.234 CCCCOCCCCCC(=O)N 7a_100000123541_100000210211 [0,1,1,0,0,0|1,0,0]=3 4411 B12R0.234 CCCCOCCCCCC(=O)N 7a_100000210227_100009817443 [0,1,1,0,0,0|1,0,0]=3 4412 B12R0.234 CCCCOCCCCCC(=O)[O-] 7a_100102619762_100000210211 [0,1,1,0,0,0|0,0,1]=3 4413 B12R0.234 CCCCOCCCCOC(=O)C 34a_100000073216_100000210210 [0,1,1,0,0,0|2,0,0]=4 4414 B12R0.234 CCCCOCCCCOC(=O)C 34a_100000210227_100000033659 [0,1,1,0,0,0|2,0,0]=4 4415 B12R0.234 CCCCOCCCCOC(=O)C 7a_100000073216_100000210211 [0,1,1,0,0,0|2,0,0]=4 4416 B12R0.234 CCCCOCCCCOC(=O)C 7a_100000210227_100000033659 [0,1,1,0,0,0|2,0,0]=4 4417 B12R0.234 CCCCOCCCCSC(=O)C 34a_100000210227_200010402107 [0,1,1,0,0,0|2,0,0]=4 4418 B12R0.234 CCCCOCCCCSC(=O)C 7a_100000210227_200010402107 [0,1,1,0,0,0|2,0,0]=4 4419 B12R0.234 CCCCOCCCNCC(=O)N 2230a_200000211371_100000747473 [0,1,1,0,0,0|2,0,0]=4 4420 B12R0.234 CCCCOCCCNCC(=O)N 34a_200000211371_100000187820 [0,1,1,0,0,0|2,0,0]=4 4421 B12R0.234 CCCCOCCCNCC(=O)[O-] 34a_200000211371_100020667443 [0,1,1,0,0,0|1,0,1]=4 4422 B12R0.234 CCCCOCCCOCC(=O)N 34a_200011215613_100000187820 [0,1,1,0,0,0|2,0,0]=4 4423 B12R0.234 CCCCOCCCOCC(=O)N 7a_200011215613_100000187820 [0,1,1,0,0,0|2,0,0]=4 4424 B12R0.234 CCCCOCCCOCC(=O)[O-] 34a_200011215613_100020667443 [0,1,1,0,0,0|1,0,1]=4 4425 B12R0.234 CCCCOCCNOCC(=O)O 269956a_100000106656_100000743108 [0,1,1,0,0,0|2,0,0]=4 4426 B12R0.234 CCCCOCCOCCC(=O)C 34a_100000759926_100000743108 [0,1,1,0,0,0|2,0,0]=4 4427 B12R0.234 CCCCOCCOCCC(=O)C 7a_100000210238_100000053229 [0,1,1,0,0,0|2,0,0]=4 4428 B12R0.234 CCCCOCCOCCC(=O)C 7a_100000759926_100000743108 [0,1,1,0,0,0|2,0,0]=4 4429 B12R0.234 CCCCOCCOCCC(=O)N 34a_100000210238_100000731001 [0,1,1,0,0,0|2,0,0]=4 4430 B12R0.234 CCCCOCCOCCC(=O)N 34a_100000757172_100000743108 [0,1,1,0,0,0|2,0,0]=4 4431 B12R0.234 CCCCOCCOCCC(=O)N 7a_100000210238_100000744528 [0,1,1,0,0,0|2,0,0]=4 4432 B12R0.234 CCCCOCCOCCC(=O)N 7a_100000757172_100000743108 [0,1,1,0,0,0|2,0,0]=4 4433 B12R0.234 CCCCOCCSCCC(=O)C 62a_100000053229_100000743108 [0,1,1,0,0,0|2,0,0]=4 4434 B12R0.234 CCCCOCCSCCC(=O)C 62a_100000743108_100000053229 [0,1,1,0,0,0|2,0,0]=4 4435 B12R0.234 CCCCOCCSCCC(=O)N 62a_100000743108_100000744528 [0,1,1,0,0,0|2,0,0]=4 4436 B12R0.234 CCCCOCCSCCC(=O)N 62a_100000744528_100000743108 [0,1,1,0,0,0|2,0,0]=4 4437 B12R0.234 CCCCOCNCCCC(=O)N 34a_100000739312_100011995733 [0,1,1,0,0,0|2,0,0]=4 4438 B12R0.234 CCCCOCOCCCC(=O)C 34a_100000759063_100011995733 [0,1,1,0,0,0|2,0,0]=4 4439 B12R0.234 CCCCOCSCCCC(=O)C 62a_100011215641_100011995733 [0,1,1,0,0,0|2,0,0]=4 4440 B12R0.234 CCCCOCSCCCC(=O)C 62a_100011995733_100011215641 [0,1,1,0,0,0|2,0,0]=4 4441 B12R0.234 CCCCOCSCCCC(=O)N 62a_100011995733_100102525003 [0,1,1,0,0,0|2,0,0]=4 4442 B12R0.234 CCCCOCSCCCC(=O)N 62a_100102525003_100011995733 [0,1,1,0,0,0|2,0,0]=4 4443 B12R0.234 CCCCSCCCCCB(O)O 62a_100000210211_200009817188 [0,1,1,0,0,0|1,0,1]=4 4444 B12R0.234 CCCCSCCCCCB(O)O 62a_200009817188_100000210210 [0,1,1,0,0,0|1,0,1]=4 4445 B12R0.234 CCCCSCCCCCC(=O)N 62a_100000210211_100009817443 [0,1,1,0,0,0|1,0,0]=3 4446 B12R0.234 CCCCSCCCCCC(=O)N 62a_100009817443_100000210210 [0,1,1,0,0,0|1,0,0]=3 4447 B12R0.234 CCCCSCCCCOC(=O)C 62a_100000033659_100000210210 [0,1,1,0,0,0|2,0,0]=4 4448 B12R0.234 CCCCSCCCCOC(=O)C 62a_100000210211_100000033659 [0,1,1,0,0,0|2,0,0]=4 4449 B12R0.234 CCCCSCCCCSC(=O)C 62a_100000210211_200010402107 [0,1,1,0,0,0|2,0,0]=4 4450 B12R0.234 CCCCSCCCCSC(=O)C 62a_200010402107_100000210210 [0,1,1,0,0,0|2,0,0]=4 4451 B12R0.234 CCCCSCCNCCC(=O)N 2230a_100025743550_100000744528 [0,1,1,0,0,0|2,0,0]=4 4452 B12R0.234 CCCCSCCOCCC(=O)C 7a_200000230436_100000053229 [0,1,1,0,0,0|2,0,0]=4 4453 B12R0.234 CCCCSCCOCCC(=O)N 34a_200000230436_100000731001 [0,1,1,0,0,0|2,0,0]=4 4454 B12R0.234 CCCCSCCOCCC(=O)N 7a_200000230436_100000744528 [0,1,1,0,0,0|2,0,0]=4 4455 B12R0.234 CCCNCCCCCNC(=O)C 2230a_200012022750_100000210303 [0,1,1,0,0,0|2,0,0]=4 4456 B12R0.234 CCCNCCCCCNC(=O)C 34a_200012022750_100000210303 [0,1,1,0,0,0|2,0,0]=4 4457 B12R0.234 CCCOCCCCCCB(O)O 34a_100000210258_100009817187 [0,1,1,0,0,0|1,0,1]=4 4458 B12R0.234 CCCOCCCCCOC(=O)C 34a_100000210258_100000033007 [0,1,1,0,0,0|2,0,0]=4 4459 B12R0.234 CCCOCCCNCCC(=O)N 2230a_100011217757_100000744528 [0,1,1,0,0,0|2,0,0]=4 4460 B12R0.234 CCCOCCCNCCC(=O)N 34a_100011217757_100000731001 [0,1,1,0,0,0|2,0,0]=4 4461 B12R0.234 CCCOCCNCCCC(=O)C 34a_100161115042_100000685027 [0,1,1,0,0,0|2,0,0]=4 4462 B12R0.234 CCCOCCNCCCC(=O)N 34a_100000739312_100011215938 [0,1,1,0,0,0|2,0,0]=4 4463 B12R0.234 CCCOCCNCCCC(=O)N 34a_100161115042_100102525003 [0,1,1,0,0,0|2,0,0]=4 4464 B12R0.234 CCCOCCOCCCC(=O)C 34a_100000752267_100000685027 [0,1,1,0,0,0|2,0,0]=4 4465 B12R0.234 CCCOCCOCCCC(=O)C 34a_100000759063_100011215938 [0,1,1,0,0,0|2,0,0]=4 4466 B12R0.234 CCCOCCOCCCC(=O)C 7a_100000752267_100011215641 [0,1,1,0,0,0|2,0,0]=4 4467 B12R0.234 CCCOCCOCCCC(=O)C 7a_100000759063_100011215938 [0,1,1,0,0,0|2,0,0]=4 4468 B12R0.234 CCCOCCOCCCC(=O)N 34a_100000752267_100102525003 [0,1,1,0,0,0|2,0,0]=4 4469 B12R0.234 CCCOCCOCCCC(=O)N 7a_100000752267_100102525003 [0,1,1,0,0,0|2,0,0]=4 4470 B12R0.234 CCCOCCSCCCC(=O)C 62a_100011215641_100011215938 [0,1,1,0,0,0|2,0,0]=4 4471 B12R0.234 CCCOCCSCCCC(=O)C 62a_100011215938_100011215641 [0,1,1,0,0,0|2,0,0]=4 4472 B12R0.234 CCCOCCSCCCC(=O)N 62a_100011215938_100102525003 [0,1,1,0,0,0|2,0,0]=4 4473 B12R0.234 CCCOCCSCCCC(=O)N 62a_100102525003_100011215938 [0,1,1,0,0,0|2,0,0]=4 4474 B12R0.234 CCCSCCCCCCB(O)O 62a_100000210303_100009817187 [0,1,1,0,0,0|1,0,1]=4 4475 B12R0.234 CCCSCCCCCCB(O)O 62a_100009817187_100000210303 [0,1,1,0,0,0|1,0,1]=4 4476 B12R0.234 CCCSCCCCCOC(=O)C 62a_100000033007_100000210303 [0,1,1,0,0,0|2,0,0]=4 4477 B12R0.234 CCCSCCCCCOC(=O)C 62a_100000210303_100000033007 [0,1,1,0,0,0|2,0,0]=4 4478 B12R0.234 CCCSCCOCCCC(=O)C 34a_200000230433_100000685027 [0,1,1,0,0,0|2,0,0]=4 4479 B12R0.234 CCCSCCOCCCC(=O)C 7a_200000230433_100011215641 [0,1,1,0,0,0|2,0,0]=4 4480 B12R0.234 CCCSCCOCCCC(=O)N 34a_200000230433_100102525003 [0,1,1,0,0,0|2,0,0]=4 4481 B12R0.234 CCCSCCOCCCC(=O)N 7a_200000230433_100102525003 [0,1,1,0,0,0|2,0,0]=4 4482 B12R0.234 CCNCCCCCCNC(=O)C 2230a_200011996284_100000210202 [0,1,1,0,0,0|2,0,0]=4 4483 B12R0.234 CCNCCCCCCNC(=O)C 34a_200011996284_100000210202 [0,1,1,0,0,0|2,0,0]=4 4484 B12R0.234 CCNCCOCCOCC(=O)O 269956a_100009854275_100000210202 [0,1,1,0,0,0|2,0,0]=4 4485 B12R0.234 CCOCCCNCCCC(=O)C 34a_100000210961_100000685027 [0,1,1,0,0,0|2,0,0]=4 4486 B12R0.234 CCOCCCNCCCC(=O)N 34a_100000210961_100102525003 [0,1,1,0,0,0|2,0,0]=4 4487 B12R0.234 CCOCCCNCCCC(=O)N 34a_100000739312_100012232248 [0,1,1,0,0,0|2,0,0]=4 4488 B12R0.234 CCOCCCOCCCC(=O)C 34a_100000757476_100000685027 [0,1,1,0,0,0|2,0,0]=4 4489 B12R0.234 CCOCCCOCCCC(=O)C 34a_100000759063_100012232248 [0,1,1,0,0,0|2,0,0]=4 4490 B12R0.234 CCOCCCOCCCC(=O)C 7a_100000757476_100011215641 [0,1,1,0,0,0|2,0,0]=4 4491 B12R0.234 CCOCCCOCCCC(=O)C 7a_100000759063_100012232248 [0,1,1,0,0,0|2,0,0]=4 4492 B12R0.234 CCOCCCOCCCC(=O)N 34a_100000757476_100102525003 [0,1,1,0,0,0|2,0,0]=4 4493 B12R0.234 CCOCCCOCCCC(=O)N 7a_100000757476_100102525003 [0,1,1,0,0,0|2,0,0]=4 4494 B12R0.234 CCOCCCSCCCC(=O)C 62a_100011215641_100012232248 [0,1,1,0,0,0|2,0,0]=4 4495 B12R0.234 CCOCCCSCCCC(=O)C 62a_100012232248_100011215641 [0,1,1,0,0,0|2,0,0]=4 4496 B12R0.234 CCOCCCSCCCC(=O)N 62a_100012232248_100102525003 [0,1,1,0,0,0|2,0,0]=4 4497 B12R0.234 CCOCCCSCCCC(=O)N 62a_100102525003_100012232248 [0,1,1,0,0,0|2,0,0]=4 4498 B12R0.234 CCOCCNCCCCC(=O)C 34a_102516460346_100009817362 [0,1,1,0,0,0|2,0,0]=4 4499 B12R0.234 CCOCCNCCCCC(=O)N 34a_100000696515_100000210147 [0,1,1,0,0,0|2,0,0]=4 4500 B12R0.234 CCOCCNCCOCC(=O)O 269956a_100000700818_100000210147 [0,1,1,0,0,0|2,0,0]=4 4501 B12R0.234 CCOCCOCCCCC(=O)C 34a_100000210136_100009817362 [0,1,1,0,0,0|2,0,0]=4 4502 B12R0.234 CCOCCOCCCCC(=O)C 7a_100000210136_100000735457 [0,1,1,0,0,0|2,0,0]=4 4503 B12R0.234 CCOCCOCCCCC(=O)N 34a_100012022536_100000210147 [0,1,1,0,0,0|2,0,0]=4 4504 B12R0.234 CCOCCOCCCCC(=O)N 7a_100012022536_100011215890 [0,1,1,0,0,0|2,0,0]=4 4505 B12R0.234 CCOCCOCCNCC(=O)O 269956a_100016091260_100011211534 [0,1,1,0,0,0|2,0,0]=4 4506 B12R0.234 CCOCCSCCCCC(=O)C 62a_100000210147_100000735457 [0,1,1,0,0,0|2,0,0]=4 4507 B12R0.234 CCOCCSCCCCC(=O)C 62a_100000735457_100011215890 [0,1,1,0,0,0|2,0,0]=4 4508 B12R0.234 CCOCSCCCCCC(=O)N 62a_100000739092_100009817443 [0,1,1,0,0,0|2,0,0]=4 4509 B12R0.234 CCOCSCCCCCC(=O)N 62a_100009817443_100000739092 [0,1,1,0,0,0|2,0,0]=4 4510 B12R0.234 CCSCCCOCCCC(=O)C 34a_100011216438_100000685027 [0,1,1,0,0,0|2,0,0]=4 4511 B12R0.234 CCSCCCOCCCC(=O)C 7a_100011216438_100011215641 [0,1,1,0,0,0|2,0,0]=4 4512 B12R0.234 CCSCCCOCCCC(=O)N 34a_100011216438_100102525003 [0,1,1,0,0,0|2,0,0]=4 4513 B12R0.234 CCSCCCOCCCC(=O)N 7a_100011216438_100102525003 [0,1,1,0,0,0|2,0,0]=4 4514 B12R0.234 CCSCCNCCCCC(=O)N 34a_100000696515_100000757381 [0,1,1,0,0,0|2,0,0]=4 4515 B12R0.234 CCSCCNCCOCC(=O)O 269956a_100000700818_100000757381 [0,1,1,0,0,0|2,0,0]=4 4516 B12R0.234 CCSCCOCCCCC(=O)C 34a_100000212035_100009817362 [0,1,1,0,0,0|2,0,0]=4 4517 B12R0.234 CCSCCOCCCCC(=O)C 7a_100000212035_100000735457 [0,1,1,0,0,0|2,0,0]=4 4518 B12R0.234 CCSCCOCCCCC(=O)N 34a_100012022536_100000757381 [0,1,1,0,0,0|2,0,0]=4 4519 B12R0.234 CCSCCOCCCCC(=O)N 7a_100012022536_100000757381 [0,1,1,0,0,0|2,0,0]=4 4520 B12R0.234 CCSCCSCCCCC(=O)C 62a_100000735457_100000757381 [0,1,1,0,0,0|2,0,0]=4 4521 B12R0.234 CCSCCSCCCCC(=O)C 62a_100000757381_100000735457 [0,1,1,0,0,0|2,0,0]=4 4522 B12R0.234 CNCCCCCOCCC(=O)N 34a_100000722520_100000731001 [0,1,1,0,0,0|2,0,0]=4 4523 B12R0.234 CNCCCOCCCCC(=O)C 34a_100000213112_100009817362 [0,1,1,0,0,0|2,0,0]=4 4524 B12R0.234 COCCCCCCNCC(=O)N 2230a_100000711301_100011998445 [0,1,1,0,0,0|2,0,0]=4 4525 B12R0.234 COCCCCCCNCC(=O)O 269956a_100016091260_100011998445 [0,1,1,0,0,0|1,0,0]=3 4526 B12R0.234 COCCCCCCOCC(=O)C 34a_100000211253_100011998445 [0,1,1,0,0,0|2,0,0]=4 4527 B12R0.234 COCCCCCCOCC(=O)N 34a_200012092642_100000187820 [0,1,1,0,0,0|2,0,0]=4 4528 B12R0.234 COCCCCCCOCC(=O)N 7a_200012092642_100000187820 [0,1,1,0,0,0|2,0,0]=4 4529 B12R0.234 COCCCCCCOCC(=O)[O-] 34a_200012092642_100020667443 [0,1,1,0,0,0|1,0,1]=4 4530 B12R0.234 COCCCCCCSCC(=O)N 62a_100000747473_100011998445 [0,1,1,0,0,0|2,0,0]=4 4531 B12R0.234 COCCCCCCSCC(=O)N 62a_100011998445_100000747473 [0,1,1,0,0,0|2,0,0]=4 4532 B12R0.234 COCCCCCCSCC(=O)[O-] 62a_100011998445_100020667443 [0,1,1,0,0,0|1,0,1]=4 4533 B12R0.234 COCCCCCCSCC(=O)[O-] 62a_100020667443_100011998445 [0,1,1,0,0,0|1,0,1]=4 4534 B12R0.234 COCCCCCNCCC(=O)N 2230a_100000747528_100000744528 [0,1,1,0,0,0|2,0,0]=4 4535 B12R0.234 COCCCCCNCCC(=O)N 34a_100000747528_100000731001 [0,1,1,0,0,0|2,0,0]=4 4536 B12R0.234 COCCCCNCCCC(=O)N 34a_100000739312_100000755781 [0,1,1,0,0,0|2,0,0]=4 4537 B12R0.234 COCCCCOCCCC(=O)C 34a_100000740925_100000685027 [0,1,1,0,0,0|2,0,0]=4 4538 B12R0.234 COCCCCOCCCC(=O)C 34a_100000759063_100000755781 [0,1,1,0,0,0|2,0,0]=4 4539 B12R0.234 COCCCCOCCCC(=O)C 7a_100000759063_100000730899 [0,1,1,0,0,0|2,0,0]=4 4540 B12R0.234 COCCCCOCCCC(=O)N 34a_100000740925_100102525003 [0,1,1,0,0,0|2,0,0]=4 4541 B12R0.234 COCCCCSCCCC(=O)C 62a_100000730899_100011215641 [0,1,1,0,0,0|2,0,0]=4 4542 B12R0.234 COCCCCSCCCC(=O)C 62a_100011215641_100000730899 [0,1,1,0,0,0|2,0,0]=4 4543 B12R0.234 COCCCCSCCCC(=O)N 62a_100000730899_100102525003 [0,1,1,0,0,0|2,0,0]=4 4544 B12R0.234 COCCCCSCCCC(=O)N 62a_100102525003_100000730899 [0,1,1,0,0,0|2,0,0]=4 4545 B12R0.234 COCCCNCCCCC(=O)C 34a_100150723488_100009817362 [0,1,1,0,0,0|2,0,0]=4 4546 B12R0.234 COCCCNCCCCC(=O)N 34a_100000696515_100000740836 [0,1,1,0,0,0|2,0,0]=4 4547 B12R0.234 COCCCNCCOCC(=O)O 269956a_100000700818_100000740836 [0,1,1,0,0,0|2,0,0]=4 4548 B12R0.234 COCCCOCCCCC(=O)C 34a_100000740835_100009817362 [0,1,1,0,0,0|2,0,0]=4 4549 B12R0.234 COCCCOCCCCC(=O)N 34a_100012022536_100000740836 [0,1,1,0,0,0|2,0,0]=4 4550 B12R0.234 COCCCOCCCCC(=O)N 7a_100012022536_100000740836 [0,1,1,0,0,0|2,0,0]=4 4551 B12R0.234 COCCCSCCCCC(=O)C 62a_100000709357_100000735457 [0,1,1,0,0,0|2,0,0]=4 4552 B12R0.234 COCCCSCCCCC(=O)C 62a_100000735457_100000709357 [0,1,1,0,0,0|2,0,0]=4 4553 B12R0.234 COCCNCCCCCC(=O)N 2230a_100000209980_100009817443 [0,1,1,0,0,0|2,0,0]=4 4554 B12R0.234 COCCOCCCCCC(=O)N 34a_100000123541_100011201679 [0,1,1,0,0,0|2,0,0]=4 4555 B12R0.234 COCCOCCCCCC(=O)N 34a_100000210237_100009817443 [0,1,1,0,0,0|2,0,0]=4 4556 B12R0.234 COCCOCCCCCC(=O)N 7a_100000123541_100000233755 [0,1,1,0,0,0|2,0,0]=4 4557 B12R0.234 COCCOCCCCCC(=O)[O-] 7a_100102619762_100000233755 [0,1,1,0,0,0|1,0,1]=4 4558 B12R0.234 COCCOCCCNCC(=O)O 269956a_100016091260_100011216529 [0,1,1,0,0,0|2,0,0]=4 4559 B12R0.234 COCCSCCCCCC(=O)N 62a_100000233755_100009817443 [0,1,1,0,0,0|2,0,0]=4 4560 B12R0.234 COCCSCCCCCC(=O)N 62a_100009817443_100000233755 [0,1,1,0,0,0|2,0,0]=4 4561 B12R0.234 CSCCCCOCCCC(=O)C 34a_100011217163_100000685027 [0,1,1,0,0,0|2,0,0]=4 4562 B12R0.234 CSCCCCOCCCC(=O)C 7a_100011217163_100011215641 [0,1,1,0,0,0|2,0,0]=4 4563 B12R0.234 CSCCCCOCCCC(=O)N 34a_100011217163_100102525003 [0,1,1,0,0,0|2,0,0]=4 4564 B12R0.234 CSCCCCOCCCC(=O)N 7a_100011217163_100102525003 [0,1,1,0,0,0|2,0,0]=4 4565 B12R0.234 CSCCCOCCCCC(=O)C 34a_100000690336_100009817362 [0,1,1,0,0,0|2,0,0]=4 4566 B12R0.234 CSCCCOCCCCC(=O)C 7a_100000690336_100000735457 [0,1,1,0,0,0|2,0,0]=4 4567 B12R0.234 CSCCNCCCCCC(=O)N 2230a_100020590264_100009817443 [0,1,1,0,0,0|2,0,0]=4 4568 B12R0.234 CSCCOCCCCCC(=O)N 34a_100000123541_100000212216 [0,1,1,0,0,0|2,0,0]=4 4569 B12R0.234 CSCCOCCCCCC(=O)N 34a_100000230434_100009817443 [0,1,1,0,0,0|2,0,0]=4 4570 B12R0.234 CSCCOCCCCCC(=O)N 7a_100000123541_100000212216 [0,1,1,0,0,0|2,0,0]=4 4571 B12R0.234 CSCCOCCCCCC(=O)N 7a_100000230434_100009817443 [0,1,1,0,0,0|2,0,0]=4 4572 B12R0.234 CSCCOCCCCCC(=O)[O-] 7a_100102619762_100000212216 [0,1,1,0,0,0|1,0,1]=4 4573 B12R0.234 CSCCSCCCCCC(=O)N 62a_100000212216_100009817443 [0,1,1,0,0,0|2,0,0]=4 4574 B12R0.234 CSCCSCCCCCC(=O)N 62a_100009817443_100000751147 [0,1,1,0,0,0|2,0,0]=4 4575 B12R0.234 N#CCCCCCCNCC(=O)O 269956a_100016091260_100009813337 [0,1,1,0,0,0|1,0,1]=4 4576 B12R0.234 NC(=O)CCCCCNCCCF 2230a_100015189416_100009817443 [0,1,1,0,0,0|2,0,0]=4 4577 B12R0.234 NC(=O)CCCCCNCCCF 34a_100015189416_100009817443 [0,1,1,0,0,0|2,0,0]=4 4578 B12R0.234 NC(=O)CCCCCOCCCBr 34a_100011217188_100009817443 [0,1,1,0,0,0|2,0,0]=4 4579 B12R0.234 NC(=O)CCCCCOCCCCl 34a_100000230001_100009817443 [0,1,1,0,0,0|2,0,0]=4 4580 B12R0.234 NC(=O)CCCCCOCCCF 34a_100000123541_100011934791 [0,1,1,0,0,0|2,0,0]=4 4581 B12R0.234 NC(=O)CCCCCOCCCF 34a_100000759539_100009817443 [0,1,1,0,0,0|2,0,0]=4 4582 B12R0.234 NC(=O)CCCCCOCCCF 7a_100000123541_100011934791 [0,1,1,0,0,0|2,0,0]=4 4583 B12R0.234 NC(=O)CCCCCOCCCO 34a_100000123541_100000230001 [0,1,1,0,0,0|2,0,0]=4 4584 B12R0.234 NC(=O)CCCCCOCCCO 7a_100000123541_100011215043 [0,1,1,0,0,0|2,0,0]=4 4585 B12R0.234 NC(=O)CCCCCSCCCF 62a_100009817443_100011934791 [0,1,1,0,0,0|2,0,0]=4 4586 B12R0.234 NC(=O)CCCCCSCCCF 62a_100011934791_100009817443 [0,1,1,0,0,0|2,0,0]=4 4587 B12R0.234 NC(=O)CCCCCSCCCO 62a_100009817443_100011215043 [0,1,1,0,0,0|2,0,0]=4 4588 B12R0.234 NC(=O)CCCCCSCCCO 62a_100011215043_100009817443 [0,1,1,0,0,0|2,0,0]=4 4589 B12R0.234 NC(=O)CCCCNCCCCF 34a_100000696515_100000729493 [0,1,1,0,0,0|2,0,0]=4 4590 B12R0.234 NC(=O)CCCCNCCCCO 34a_100000696515_100011216708 [0,1,1,0,0,0|2,0,0]=4 4591 B12R0.234 NC(=O)CCCCOCCCCF 34a_100012022536_100000729493 [0,1,1,0,0,0|2,0,0]=4 4592 B12R0.234 NC(=O)CCCCOCCCCF 7a_100012022536_100000729493 [0,1,1,0,0,0|2,0,0]=4 4593 B12R0.234 NC(=O)CCCCOCCCCO 34a_100012022536_100011216708 [0,1,1,0,0,0|2,0,0]=4 4594 B12R0.234 NC(=O)CCCCOCCCCO 7a_100012022536_100000210776 [0,1,1,0,0,0|2,0,0]=4 4595 B12R0.234 NC(=O)CCCNCCCCCF 34a_100000739312_100000729378 [0,1,1,0,0,0|2,0,0]=4 4596 B12R0.234 NC(=O)CCCNCCCCCO 34a_100000739312_100000746330 [0,1,1,0,0,0|2,0,0]=4 4597 B12R0.234 NC(=O)CCCNCCCCCO 34a_100000762737_100102525003 [0,1,1,0,0,0|2,0,0]=4 4598 B12R0.234 NC(=O)CCCOCCCCCBr 34a_100000746331_100102525003 [0,1,1,0,0,0|2,0,0]=4 4599 B12R0.234 NC(=O)CCCOCCCCCBr 7a_100000746331_100102525003 [0,1,1,0,0,0|2,0,0]=4 4600 B12R0.234 NC(=O)CCCOCCCCCCl 34a_100000746330_100102525003 [0,1,1,0,0,0|2,0,0]=4 4601 B12R0.234 NC(=O)CCCOCCCCCCl 7a_100000746330_100102525003 [0,1,1,0,0,0|2,0,0]=4 4602 B12R0.234 NC(=O)CCCOCCCCCI 34a_200012148887_100102525003 [0,1,1,0,0,0|2,0,0]=4 4603 B12R0.234 NC(=O)CCCOCCCCCI 7a_200012148887_100102525003 [0,1,1,0,0,0|2,0,0]=4 4604 B12R0.234 NC(=O)CCCSCCCCCF 62a_100000729378_100102525003 [0,1,1,0,0,0|2,0,0]=4 4605 B12R0.234 NC(=O)CCCSCCCCCF 62a_100102525003_100000729378 [0,1,1,0,0,0|2,0,0]=4 4606 B12R0.234 NC(=O)CCCSCCCCCO 62a_100000746330_100102525003 [0,1,1,0,0,0|2,0,0]=4 4607 B12R0.234 NC(=O)CCCSCCCCCO 62a_100102525003_100000746330 [0,1,1,0,0,0|2,0,0]=4 4608 B12R0.234 NC(=O)CCNCCCCCCO 2230a_100000686447_100000744528 [0,1,1,0,0,0|2,0,0]=4 4609 B12R0.234 NC(=O)CCNCCCCCCO 34a_100000686447_100000731001 [0,1,1,0,0,0|2,0,0]=4 4610 B12R0.234 NC(=O)CCOCCCCCCBr 34a_100011215345_100000731001 [0,1,1,0,0,0|2,0,0]=4 4611 B12R0.234 NC(=O)CCOCCCCCCBr 7a_100011215345_100000744528 [0,1,1,0,0,0|2,0,0]=4 4612 B12R0.234 NC(=O)CCOCCCCCCCl 34a_100000766143_100000731001 [0,1,1,0,0,0|2,0,0]=4 4613 B12R0.234 NC(=O)CCOCCCCCCCl 7a_100000766143_100000744528 [0,1,1,0,0,0|2,0,0]=4 4614 B12R0.234 NC(=O)CCOCCCCCCF 34a_100000732779_100000731001 [0,1,1,0,0,0|2,0,0]=4 4615 B12R0.234 NC(=O)CCOCCCCCCF 34a_100000757172_100015922095 [0,1,1,0,0,0|2,0,0]=4 4616 B12R0.234 NC(=O)CCOCCCCCCF 7a_100000732779_100000744528 [0,1,1,0,0,0|2,0,0]=4 4617 B12R0.234 NC(=O)CCOCCCCCCF 7a_100000757172_100015922095 [0,1,1,0,0,0|2,0,0]=4 4618 B12R0.234 NC(=O)CCOCCCCCCO 34a_100000757172_100000766143 [0,1,1,0,0,0|2,0,0]=4 4619 B12R0.234 NC(=O)CCOCCCCCCO 7a_100000757172_100000766143 [0,1,1,0,0,0|2,0,0]=4 4620 B12R0.234 NC(=O)CCSCCCCCCF 62a_100000744528_100015922095 [0,1,1,0,0,0|2,0,0]=4 4621 B12R0.234 NC(=O)CCSCCCCCCF 62a_100015922095_100000744528 [0,1,1,0,0,0|2,0,0]=4 4622 B12R0.234 NC(=O)CCSCCCCCCO 62a_100000744528_100000766143 [0,1,1,0,0,0|2,0,0]=4 4623 B12R0.234 NC(=O)CCSCCCCCCO 62a_100000766143_100000744528 [0,1,1,0,0,0|2,0,0]=4 4624 B12R0.234 NC(=O)CNCCCCCCCO 2230a_100000711301_100000760002 [0,1,1,0,0,0|2,0,0]=4 4625 B12R0.234 NC(=O)CNCCCCCCCO 2230a_100011996573_100000747473 [0,1,1,0,0,0|2,0,0]=4 4626 B12R0.234 NC(=O)CNCCCCCCCO 34a_100011996573_100000187820 [0,1,1,0,0,0|2,0,0]=4 4627 B12R0.234 NC(=O)COCCCCCCCBr 34a_100000760002_100000187820 [0,1,1,0,0,0|2,0,0]=4 4628 B12R0.234 NC(=O)COCCCCCCCBr 7a_100000760002_100000187820 [0,1,1,0,0,0|2,0,0]=4 4629 B12R0.234 NC(=O)CSCCCCCCCO 62a_100000747473_100000760002 [0,1,1,0,0,0|2,0,0]=4 4630 B12R0.234 NC(=O)CSCCCCCCCO 62a_100000760002_100000747473 [0,1,1,0,0,0|2,0,0]=4 4631 B12R0.234 NCCCCCCCOCC(=O)N 34a_100011996573_100000187820 [0,1,1,0,0,0|2,0,0]=4 4632 B12R0.234 NCCCCCCCOCC(=O)[O-] 34a_100011996573_100020667443 [0,1,1,0,0,0|1,0,1]=4 4633 B12R0.234 NCCCCCCOCCC(=O)N 34a_100000686447_100000731001 [0,1,1,0,0,0|2,0,0]=4 4634 B12R0.234 NCCCCCOCCCC(=O)N 34a_100000762737_100102525003 [0,1,1,0,0,0|2,0,0]=4 4635 B12R0.234 NCCCOCCCCCC(=O)N 34a_100000182051_100009817443 [0,1,1,0,0,0|2,0,0]=4 4636 B12R0.234 O=C(O)CNCCCCCCCO 269956a_100016091260_100000760002 [0,1,1,0,0,0|1,0,0]=3 4637 B12R0.234 O=C(O)COCCNCCCCF 269956a_100000700818_100000729493 [0,1,1,0,0,0|2,0,0]=4 4638 B12R0.234 O=C(O)COCCNCCCCO 269956a_100000700818_100000210776 [0,1,1,0,0,0|2,0,0]=4 4639 B12R0.234 O=C(O)CONCCCCCCF 269956a_100000106656_100015922095 [0,1,1,0,0,0|2,0,0]=4 4640 B12R0.234 O=C(O)CONCCCCCCO 269956a_100000106656_100000766143 [0,1,1,0,0,0|2,0,0]=4 4641 B12R0.234 O=C([O-])CCCCCOCCCF 7a_100102619762_100011934791 [0,1,1,0,0,0|1,0,1]=4 4642 B12R0.234 O=C([O-])CCCCCOCCCO 7a_100102619762_100011215043 [0,1,1,0,0,0|1,0,1]=4 4643 B12R0.234 O=C([O-])CNCCCCCCCO 34a_100011996573_100020667443 [0,1,1,0,0,0|1,0,1]=4 4644 B12R0.234 O=C([O-])COCCCCCCCBr 34a_100000760002_100020667443 [0,1,1,0,0,0|1,0,1]=4 4645 B12R0.234 O=C([O-])CSCCCCCCCO 62a_100000760002_100020667443 [0,1,1,0,0,0|1,0,1]=4 4646 B12R0.234 O=C([O-])CSCCCCCCCO 62a_100020667443_100000760002 [0,1,1,0,0,0|1,0,1]=4 4647 B12R0.234 [13CH3]C(=O)CCCCCCCCCF 1458a_200009909015_200025704644 [0,1,1,0,0,0|1,0,0]=3 4648 B12R0.268 CC(=O)CCCCOCCC(C)Br 34a_100009893172_100009817362 [0,1,1,0,0,0|2,0,0]=4 4649 B12R0.268 CC(=O)CCCCOCCC(C)C 34a_100000210254_100009817362 [0,1,1,0,0,0|2,0,0]=4 4650 B12R0.268 CC(=O)CCCCOCCC(C)C 7a_100000210254_100000735457 [0,1,1,0,0,0|2,0,0]=4 4651 B12R0.268 CC(=O)CCCCOCC[C@@H](C)N 34a_100000706166_100009817362 [0,1,1,0,0,0|2,0,0]=4 4652 B12R0.268 CC(=O)CCCCSCCC(C)C 62a_100000210312_100000735457 [0,1,1,0,0,0|2,0,0]=4 4653 B12R0.268 CC(=O)CCCCSCCC(C)C 62a_100000735457_100000210312 [0,1,1,0,0,0|2,0,0]=4 4654 B12R0.268 CC(=O)CCCCSCCC(C)O 62a_100000735457_100012276601 [0,1,1,0,0,0|2,0,0]=4 4655 B12R0.268 CC(=O)CCCCSCCC(C)O 62a_100012276601_100000735457 [0,1,1,0,0,0|2,0,0]=4 4656 B12R0.268 CC(=O)CCCNCCCC(C)C 34a_200000737386_100000685027 [0,1,1,0,0,0|2,0,0]=4 4657 B12R0.268 CC(=O)CCCOCCCC(C)C 34a_100000210774_100000685027 [0,1,1,0,0,0|2,0,0]=4 4658 B12R0.268 CC(=O)CCCOCCCC(C)C 34a_100000759063_100011214892 [0,1,1,0,0,0|2,0,0]=4 4659 B12R0.268 CC(=O)CCCOCCCC(C)C 7a_100000210774_100011215641 [0,1,1,0,0,0|2,0,0]=4 4660 B12R0.268 CC(=O)CCCOCCCC(C)C 7a_100000759063_100011214892 [0,1,1,0,0,0|2,0,0]=4 4661 B12R0.268 CC(=O)CCCOCCCC(C)O 34a_100000759063_200000718107 [0,1,1,0,0,0|2,0,0]=4 4662 B12R0.268 CC(=O)CCCOCCCC(C)O 7a_100000759063_200000718107 [0,1,1,0,0,0|2,0,0]=4 4663 B12R0.268 CC(=O)CCCSCCCC(C)C 62a_100011214892_100011215641 [0,1,1,0,0,0|2,0,0]=4 4664 B12R0.268 CC(=O)CCCSCCCC(C)C 62a_100011215641_100011214892 [0,1,1,0,0,0|2,0,0]=4 4665 B12R0.268 CC(=O)CCCSCCCC(C)O 62a_100011215641_200000718107 [0,1,1,0,0,0|2,0,0]=4 4666 B12R0.268 CC(=O)CCCSCCCC(C)O 62a_200000718107_100011215641 [0,1,1,0,0,0|2,0,0]=4 4667 B12R0.268 CC(=O)CCOCCCCC(C)C 34a_100000759926_100011216152 [0,1,1,0,0,0|2,0,0]=4 4668 B12R0.268 CC(=O)CCOCCCCC(C)C 7a_100000759926_100011216152 [0,1,1,0,0,0|2,0,0]=4 4669 B12R0.268 CC(=O)CCOCCCCC(C)C 7a_100011214890_100000053229 [0,1,1,0,0,0|2,0,0]=4 4670 B12R0.268 CC(=O)CCSCCCCC(C)C 62a_100000053229_100011216152 [0,1,1,0,0,0|2,0,0]=4 4671 B12R0.268 CC(=O)CCSCCCCC(C)C 62a_100011216152_100000053229 [0,1,1,0,0,0|2,0,0]=4 4672 B12R0.268 CC(=O)COCCCCCC(C)C 34a_100000211253_100000210682 [0,1,1,0,0,0|2,0,0]=4 4673 B12R0.268 CC(=O)NCCCCCCC(C)C 11a_100000211014_100015343762 [0,1,1,0,0,0|2,0,0]=4 4674 B12R0.268 CC(=O)NCCCCCCC(C)C 1626a_100000211014_100015343762 [0,1,1,0,0,0|2,0,0]=4 4675 B12R0.268 CC(=O)NCCCCCCC(C)C 240690a_100000211014_100015343762 [0,1,1,0,0,0|2,0,0]=4 4676 B12R0.268 CC(=O)NCCCCCCC(C)C 527a_100000211014_100103153847 [0,1,1,0,0,0|2,0,0]=4 4677 B12R0.268 CC(Br)COCCCCCC(=O)N 34a_100012180447_100009817443 [0,1,1,0,0,0|2,0,0]=4 4678 B12R0.268 CC(C)CCCCCNCC(=O)N 2230a_100000711301_100000210682 [0,1,1,0,0,0|2,0,0]=4 4679 B12R0.268 CC(C)CCCCCNCC(=O)N 2230a_100011290863_100000747473 [0,1,1,0,0,0|2,0,0]=4 4680 B12R0.268 CC(C)CCCCCNCC(=O)N 34a_100011290863_100000187820 [0,1,1,0,0,0|2,0,0]=4 4681 B12R0.268 CC(C)CCCCCNCC(=O)O 269956a_100016091260_100000210682 [0,1,1,0,0,0|1,0,0]=3 4682 B12R0.268 CC(C)CCCCCNCC(=O)[O-] 34a_100011290863_100020667443 [0,1,1,0,0,0|1,0,1]=4 4683 B12R0.268 CC(C)CCCCCOCC(=O)N 34a_100011995859_100000187820 [0,1,1,0,0,0|2,0,0]=4 4684 B12R0.268 CC(C)CCCCCOCC(=O)N 7a_100011995859_100000187820 [0,1,1,0,0,0|2,0,0]=4 4685 B12R0.268 CC(C)CCCCCOCC(=O)[O-] 34a_100011995859_100020667443 [0,1,1,0,0,0|1,0,1]=4 4686 B12R0.268 CC(C)CCCCCSCC(=O)N 62a_100000210682_100000747473 [0,1,1,0,0,0|2,0,0]=4 4687 B12R0.268 CC(C)CCCCCSCC(=O)N 62a_100000747473_100000210682 [0,1,1,0,0,0|2,0,0]=4 4688 B12R0.268 CC(C)CCCCCSCC(=O)[O-] 62a_100000210682_100020667443 [0,1,1,0,0,0|1,0,1]=4 4689 B12R0.268 CC(C)CCCCCSCC(=O)[O-] 62a_100020667443_100000210682 [0,1,1,0,0,0|1,0,1]=4 4690 B12R0.268 CC(C)CCCCNOCC(=O)O 269956a_100000106656_100011216152 [0,1,1,0,0,0|2,0,0]=4 4691 B12R0.268 CC(C)CCCCOCCC(=O)N 34a_100000757172_100011216152 [0,1,1,0,0,0|2,0,0]=4 4692 B12R0.268 CC(C)CCCCOCCC(=O)N 34a_100011214890_100000731001 [0,1,1,0,0,0|2,0,0]=4 4693 B12R0.268 CC(C)CCCCOCCC(=O)N 7a_100000757172_100011216152 [0,1,1,0,0,0|2,0,0]=4 4694 B12R0.268 CC(C)CCCCOCCC(=O)N 7a_100011214890_100000744528 [0,1,1,0,0,0|2,0,0]=4 4695 B12R0.268 CC(C)CCCCSCCC(=O)N 62a_100000744528_100011216152 [0,1,1,0,0,0|2,0,0]=4 4696 B12R0.268 CC(C)CCCCSCCC(=O)N 62a_100011216152_100000744528 [0,1,1,0,0,0|2,0,0]=4 4697 B12R0.268 CC(C)CCCNCCCC(=O)N 34a_100000739312_100011214892 [0,1,1,0,0,0|2,0,0]=4 4698 B12R0.268 CC(C)CCCNCCCC(=O)N 34a_200000737386_100102525003 [0,1,1,0,0,0|2,0,0]=4 4699 B12R0.268 CC(C)CCCOCCCC(=O)N 34a_100000210774_100102525003 [0,1,1,0,0,0|2,0,0]=4 4700 B12R0.268 CC(C)CCCOCCCC(=O)N 7a_100000210774_100102525003 [0,1,1,0,0,0|2,0,0]=4 4701 B12R0.268 CC(C)CCCSCCCC(=O)N 62a_100011214892_100102525003 [0,1,1,0,0,0|2,0,0]=4 4702 B12R0.268 CC(C)CCCSCCCC(=O)N 62a_100102525003_100011214892 [0,1,1,0,0,0|2,0,0]=4 4703 B12R0.268 CC(C)CCNCCCCC(=O)N 269862a_100000696515_100000185833 [0,1,1,0,0,0|2,0,0]=4 4704 B12R0.268 CC(C)CCNCCCCC(=O)N 34a_100000696515_100000210312 [0,1,1,0,0,0|2,0,0]=4 4705 B12R0.268 CC(C)CCNCCOCC(=O)O 269956a_100000700818_100000210312 [0,1,1,0,0,0|2,0,0]=4 4706 B12R0.268 CC(C)CCOCCCCC(=O)N 34a_100012022536_100000210312 [0,1,1,0,0,0|2,0,0]=4 4707 B12R0.268 CC(C)CCOCCCCC(=O)N 7a_100012022536_100000210626 [0,1,1,0,0,0|2,0,0]=4 4708 B12R0.268 CC(C)CNCCCCCC(=O)N 2230a_100000210953_100009817443 [0,1,1,0,0,0|2,0,0]=4 4709 B12R0.268 CC(C)CNCCCCCC(=O)N 34a_100000210953_100009817443 [0,1,1,0,0,0|2,0,0]=4 4710 B12R0.268 CC(C)COCCCCCC(=O)N 34a_100000123541_100000210624 [0,1,1,0,0,0|2,0,0]=4 4711 B12R0.268 CC(C)COCCCCCC(=O)N 34a_100000210257_100009817443 [0,1,1,0,0,0|2,0,0]=4 4712 B12R0.268 CC(C)COCCCCCC(=O)N 7a_100000123541_100000210760 [0,1,1,0,0,0|2,0,0]=4 4713 B12R0.268 CC(C)COCCCCCC(=O)[O-] 7a_100102619762_100000210760 [0,1,1,0,0,0|1,0,1]=4 4714 B12R0.268 CC(C)CSCCCCCC(=O)N 62a_100000210624_100009817443 [0,1,1,0,0,0|2,0,0]=4 4715 B12R0.268 CC(C)CSCCCCCC(=O)N 62a_100009817443_100000210760 [0,1,1,0,0,0|2,0,0]=4 4716 B12R0.268 CC(F)COCCCCCC(=O)N 34a_100015925927_100009817443 [0,1,1,0,0,0|2,0,0]=4 4717 B12R0.268 CC(O)CCCNCCCC(=O)N 34a_100000739312_200000718107 [0,1,1,0,0,0|2,0,0]=4 4718 B12R0.268 CC(O)CCCSCCCC(=O)N 62a_100102525003_200000718107 [0,1,1,0,0,0|2,0,0]=4 4719 B12R0.268 CC(O)CCCSCCCC(=O)N 62a_200000718107_100102525003 [0,1,1,0,0,0|2,0,0]=4 4720 B12R0.268 CC(O)CCNCCCCC(=O)N 34a_100000696515_100012276601 [0,1,1,0,0,0|2,0,0]=4 4721 B12R0.268 CC(O)CCNCCOCC(=O)O 269956a_100000700818_100012276601 [0,1,1,0,0,0|2,0,0]=4 4722 B12R0.268 CC(O)CCOCCCCC(=O)N 34a_100012022536_100012276601 [0,1,1,0,0,0|2,0,0]=4 4723 B12R0.268 CC(O)CCOCCCCC(=O)N 7a_100012022536_100012276601 [0,1,1,0,0,0|2,0,0]=4 4724 B12R0.268 CC(O)CNCCCCCC(=O)N 2230a_100000210904_100009817443 [0,1,1,0,0,0|2,0,0]=4 4725 B12R0.268 CC(O)CNCCCCCC(=O)N 34a_100000210904_100009817443 [0,1,1,0,0,0|2,0,0]=4 4726 B12R0.268 CC(O)COCCCCCC(=O)N 34a_100000123541_100011218427 [0,1,1,0,0,0|2,0,0]=4 4727 B12R0.268 CC(O)COCCCCCC(=O)N 7a_100000123541_100011218427 [0,1,1,0,0,0|2,0,0]=4 4728 B12R0.268 CC(O)COCCCCCC(=O)[O-] 7a_100102619762_100011218427 [0,1,1,0,0,0|1,0,1]=4 4729 B12R0.268 CC(O)CSCCCCCC(=O)N 62a_100009817443_100011218427 [0,1,1,0,0,0|2,0,0]=4 4730 B12R0.268 CC(O)CSCCCCCC(=O)N 62a_100011218427_100009817443 [0,1,1,0,0,0|2,0,0]=4 4731 B12R0.268 C[C@@H](Cl)COCCCCCC(=O)N 34a_100016084084_100009817443 [0,1,1,0,0,0|2,0,0]=4 4732 B12R0.268 C[C@@H](N)COCCCCCC(=O)N 34a_100000737577_100009817443 [0,1,1,0,0,0|2,0,0]=4 4733 B12R0.268 C[C@@H](O)COCCCCCC(=O)N 34a_100000123541_100009817552 [0,1,1,0,0,0|2,0,0]=4 4734 B12R0.268 C[C@@H](O)COCCCCCC(=O)N 7a_100000123541_100009817552 [0,1,1,0,0,0|2,0,0]=4 4735 B12R0.268 C[C@@H](O)COCCCCCC(=O)[O-] 7a_100102619762_100009817552 [0,1,1,0,0,0|1,0,1]=4 4736 B12R0.268 C[C@@H](O)CSCCCCCC(=O)N 62a_100009817443_100009817552 [0,1,1,0,0,0|2,0,0]=4 4737 B12R0.268 C[C@@H](O)CSCCCCCC(=O)N 62a_100009817552_100009817443 [0,1,1,0,0,0|2,0,0]=4 4738 B12R0.277 CCCC(=O)CCCCCC(=O)N 1458a_100000211992_100009817443 [0,1,1,0,0,0|1,0,1]=4 4739 B12R0.277 CCCC(C)CCCOCC(=O)N 34a_100011713154_100000187820 [0,1,1,0,0,0|2,0,0]=4 4740 B12R0.277 CCCC(C)CCCOCC(=O)N 7a_100011713154_100000187820 [0,1,1,0,0,0|2,0,0]=4 4741 B12R0.277 CCCC(C)CCCOCC(=O)[O-] 34a_100011713154_100020667443 [0,1,1,0,0,0|1,0,1]=4 4742 B12R0.277 CCCC(C)CCOCCC(=O)C 7a_100011217855_100000053229 [0,1,1,0,0,0|2,0,0]=4 4743 B12R0.277 CCCC(C)CCOCCC(=O)N 34a_100011217855_100000731001 [0,1,1,0,0,0|2,0,0]=4 4744 B12R0.277 CCCC(C)CCOCCC(=O)N 7a_100011217855_100000744528 [0,1,1,0,0,0|2,0,0]=4 4745 B12R0.277 CCCC(C)CNCCCC(=O)N 34a_100000739312_100011216630 [0,1,1,0,0,0|2,0,0]=4 4746 B12R0.277 CCCC(C)COCCCC(=O)C 34a_100000688023_100000685027 [0,1,1,0,0,0|2,0,0]=4 4747 B12R0.277 CCCC(C)COCCCC(=O)C 34a_100000759063_100011216630 [0,1,1,0,0,0|2,0,0]=4 4748 B12R0.277 CCCC(C)COCCCC(=O)C 7a_100000688023_100011215641 [0,1,1,0,0,0|2,0,0]=4 4749 B12R0.277 CCCC(C)COCCCC(=O)C 7a_100000759063_100011216630 [0,1,1,0,0,0|2,0,0]=4 4750 B12R0.277 CCCC(C)COCCCC(=O)N 34a_100000688023_100102525003 [0,1,1,0,0,0|2,0,0]=4 4751 B12R0.277 CCCC(C)COCCCC(=O)N 7a_100000688023_100102525003 [0,1,1,0,0,0|2,0,0]=4 4752 B12R0.277 CCCC(C)CSCCCC(=O)C 62a_100011215641_100011216630 [0,1,1,0,0,0|2,0,0]=4 4753 B12R0.277 CCCC(C)CSCCCC(=O)C 62a_100011216630_100011215641 [0,1,1,0,0,0|2,0,0]=4 4754 B12R0.277 CCCC(C)CSCCCC(=O)N 62a_100011216630_100102525003 [0,1,1,0,0,0|2,0,0]=4 4755 B12R0.277 CCCC(C)CSCCCC(=O)N 62a_100102525003_100011216630 [0,1,1,0,0,0|2,0,0]=4 4756 B12R0.277 CCCC(C)NCCCCC(=O)N 270004a_100000696515_100000211909 [0,1,1,0,0,0|2,0,0]=4 4757 B12R0.277 CCCC(C)NCCCCC(=O)N 34a_100000696515_100000766640 [0,1,1,0,0,0|2,0,0]=4 4758 B12R0.277 CCCC(C)NCCOCC(=O)O 269956a_100000700818_100000766640 [0,1,1,0,0,0|2,0,0]=4 4759 B12R0.277 CCCC(C)OCCCCC(=O)C 34a_100000764384_100009817362 [0,1,1,0,0,0|2,0,0]=4 4760 B12R0.277 CCCC(C)OCCCCC(=O)C 7a_100000764384_100000735457 [0,1,1,0,0,0|2,0,0]=4 4761 B12R0.277 CCCC(C)OCCCCC(=O)N 34a_100012022536_100000766640 [0,1,1,0,0,0|2,0,0]=4 4762 B12R0.277 CCCC(C)OCCCCC(=O)N 7a_100012022536_100000766640 [0,1,1,0,0,0|2,0,0]=4 4763 B12R0.277 CCCC(C)SCCCCC(=O)C 62a_100000735457_100000766640 [0,1,1,0,0,0|2,0,0]=4 4764 B12R0.277 CCCC(C)SCCCCC(=O)C 62a_100000766640_100000735457 [0,1,1,0,0,0|2,0,0]=4 4765 B12R0.277 CCCN(C)CCCCCC(=O)N 2230a_100000747261_100009817443 [0,1,1,0,0,0|2,0,0]=4 4766 B12R0.277 CCCN(C)CCCCCC(=O)N 269982a_100000747261_100009817443 [0,1,1,0,0,0|2,0,0]=4 4767 B12R0.277 CCC[C@H](N)CCOCCC(=O)N 34a_100015193777_100000731001 [0,1,1,0,0,0|2,0,0]=4 4768 B12R0.277 CCC[C@H](N)COCCCC(=O)C 34a_100000732646_100000685027 [0,1,1,0,0,0|2,0,0]=4 4769 B12R0.277 CCC[C@H](N)COCCCC(=O)N 34a_100000732646_100102525003 [0,1,1,0,0,0|2,0,0]=4 4770 B12R0.121 CCCCCCCC(CC)OCC 34a_200011217053_100000210202 [0,1,1,0,0,0|1,0,1]=4 4771 B12R0.121 CCCCCCCC(CC)OCC 7a_200011217053_100000210202 [0,1,1,0,0,0|1,0,1]=4 4772 B12R0.121 CCCCCCCC(CC)OCF 34a_200011217053_100015361967 [0,1,1,0,0,0|1,0,1]=4 4773 B12R0.121 CCCCCCCC(CC)OCF 7a_200011217053_100015361967 [0,1,1,0,0,0|1,0,1]=4 4774 B12R0.121 CCCCCCCN(CC)CC=O 2230a_100000228213_200015260668 [0,1,1,0,0,0|2,0,0]=4 4775 B12R0.121 CCCCCCCN(CC)CC=O 269982a_100000228213_200015260668 [0,1,1,0,0,0|2,0,0]=4 4776 B12R0.121 CCCCCNCC(CC)OCC 2230a_100015183923_100000210326 [0,1,1,0,0,0|1,0,1]=4 4777 B12R0.121 CCCCCNCC(CC)OCC 34a_100015183923_100000718602 [0,1,1,0,0,0|1,0,1]=4 4778 B12R0.205 CCCCCCC(CCC)OCC 34a_200011215193_100000210202 [0,1,1,0,0,0|1,0,1]=4 4779 B12R0.205 CCCCCCC(CCC)OCC 7a_200011215193_100000210202 [0,1,1,0,0,0|1,0,1]=4 4780 B12R0.205 CCCCCCC(CCC)OCF 34a_200011215193_100015361967 [0,1,1,0,0,0|1,0,1]=4 4781 B12R0.205 CCCCCCC(CCC)OCF 7a_200011215193_100015361967 [0,1,1,0,0,0|1,0,1]=4 4782 B12R1.35 CCCCCC(=O)[C@@H]1CCCO1 1458a_100000686382_100000210326 [1,1,0,0,0,0|0,0,2]=4 4783 B12R1.35 CCCCNC(C)C1CCCO1 2230a_100025754208_100000210211 [1,1,0,0,0,0|1,0,1]=4 4784 B12R1.35 CCCCNC(C)C1CCCO1 34a_100025754208_100000210210 [1,1,0,0,0,0|1,0,1]=4 4785 B12R1.37 CCCCCCNC1CC=CC1 2230a_100015188752_100000210314 [1,1,0,0,0,0|1,0,1]=4 4786 B12R1.37 CCCCCCNC1CCCC1 2230a_100000210581_100000179811 [1,1,0,0,0,0|1,0,1]=4 4787 B12R1.37 CCCCCCNC1CCCC1 2230a_100000211070_100000210314 [1,1,0,0,0,0|1,0,1]=4 4788 B12R1.37 CCCCCCNC1CCCC1 270004a_100000210581_100000210133 [1,1,0,0,0,0|1,0,1]=4 4789 B12R1.37 CCCCCCNC1CCCC1 34a_100000211070_100000210314 [1,1,0,0,0,0|1,0,1]=4 4790 B12R1.37 CCCCCCNC1CCOC1 2230a_100000210581_100000731011 [1,1,0,0,0,0|2,0,0]=4 4791 B12R1.37 CCCCCCNC1CCOC1 270004a_100000210581_100000752484 [1,1,0,0,0,0|2,0,0]=4 4792 B12R1.37 CCCCCCNC1CCSC1 270004a_100000210581_100000212027 [1,1,0,0,0,0|2,0,0]=4 4793 B12R1.37 CCCCCCN[C@@H]1CCOC1 2230a_200015188469_100000210314 [1,1,0,0,0,0|2,0,0]=4 4794 B12R1.37 CCCCCCN[C@H]1CCOC1 2230a_100015188467_100000210314 [1,1,0,0,0,0|2,0,0]=4 4795 B12R1.37 CCCCCCN[C@H]1CCOC1 34a_100015188467_100000210314 [1,1,0,0,0,0|2,0,0]=4 4796 B12R1.37 CCCCCCOC1CCCC1 34a_100000210259_100000179811 [1,1,0,0,0,0|1,0,1]=4 4797 B12R1.37 CCCCCCOC1CCCC1 34a_100000210269_100000210314 [1,1,0,0,0,0|1,0,1]=4 4798 B12R1.37 CCCCCCOC1CCCC1 7a_100000210259_100000179811 [1,1,0,0,0,0|1,0,1]=4 4799 B12R1.37 CCCCCCOC1CCCC1 7a_100000210269_100000210314 [1,1,0,0,0,0|1,0,1]=4 4800 B12R1.37 CCCCCCOC1CCCO1 34a_100000085407_100000210314 [1,1,0,0,0,0|0,0,1]=3 4801 B12R1.37 CCCCCCOC1CCOC1 34a_100000210259_100000690089 [1,1,0,0,0,0|2,0,0]=4 4802 B12R1.37 CCCCCCOC1CCOC1 7a_100000210259_100000731011 [1,1,0,0,0,0|2,0,0]=4 4803 B12R1.37 CCCCCCOC1CCSC1 7a_100011232664_100000210314 [1,1,0,0,0,0|2,0,0]=4 4804 B12R1.37 CCCCCCO[C@H]1CCOC1 34a_100000717292_100000210314 [1,1,0,0,0,0|2,0,0]=4 4805 B12R1.37 CCCCCCSC1CCCC1 62a_100000210314_100000179811 [1,1,0,0,0,0|1,0,1]=4 4806 B12R1.37 CCCCCCSC1CCCC1 62a_100011217020_100000210757 [1,1,0,0,0,0|1,0,1]=4 4807 B12R1.37 CCCCCCSC1CCOC1 62a_100000210314_100000690089 [1,1,0,0,0,0|2,0,0]=4 4808 B12R1.37 CCCCCNCC1CCCC1 2230a_100000209983_100000740388 [1,1,0,0,0,0|1,0,1]=4 4809 B12R1.37 CCCCCNCC1CCCC1 2230a_100000737975_100000210326 [1,1,0,0,0,0|1,0,1]=4 4810 B12R1.37 CCCCCNCC1CCCC1 269862a_100000209983_100000746403 [1,1,0,0,0,0|1,0,1]=4 4811 B12R1.37 CCCCCNCC1CCCC1 34a_100000737975_100000718602 [1,1,0,0,0,0|1,0,1]=4 4812 B12R1.37 CCCCCNCC1CCCO1 2230a_100000209983_100000203698 [1,1,0,0,0,0|0,0,1]=3 4813 B12R1.37 CCCCCNCC1CCOC1 2230a_100000209983_100000702531 [1,1,0,0,0,0|2,0,0]=4 4814 B12R1.37 CCCCCNCC1CCOC1 2230a_100000737293_100000210326 [1,1,0,0,0,0|2,0,0]=4 4815 B12R1.37 CCCCCNCC1CCOC1 34a_100000737293_100000718602 [1,1,0,0,0,0|2,0,0]=4 4816 B12R1.37 CCCCCNCC1OCCO1 2230a_100000036311_100000210326 [1,1,0,0,0,0|1,0,1]=4 4817 B12R1.37 CCCCCNCC1OCCO1 2230a_100000209983_100000755774 [1,1,0,0,0,0|1,0,1]=4 4818 B12R1.37 CCCCCNCC1OCCO1 34a_100000036311_100000718602 [1,1,0,0,0,0|1,0,1]=4 4819 B12R1.37 CCCCCNC[C@@H]1CCCO1 2230a_100020590478_100000210326 [1,1,0,0,0,0|0,0,1]=3 4820 B12R1.37 CCCCCNC[C@@H]1CCCO1 34a_100020590478_100000718602 [1,1,0,0,0,0|0,0,1]=3 4821 B12R1.37 CCCCCOCC1CC=CC1 34a_100000688395_100000718602 [1,1,0,0,0,0|1,0,1]=4 4822 B12R1.37 CCCCCOCC1CCCC1 34a_100000210253_100000740388 [1,1,0,0,0,0|1,0,1]=4 4823 B12R1.37 CCCCCOCC1CCCC1 34a_100000742336_100000718602 [1,1,0,0,0,0|1,0,1]=4 4824 B12R1.37 CCCCCOCC1CCCC1 7a_100000210253_100000740388 [1,1,0,0,0,0|1,0,1]=4 4825 B12R1.37 CCCCCOCC1CCCC1 7a_100000742336_100000210326 [1,1,0,0,0,0|1,0,1]=4 4826 B12R1.37 CCCCCOCC1CCCO1 34a_100000210270_100000718602 [1,1,0,0,0,0|0,0,1]=3 4827 B12R1.37 CCCCCOCC1CCCO1 7a_100000210253_100000203698 [1,1,0,0,0,0|0,0,1]=3 4828 B12R1.37 CCCCCOCC1CCCO1 7a_100000210270_100000210326 [1,1,0,0,0,0|0,0,1]=3 4829 B12R1.37 CCCCCOCC1CCNC1 34a_100000748654_100000718602 [1,1,0,0,0,0|2,0,0]=4 4830 B12R1.37 CCCCCOCC1CCOC1 34a_100000210253_100011261433 [1,1,0,0,0,0|2,0,0]=4 4831 B12R1.37 CCCCCOCC1CCOC1 34a_100000740260_100000718602 [1,1,0,0,0,0|2,0,0]=4 4832 B12R1.37 CCCCCOCC1CCOC1 7a_100000210253_100000702531 [1,1,0,0,0,0|2,0,0]=4 4833 B12R1.37 CCCCCOCC1COCO1 34a_100011216627_100000718602 [1,1,0,0,0,0|1,0,1]=4 4834 B12R1.37 CCCCCOCC1OCCO1 34a_100000087154_100000718602 [1,1,0,0,0,0|1,0,1]=4 4835 B12R1.37 CCCCCOCC1OCCO1 34a_100000210253_100000755774 [1,1,0,0,0,0|1,0,1]=4 4836 B12R1.37 CCCCCOCC1OCCO1 7a_100000210253_100000755774 [1,1,0,0,0,0|1,0,1]=4 4837 B12R1.37 CCCCCOC[C@H]1CCCN1 34a_100000745186_100000718602 [1,1,0,0,0,0|1,0,1]=4 4838 B12R1.37 CCCCCSCC1CCCC1 62a_100000210326_100000740388 [1,1,0,0,0,0|1,0,1]=4 4839 B12R1.37 CCCCCSCC1CCCC1 62a_100000740388_100000210326 [1,1,0,0,0,0|1,0,1]=4 4840 B12R1.37 CCCCCSCC1CCCO1 62a_100000203698_100000210326 [1,1,0,0,0,0|0,0,1]=3 4841 B12R1.37 CCCCCSCC1CCCO1 62a_100000210326_100000203698 [1,1,0,0,0,0|0,0,1]=3 4842 B12R1.37 CCCCCSCC1CCOC1 62a_100000210326_100000702531 [1,1,0,0,0,0|2,0,0]=4 4843 B12R1.37 CCCCCSCC1CCOC1 62a_100000702531_100000210326 [1,1,0,0,0,0|2,0,0]=4 4844 B12R1.37 CCCCCSCC1OCCO1 62a_100000210326_100000755774 [1,1,0,0,0,0|1,0,1]=4 4845 B12R1.37 CCCCCSCC1OCCO1 62a_100000755774_100000210326 [1,1,0,0,0,0|1,0,1]=4 4846 B12R1.37 CCCCNCCC1CCCC1 2230a_100000102301_100000760354 [1,1,0,0,0,0|1,0,1]=4 4847 B12R1.37 CCCCNCCC1CCCC1 2230a_100000739158_100000210211 [1,1,0,0,0,0|1,0,1]=4 4848 B12R1.37 CCCCNCCC1CCCC1 34a_100000739158_100000210210 [1,1,0,0,0,0|1,0,1]=4 4849 B12R1.37 CCCCNCCC1CCCC1 7a_106832991798_100000760354 [1,1,0,0,0,0|1,0,1]=4 4850 B12R1.37 CCCCNCCC1OCCO1 2230a_100000034215_100000210211 [1,1,0,0,0,0|1,0,1]=4 4851 B12R1.37 CCCCNCCC1OCCO1 2230a_100000102301_100000740749 [1,1,0,0,0,0|1,0,1]=4 4852 B12R1.37 CCCCNCCC1OCCO1 34a_100000034215_100000210210 [1,1,0,0,0,0|1,0,1]=4 4853 B12R1.37 CCCCNCCC1OCCO1 7a_106832991798_100000740749 [1,1,0,0,0,0|1,0,1]=4 4854 B12R1.37 CCCCOCCC1CCCC1 34a_100000210227_100000760354 [1,1,0,0,0,0|1,0,1]=4 4855 B12R1.37 CCCCOCCC1CCCC1 34a_100000749090_100000210210 [1,1,0,0,0,0|1,0,1]=4 4856 B12R1.37 CCCCOCCC1CCCC1 7a_100000210227_100000760354 [1,1,0,0,0,0|1,0,1]=4 4857 B12R1.37 CCCCOCCC1CCCC1 7a_100000749090_100000210211 [1,1,0,0,0,0|1,0,1]=4 4858 B12R1.37 CCCCOCCC1CCNC1 34a_100016987287_100000210210 [1,1,0,0,0,0|2,0,0]=4 4859 B12R1.37 CCCCOCCC1CCOC1 34a_100011879284_100000210210 [1,1,0,0,0,0|2,0,0]=4 4860 B12R1.37 CCCCOCCC1OCCO1 34a_100000210227_100000740749 [1,1,0,0,0,0|1,0,1]=4 4861 B12R1.37 CCCCOCCC1OCCO1 7a_100000210227_100000740749 [1,1,0,0,0,0|1,0,1]=4 4862 B12R1.37 CCCCOCOC1CCCO1 34a_100000085407_100011995733 [1,1,0,0,0,0|1,0,1]=4 4863 B12R1.37 CCCCSCCC1CCCC1 62a_100000210211_100000760354 [1,1,0,0,0,0|1,0,1]=4 4864 B12R1.37 CCCCSCCC1CCCC1 62a_100000760354_100000210210 [1,1,0,0,0,0|1,0,1]=4 4865 B12R1.37 CCCCSCCC1OCCO1 62a_100000210211_100000740749 [1,1,0,0,0,0|1,0,1]=4 4866 B12R1.37 CCCNCCCC1CCCC1 2230a_100000736752_100000210303 [1,1,0,0,0,0|1,0,1]=4 4867 B12R1.37 CCCNCCCC1CCCC1 34a_100000736752_100000210303 [1,1,0,0,0,0|1,0,1]=4 4868 B12R1.37 CCCOCCCC1CCCC1 34a_100000210258_100011713738 [1,1,0,0,0,0|1,0,1]=4 4869 B12R1.37 CCCOCCCC1CCCC1 34a_100011215328_100000210303 [1,1,0,0,0,0|1,0,1]=4 4870 B12R1.37 CCCOCCCC1CCCC1 7a_100011215328_100000210303 [1,1,0,0,0,0|1,0,1]=4 4871 B12R1.37 CCCOCCCC1OCCO1 34a_100000210258_100009861162 [1,1,0,0,0,0|1,0,1]=4 4872 B12R1.37 CCCOCCCC1OCCO1 34a_100009871617_100000210303 [1,1,0,0,0,0|1,0,1]=4 4873 B12R1.37 CCCOCCCC1OCCO1 7a_100009871617_100000210303 [1,1,0,0,0,0|1,0,1]=4 4874 B12R1.37 CCCOCCOC1CCCO1 34a_100000085407_100011215938 [1,1,0,0,0,0|1,0,1]=4 4875 B12R1.37 CCCSCCCC1CCCC1 62a_100000210303_100011713738 [1,1,0,0,0,0|1,0,1]=4 4876 B12R1.37 CCCSCCCC1CCCC1 62a_100011713738_100000210303 [1,1,0,0,0,0|1,0,1]=4 4877 B12R1.37 CCCSCCCC1OCCO1 62a_100000210303_100000042513 [1,1,0,0,0,0|1,0,1]=4 4878 B12R1.37 CCNCCCCC1OCCO1 2230a_100015525214_100000034956 [1,1,0,0,0,0|1,0,1]=4 4879 B12R1.37 CCOCCCCC1OCCO1 34a_100121572206_200009813554 [1,1,0,0,0,0|1,0,1]=4 4880 B12R1.37 CCOCCCOC1CCCO1 34a_100000085407_100012232248 [1,1,0,0,0,0|1,0,1]=4 4881 B12R1.37 CCOCCNCC1CCCO1 2230a_102516460346_100000203698 [1,1,0,0,0,0|1,0,1]=4 4882 B12R1.37 CCOCCNC[C@@H]1CCCO1 2230a_100020590478_100011215890 [1,1,0,0,0,0|1,0,1]=4 4883 B12R1.37 CCOCCNC[C@@H]1CCCO1 34a_100020590478_100000210147 [1,1,0,0,0,0|1,0,1]=4 4884 B12R1.37 CCOCCOCC1CCCO1 34a_100000210270_100000210147 [1,1,0,0,0,0|1,0,1]=4 4885 B12R1.37 CCOCCOCC1CCCO1 7a_100000210136_100000203698 [1,1,0,0,0,0|1,0,1]=4 4886 B12R1.37 CCOCCOCC1CCCO1 7a_100000210270_100011215890 [1,1,0,0,0,0|1,0,1]=4 4887 B12R1.37 CCOCCSCC1CCCO1 62a_100000203698_100011215890 [1,1,0,0,0,0|1,0,1]=4 4888 B12R1.37 CCOCCSCC1CCCO1 62a_100000210147_100000203698 [1,1,0,0,0,0|1,0,1]=4 4889 B12R1.37 CCSCCCCC1OCCO1 62a_100000210202_100000034956 [1,1,0,0,0,0|1,0,1]=4 4890 B12R1.37 CCSCCNCC1CCCO1 2230a_100000106463_100000203698 [1,1,0,0,0,0|1,0,1]=4 4891 B12R1.37 CCSCCNC[C@@H]1CCCO1 2230a_100020590478_100000757381 [1,1,0,0,0,0|1,0,1]=4 4892 B12R1.37 CCSCCNC[C@@H]1CCCO1 34a_100020590478_100000757381 [1,1,0,0,0,0|1,0,1]=4 4893 B12R1.37 CCSCCOCC1CCCO1 34a_100000210270_100000757381 [1,1,0,0,0,0|1,0,1]=4 4894 B12R1.37 CCSCCOCC1CCCO1 7a_100000210270_100000757381 [1,1,0,0,0,0|1,0,1]=4 4895 B12R1.37 CCSCCOCC1CCCO1 7a_100000212035_100000203698 [1,1,0,0,0,0|1,0,1]=4 4896 B12R1.37 CCSCCSCC1CCCO1 62a_100000203698_100000757381 [1,1,0,0,0,0|1,0,1]=4 4897 B12R1.37 CCSCCSCC1CCCO1 62a_100000757381_100000203698 [1,1,0,0,0,0|1,0,1]=4 4898 B12R1.37 COCCCCOC1CCCO1 34a_100000085407_100000755781 [1,1,0,0,0,0|1,0,1]=4 4899 B12R1.37 COCCCCOC1CCCO1 34a_100011018183_200000210301 [1,1,0,0,0,0|1,0,1]=4 4900 B12R1.37 COCCCCOC1CCCO1 7a_100011018183_200000210301 [1,1,0,0,0,0|1,0,1]=4 4901 B12R1.37 COCCCNC[C@@H]1CCCO1 2230a_100020590478_100000740836 [1,1,0,0,0,0|1,0,1]=4 4902 B12R1.37 COCCCNC[C@@H]1CCCO1 34a_100020590478_100000740836 [1,1,0,0,0,0|1,0,1]=4 4903 B12R1.37 COCCCOCC1CCCO1 34a_100000210270_100000740836 [1,1,0,0,0,0|1,0,1]=4 4904 B12R1.37 COCCCOCC1CCCO1 7a_100000210270_100000740836 [1,1,0,0,0,0|1,0,1]=4 4905 B12R1.37 COCCCSCC1CCCO1 62a_100000203698_100000709357 [1,1,0,0,0,0|1,0,1]=4 4906 B12R1.37 COCCCSCC1CCCO1 62a_100000709357_100000203698 [1,1,0,0,0,0|1,0,1]=4 4907 B12R1.37 CSCCCNCC1CCCO1 2230a_100000749238_100000203698 [1,1,0,0,0,0|1,0,1]=4 4908 B12R1.37 CSCCCOCC1CCCO1 7a_100000690336_100000203698 [1,1,0,0,0,0|1,0,1]=4 4909 B12R1.37 ClCCCCOCC1CCCO1 7a_100000210776_100000203698 [1,1,0,0,0,0|1,0,1]=4 4910 B12R1.37 FCCCCCOC1CCCO1 34a_100000085407_100000729378 [1,1,0,0,0,0|1,0,1]=4 4911 B12R1.37 FCCCCNC[C@@H]1CCCO1 2230a_100020590478_100000729493 [1,1,0,0,0,0|1,0,1]=4 4912 B12R1.37 FCCCCNC[C@@H]1CCCO1 34a_100020590478_100000729493 [1,1,0,0,0,0|1,0,1]=4 4913 B12R1.37 FCCCCOCC1CCCO1 34a_100000210270_100000729493 [1,1,0,0,0,0|1,0,1]=4 4914 B12R1.37 FCCCCOCC1CCCO1 7a_100000210270_100000729493 [1,1,0,0,0,0|1,0,1]=4 4915 B12R1.37 FCCCCOCC1CCCO1 7a_100011995726_100000203698 [1,1,0,0,0,0|1,0,1]=4 4916 B12R1.37 FCCCCSCC1CCCO1 62a_100000203698_100000729493 [1,1,0,0,0,0|1,0,1]=4 4917 B12R1.37 FCCCCSCC1CCCO1 62a_100000729493_100000203698 [1,1,0,0,0,0|1,0,1]=4 4918 B12R1.37 OCCCCCOC1CCCO1 34a_100000085407_100000746330 [1,1,0,0,0,0|1,0,1]=4 4919 B12R1.37 OCCCCNCC1CCCO1 2230a_100000750430_100000203698 [1,1,0,0,0,0|1,0,1]=4 4920 B12R1.37 OCCCCNC[C@@H]1CCCO1 2230a_100020590478_100000210776 [1,1,0,0,0,0|1,0,1]=4 4921 B12R1.37 OCCCCNC[C@@H]1CCCO1 34a_100020590478_100011216708 [1,1,0,0,0,0|1,0,1]=4 4922 B12R1.37 OCCCCOCC1CCCO1 34a_100000210270_100011216708 [1,1,0,0,0,0|1,0,1]=4 4923 B12R1.37 OCCCCOCC1CCCO1 7a_100000210270_100000210776 [1,1,0,0,0,0|1,0,1]=4 4924 B12R1.37 OCCCCSCC1CCCO1 62a_100000203698_100000210776 [1,1,0,0,0,0|1,0,1]=4 4925 B12R1.37 OCCCCSCC1CCCO1 62a_100000210776_100000203698 [1,1,0,0,0,0|1,0,1]=4 4926 B12R1.37 [13CH3]OCCCCOC1CCCO1 34a_100011018183_200025704644 [1,1,0,0,0,0|1,0,1]=4 4927 B12R1.37 [13CH3]OCCCCOC1CCCO1 7a_100011018183_200025704644 [1,1,0,0,0,0|1,0,1]=4 4928 B12R1.51 CCCC(=O)CCC1CCCO1 1458a_100011247709_100000210303 [1,1,0,0,0,0|0,0,2]=4 4929 B12R1.51 CCCC(C)COC1CCCO1 34a_100000085407_100011216630 [1,1,0,0,0,0|1,0,1]=4 4930 B12R1.51 CCCC(C)NCC1CCCO1 2230a_100000741246_100000203698 [1,1,0,0,0,0|1,0,1]=4 4931 B12R1.51 CCCC(C)NC[C@@H]1CCCO1 2230a_100020590478_100000766640 [1,1,0,0,0,0|1,0,1]=4 4932 B12R1.51 CCCC(C)NC[C@@H]1CCCO1 270004a_100020590478_100000211909 [1,1,0,0,0,0|1,0,1]=4 4933 B12R1.51 CCCC(C)NC[C@@H]1CCCO1 34a_100020590478_100000766640 [1,1,0,0,0,0|1,0,1]=4 4934 B12R1.51 CCCC(C)OCC1CCCO1 34a_100000210270_100000766640 [1,1,0,0,0,0|1,0,1]=4 4935 B12R1.51 CCCC(C)OCC1CCCO1 7a_100000210270_100000766640 [1,1,0,0,0,0|1,0,1]=4 4936 B12R1.51 CCCC(C)OCC1CCCO1 7a_100000764384_100000203698 [1,1,0,0,0,0|1,0,1]=4 4937 B12R1.51 CCCC(C)SCC1CCCO1 62a_100000203698_100000766640 [1,1,0,0,0,0|1,0,1]=4 4938 B12R1.51 CCCC(C)SCC1CCCO1 62a_100000766640_100000203698 [1,1,0,0,0,0|1,0,1]=4 4939 B12R1.53 CCCCC(=O)CC1C=CCC1 1458a_100000212241_100000210211 [1,1,0,0,0,0|1,0,1]=4 4940 B12R1.53 CCCCC(=O)CC1CCCO1 1458a_100000210183_100000203698 [1,1,0,0,0,0|0,0,2]=4 4941 B12R1.53 CCCCC(C)OC1CCCO1 34a_100000085407_200011215066 [1,1,0,0,0,0|1,0,1]=4 4942 B12R1.53 CCCCN(C)CC1CCCO1 2230a_100000207549_100000203698 [1,1,0,0,0,0|1,0,1]=4 4943 B12R1.53 CCCCN(C)CC1CCCO1 2230a_100102946541_100000210211 [1,1,0,0,0,0|1,0,1]=4 4944 B12R1.53 CCCCN(C)CC1CCCO1 269982a_100000207549_100000183445 [1,1,0,0,0,0|1,0,1]=4 4945 B12R1.53 CCCCN(C)CC1CCCO1 269982a_100102946541_100000210211 [1,1,0,0,0,0|1,0,1]=4 4946 B12R1.53 CCCCN(C)CC1CCCO1 34a_100102946541_100000210210 [1,1,0,0,0,0|1,0,1]=4 4947 B12R1.53 CCCNC(C)CC1C=CCC1 270004a_100020643023_100000116859 [1,1,0,0,0,0|2,0,0]=4 4948 B12R1.255 CC(C)CCCOC1CCCO1 34a_100000085407_100011214892 [1,1,0,0,0,0|1,0,1]=4 4949 B12R1.255 CC(C)CCNC[C@@H]1CCCO1 2230a_100020590478_100000210312 [1,1,0,0,0,0|1,0,1]=4 4950 B12R1.255 CC(C)CCNC[C@@H]1CCCO1 269862a_100020590478_100000185833 [1,1,0,0,0,0|1,0,1]=4 4951 B12R1.255 CC(C)CCNC[C@@H]1CCCO1 34a_100020590478_100000210312 [1,1,0,0,0,0|1,0,1]=4 4952 B12R1.255 CC(C)CCOCC1CCCO1 34a_100000210270_100000210312 [1,1,0,0,0,0|1,0,1]=4 4953 B12R1.255 CC(C)CCOCC1CCCO1 7a_100000210254_100000203698 [1,1,0,0,0,0|1,0,1]=4 4954 B12R1.255 CC(C)CCOCC1CCCO1 7a_100000210270_100000210626 [1,1,0,0,0,0|1,0,1]=4 4955 B12R1.255 CC(C)CCSCC1CCCO1 62a_100000203698_100000210312 [1,1,0,0,0,0|1,0,1]=4 4956 B12R1.255 CC(C)CCSCC1CCCO1 62a_100000210312_100000203698 [1,1,0,0,0,0|1,0,1]=4 4957 B12R1.255 CC(O)CCCOC1CCCO1 34a_100000085407_200000718107 [1,1,0,0,0,0|1,0,1]=4 4958 B12R1.255 CC(O)CCNCC1CCCO1 2230a_200000755665_100000203698 [1,1,0,0,0,0|1,0,1]=4 4959 B12R1.255 CC(O)CCNC[C@@H]1CCCO1 2230a_100020590478_100012276601 [1,1,0,0,0,0|1,0,1]=4 4960 B12R1.255 CC(O)CCNC[C@@H]1CCCO1 34a_100020590478_100012276601 [1,1,0,0,0,0|1,0,1]=4 4961 B12R1.255 CC(O)CCOCC1CCCO1 34a_100000210270_100012276601 [1,1,0,0,0,0|1,0,1]=4 4962 B12R1.255 CC(O)CCOCC1CCCO1 7a_100000210270_100012276601 [1,1,0,0,0,0|1,0,1]=4 4963 B12R1.255 CC(O)CCSCC1CCCO1 62a_100000203698_100012276601 [1,1,0,0,0,0|1,0,1]=4 4964 B12R1.255 CC(O)CCSCC1CCCO1 62a_100012276601_100000203698 [1,1,0,0,0,0|1,0,1]=4 4965 B12R1.477 CCC(C)CNCC1CCCO1 2230a_100020588543_100000203698 [1,1,0,0,0,0|1,0,1]=4 4966 B12R1.477 CCC(C)CNC[C@@H]1CCCO1 2230a_100020590478_100000748023 [1,1,0,0,0,0|1,0,1]=4 4967 B12R1.477 CCC(C)CNC[C@@H]1CCCO1 270004a_100020590478_100000243153 [1,1,0,0,0,0|1,0,1]=4 4968 B12R1.477 CCC(C)CNC[C@@H]1CCCO1 34a_100020590478_100000748023 [1,1,0,0,0,0|1,0,1]=4 4969 B12R1.477 CCC(C)COCC1CCCO1 34a_100000210270_100000748023 [1,1,0,0,0,0|1,0,1]=4 4970 B12R1.477 CCC(C)COCC1CCCO1 7a_100000210270_100000748023 [1,1,0,0,0,0|1,0,1]=4 4971 B12R1.477 CCC(C)CSCC1CCCO1 62a_100000203698_100000748023 [1,1,0,0,0,0|1,0,1]=4 4972 B12R1.477 CCC(C)CSCC1CCCO1 62a_100000748023_100000203698 [1,1,0,0,0,0|1,0,1]=4 4973 B12R1.477 CCC(O)CNCC1CCCO1 2230a_100011218483_100000203698 [1,1,0,0,0,0|1,0,1]=4 4974 B12R1.477 CCC(O)CNC[C@@H]1CCCO1 2230a_100020590478_100011218378 [1,1,0,0,0,0|1,0,1]=4 4975 B12R1.477 CCC(O)CNC[C@@H]1CCCO1 34a_100020590478_100011218378 [1,1,0,0,0,0|1,0,1]=4 4976 B12R1.477 CCC(O)COCC1CCCO1 34a_100000210270_100011218378 [1,1,0,0,0,0|1,0,1]=4 4977 B12R1.477 CCC(O)COCC1CCCO1 7a_100000210270_100011218378 [1,1,0,0,0,0|1,0,1]=4 4978 B12R1.477 CCC(O)CSCC1CCCO1 62a_100000203698_100011218378 [1,1,0,0,0,0|1,0,1]=4 4979 B12R1.477 CCC(O)CSCC1CCCO1 62a_100011218378_100000203698 [1,1,0,0,0,0|1,0,1]=4 4980 B12R1.477 CCN(C)CCCC1CCCO1 2230a_100011698863_100000210202 [1,1,0,0,0,0|1,0,1]=4 4981 B12R1.477 CCN(C)CCCC1CCCO1 269982a_100011698863_100000204670 [1,1,0,0,0,0|1,0,1]=4 4982 B12R1.477 CCN(C)CCCC1CCCO1 34a_100011698863_100000210202 [1,1,0,0,0,0|1,0,1]=4 4983 B12R1.477 CC[C@H](C)CNC[C@@H]1CCCO1 2230a_100020590478_100009816398 [1,1,0,0,0,0|1,0,1]=4 4984 B12R1.477 CC[C@H](C)CNC[C@@H]1CCCO1 34a_100020590478_100009816398 [1,1,0,0,0,0|1,0,1]=4 4985 B12R1.477 CC[C@H](C)COCC1CCCO1 34a_100000210270_100009816398 [1,1,0,0,0,0|1,0,1]=4 4986 B12R1.477 CC[C@H](C)COCC1CCCO1 7a_100000210270_100009816398 [1,1,0,0,0,0|1,0,1]=4 4987 B12R1.477 CC[C@H](C)COCC1CCCO1 7a_100009816381_100000203698 [1,1,0,0,0,0|1,0,1]=4 4988 B12R1.477 CC[C@H](C)CSCC1CCCO1 62a_100000203698_100009816398 [1,1,0,0,0,0|1,0,1]=4 4989 B12R1.477 CC[C@H](C)CSCC1CCCO1 62a_100009816398_100000203698 [1,1,0,0,0,0|1,0,1]=4 4990 B12R1.26 CCC(C)COC1CCC(=O)C1 34a_100012614533_100000748023 [1,1,0,0,0,0|2,0,0]=4 4991 B12R1.26 CCC(C)CSC1COC(=O)O1 62a_100000748023_100000032252 [1,1,0,0,0,0|2,0,0]=4 4992 B12R1.26 CCC(C)NCC1CNC(=O)O1 2230a_100000209981_100000181169 [1,1,0,0,0,0|2,0,0]=4 4993 B12R1.26 CCC(C)NC[C@@H]1CCC(=O)N1 2230a_100000209981_100015189358 [1,1,0,0,0,0|2,0,0]=4 4994 B12R1.26 CCC(C)NC[C@H]1CCC(=O)N1 2230a_100015423886_100000758301 [1,1,0,0,0,0|2,0,0]=4 4995 B12R1.26 CCC(C)NC[C@H]1CCC(=O)N1 34a_100015423886_100011215416 [1,1,0,0,0,0|2,0,0]=4 4996 B12R1.26 CCC(C)OCC1CCC(=O)N1 34a_100000737831_100011215416 [1,1,0,0,0,0|2,0,0]=4 4997 B12R1.26 CCC(C)OCC1CNC(=O)O1 34a_100011315639_100011215416 [1,1,0,0,0,0|2,0,0]=4 4998 B12R1.26 CCC(C)OCC1CNC(=O)O1 7a_100000210228_100000181169 [1,1,0,0,0,0|2,0,0]=4 4999 B12R1.26 CCC(C)OC[C@@H]1CCC(=O)N1 7a_100000210228_100015189358 [1,1,0,0,0,0|2,0,0]=4 5000 B12R1.26 CCC(C)SCC1CNC(=O)O1 62a_100000181169_100000758301 [1,1,0,0,0,0|2,0,0]=4 5001 B12R1.26 CCC(C)SCC1CNC(=O)O1 62a_100000758301_100000181169 [1,1,0,0,0,0|2,0,0]=4 5002 B12R1.26 CCC(C)SCC1COC(=O)O1 62a_100000073702_100000758301 [1,1,0,0,0,0|2,0,0]=4 5003 B12R1.26 CCC(C)SCC1COC(=O)O1 62a_100000758301_100000073702 [1,1,0,0,0,0|2,0,0]=4 5004 B12R1.26 CCC(C)SC[C@@H]1CCC(=O)N1 62a_100000758301_100015189358 [1,1,0,0,0,0|2,0,0]=4 5005 B12R1.26 CCC(C)SC[C@@H]1CCC(=O)N1 62a_100015189358_100000758301 [1,1,0,0,0,0|2,0,0]=4 5006 B12R1.26 CCC(O)COC1CCC(=O)C1 34a_100012614533_100011218378 [1,1,0,0,0,0|2,0,0]=4 5007 B12R1.26 CCC(O)CSC1COC(=O)O1 62a_100011218378_100000032252 [1,1,0,0,0,0|2,0,0]=4 5008 B12R1.26 CC[C@H](C)COC1CCC(=O)C1 34a_100012614533_100009816398 [1,1,0,0,0,0|2,0,0]=4 5009 B12R1.26 CC[C@H](C)CSC1COC(=O)O1 62a_100009816398_100000032252 [1,1,0,0,0,0|2,0,0]=4 5010 B12R1.29 CCCCC(=O)C1CCC(=O)N1 1458a_100000210400_100000210211 [1,1,0,0,0,0|1,0,1]=4 5011 B12R1.29 CCCCC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_100000210211 [1,1,0,0,0,0|0,0,1]=3 5012 B12R1.29 CCCNC(=O)[C@@H]1CCC(=O)O1 11a_100020643023_100009814974 [1,1,0,0,0,0|1,0,1]=4 5013 B12R1.29 CCCNC(=O)[C@@H]1CCC(=O)O1 1626a_100020643023_100009814974 [1,1,0,0,0,0|1,0,1]=4 5014 B12R1.29 CCCNC(=O)[C@@H]1CCC(=O)O1 240690a_100020643023_100009814974 [1,1,0,0,0,0|1,0,1]=4 5015 B12R1.29 CCCNC(=O)[C@@H]1CCC(=O)O1 527a_100020643023_100009814974 [1,1,0,0,0,0|1,0,1]=4 5016 B12R1.29 COCCC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_100000233755 [1,1,0,0,0,0|1,0,1]=4 5017 B12R1.29 CSCCC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_100000751147 [1,1,0,0,0,0|1,0,1]=4 5018 B12R1.29 O=C1CC[C@H](O1)C(=O)CCCF 1458a_100009814974_100011934791 [1,1,0,0,0,0|1,0,1]=4 5019 B12R1.29 O=C1CC[C@H](O1)C(=O)CCCO 1458a_100009814974_100011215043 [1,1,0,0,0,0|1,0,1]=4 5020 B12R1.31 CCCC(=O)CC1CCC(=O)N1 1458a_100000026770_100000210303 [1,1,0,0,0,0|1,0,1]=4 5021 B12R1.31 CCCC(=O)CC1CNC(=O)O1 1458a_100000211992_100000181169 [1,1,0,0,0,0|1,0,1]=4 5022 B12R1.31 CCCC(=O)CC1COC(=O)O1 1458a_100000211992_100000073702 [1,1,0,0,0,0|1,0,1]=4 5023 B12R1.31 CCCC(=O)C[C@@H]1CCC(=O)N1 1458a_100000211992_100015189358 [1,1,0,0,0,0|1,0,1]=4 5024 B12R1.31 CCCC(C)OC1CCC(=O)C1 34a_100012614533_100000766640 [1,1,0,0,0,0|2,0,0]=4 5025 B12R1.31 CCCC(C)OC1COC(=O)O1 34a_100000764384_100000032252 [1,1,0,0,0,0|2,0,0]=4 5026 B12R1.31 CCCC(C)SC1COC(=O)O1 62a_100000766640_100000032252 [1,1,0,0,0,0|2,0,0]=4 5027 B12R1.31 CCCN(C)CC1CNC(=O)O1 2230a_100000747261_100000181169 [1,1,0,0,0,0|2,0,0]=4 5028 B12R1.31 CCCN(C)CC1CNC(=O)O1 269982a_100000747261_100000181169 [1,1,0,0,0,0|2,0,0]=4 5029 B12R1.31 CCCN(C)CC1COC(=O)O1 269982a_100000747261_100000073702 [1,1,0,0,0,0|2,0,0]=4 5030 B12R1.31 CCCN(C)C[C@@H]1CCC(=O)N1 2230a_100000747261_100015189358 [1,1,0,0,0,0|2,0,0]=4 5031 B12R1.31 CCCN(C)C[C@@H]1CCC(=O)N1 269982a_100000747261_100015189358 [1,1,0,0,0,0|2,0,0]=4 5032 B12R1.105 CC(Br)CCOC1COC(=O)O1 34a_100009893172_100000032252 [1,1,0,0,0,0|2,0,0]=4 5033 B12R1.105 CC(Br)COCC1CNC(=O)O1 34a_100012180447_100000181169 [1,1,0,0,0,0|2,0,0]=4 5034 B12R1.105 CC(Br)COCC1COC(=O)O1 34a_100012180447_100000073702 [1,1,0,0,0,0|2,0,0]=4 5035 B12R1.105 CC(C)CCOC1CCC(=O)C1 34a_100012614533_100000210312 [1,1,0,0,0,0|2,0,0]=4 5036 B12R1.105 CC(C)CCOC1COC(=O)O1 34a_100000210254_100000032252 [1,1,0,0,0,0|2,0,0]=4 5037 B12R1.105 CC(C)CCSC1COC(=O)O1 62a_100000210312_100000032252 [1,1,0,0,0,0|2,0,0]=4 5038 B12R1.105 CC(C)CNCC1CNC(=O)O1 2230a_100000210953_100000181169 [1,1,0,0,0,0|2,0,0]=4 5039 B12R1.105 CC(C)CNCC1CNC(=O)O1 34a_100000210953_100000181169 [1,1,0,0,0,0|2,0,0]=4 5040 B12R1.105 CC(C)CNCC1COC(=O)O1 34a_100000210953_100000073702 [1,1,0,0,0,0|2,0,0]=4 5041 B12R1.105 CC(C)CNC[C@@H]1CCC(=O)N1 2230a_100000210953_100015189358 [1,1,0,0,0,0|2,0,0]=4 5042 B12R1.105 CC(C)CNC[C@H]1CCC(=O)N1 2230a_100015423886_100000210760 [1,1,0,0,0,0|2,0,0]=4 5043 B12R1.105 CC(C)CNC[C@H]1CCC(=O)N1 270004a_100015423886_100000210432 [1,1,0,0,0,0|2,0,0]=4 5044 B12R1.105 CC(C)CNC[C@H]1CCC(=O)N1 34a_100015423886_100000210624 [1,1,0,0,0,0|2,0,0]=4 5045 B12R1.105 CC(C)COCC1CCC(=O)N1 34a_100000737831_100000210624 [1,1,0,0,0,0|2,0,0]=4 5046 B12R1.105 CC(C)COCC1CNC(=O)O1 34a_100000210257_100000181169 [1,1,0,0,0,0|2,0,0]=4 5047 B12R1.105 CC(C)COCC1CNC(=O)O1 34a_100011315639_100000210624 [1,1,0,0,0,0|2,0,0]=4 5048 B12R1.105 CC(C)COCC1COC(=O)O1 34a_100000210257_100000073702 [1,1,0,0,0,0|2,0,0]=4 5049 B12R1.105 CC(C)CSCC1CNC(=O)O1 62a_100000181169_100000210760 [1,1,0,0,0,0|2,0,0]=4 5050 B12R1.105 CC(C)CSCC1CNC(=O)O1 62a_100000210624_100000181169 [1,1,0,0,0,0|2,0,0]=4 5051 B12R1.105 CC(C)CSCC1COC(=O)O1 62a_100000073702_100000210760 [1,1,0,0,0,0|2,0,0]=4 5052 B12R1.105 CC(C)CSCC1COC(=O)O1 62a_100000210624_100000073702 [1,1,0,0,0,0|2,0,0]=4 5053 B12R1.105 CC(C)CSC[C@@H]1CCC(=O)N1 62a_100000210624_100015189358 [1,1,0,0,0,0|2,0,0]=4 5054 B12R1.105 CC(C)CSC[C@@H]1CCC(=O)N1 62a_100015189358_100000210760 [1,1,0,0,0,0|2,0,0]=4 5055 B12R1.105 CC(F)COCC1CNC(=O)O1 34a_100015925927_100000181169 [1,1,0,0,0,0|2,0,0]=4 5056 B12R1.105 CC(F)COCC1COC(=O)O1 34a_100015925927_100000073702 [1,1,0,0,0,0|2,0,0]=4 5057 B12R1.105 CC(O)CCOC1CCC(=O)C1 34a_100012614533_100012276601 [1,1,0,0,0,0|2,0,0]=4 5058 B12R1.105 CC(O)CCSC1COC(=O)O1 62a_100012276601_100000032252 [1,1,0,0,0,0|2,0,0]=4 5059 B12R1.105 CC(O)CNCC1CNC(=O)O1 2230a_100000210904_100000181169 [1,1,0,0,0,0|2,0,0]=4 5060 B12R1.105 CC(O)CNCC1CNC(=O)O1 34a_100000210904_100000181169 [1,1,0,0,0,0|2,0,0]=4 5061 B12R1.105 CC(O)CNCC1COC(=O)O1 34a_100000210904_100000073702 [1,1,0,0,0,0|2,0,0]=4 5062 B12R1.105 CC(O)CNC[C@@H]1CCC(=O)N1 2230a_100000210904_100015189358 [1,1,0,0,0,0|2,0,0]=4 5063 B12R1.105 CC(O)CNC[C@H]1CCC(=O)N1 2230a_100015423886_100011218427 [1,1,0,0,0,0|2,0,0]=4 5064 B12R1.105 CC(O)CNC[C@H]1CCC(=O)N1 34a_100015423886_100011218427 [1,1,0,0,0,0|2,0,0]=4 5065 B12R1.105 CC(O)COCC1CCC(=O)N1 34a_100000737831_100011218427 [1,1,0,0,0,0|2,0,0]=4 5066 B12R1.105 CC(O)COCC1CNC(=O)O1 34a_100011315639_100011218427 [1,1,0,0,0,0|2,0,0]=4 5067 B12R1.105 CC(O)CSCC1CNC(=O)O1 62a_100000181169_100011218427 [1,1,0,0,0,0|2,0,0]=4 5068 B12R1.105 CC(O)CSCC1CNC(=O)O1 62a_100011218427_100000181169 [1,1,0,0,0,0|2,0,0]=4 5069 B12R1.105 CC(O)CSCC1COC(=O)O1 62a_100000073702_100011218427 [1,1,0,0,0,0|2,0,0]=4 5070 B12R1.105 CC(O)CSCC1COC(=O)O1 62a_100011218427_100000073702 [1,1,0,0,0,0|2,0,0]=4 5071 B12R1.105 CC(O)CSC[C@@H]1CCC(=O)N1 62a_100011218427_100015189358 [1,1,0,0,0,0|2,0,0]=4 5072 B12R1.105 CC(O)CSC[C@@H]1CCC(=O)N1 62a_100015189358_100011218427 [1,1,0,0,0,0|2,0,0]=4 5073 B12R1.105 C[C@@H](Cl)COCC1CNC(=O)O1 34a_100016084084_100000181169 [1,1,0,0,0,0|2,0,0]=4 5074 B12R1.105 C[C@@H](Cl)COCC1COC(=O)O1 34a_100016084084_100000073702 [1,1,0,0,0,0|2,0,0]=4 5075 B12R1.105 C[C@@H](N)CCOC1COC(=O)O1 34a_100000706166_100000032252 [1,1,0,0,0,0|2,0,0]=4 5076 B12R1.105 C[C@@H](N)COCC1CNC(=O)O1 34a_100000737577_100000181169 [1,1,0,0,0,0|2,0,0]=4 5077 B12R1.105 C[C@@H](N)COCC1COC(=O)O1 34a_100000737577_100000073702 [1,1,0,0,0,0|2,0,0]=4 5078 B12R1.105 C[C@@H](O)CNC[C@H]1CCC(=O)N1 2230a_100015423886_100009817552 [1,1,0,0,0,0|2,0,0]=4 5079 B12R1.105 C[C@@H](O)CNC[C@H]1CCC(=O)N1 34a_100015423886_100009817552 [1,1,0,0,0,0|2,0,0]=4 5080 B12R1.105 C[C@@H](O)COCC1CCC(=O)N1 34a_100000737831_100009817552 [1,1,0,0,0,0|2,0,0]=4 5081 B12R1.105 C[C@@H](O)COCC1CNC(=O)O1 34a_100011315639_100009817552 [1,1,0,0,0,0|2,0,0]=4 5082 B12R1.105 C[C@@H](O)CSCC1CNC(=O)O1 62a_100000181169_100009817552 [1,1,0,0,0,0|2,0,0]=4 5083 B12R1.105 C[C@@H](O)CSCC1CNC(=O)O1 62a_100009817552_100000181169 [1,1,0,0,0,0|2,0,0]=4 5084 B12R1.105 C[C@@H](O)CSCC1COC(=O)O1 62a_100000073702_100009817552 [1,1,0,0,0,0|2,0,0]=4 5085 B12R1.105 C[C@@H](O)CSCC1COC(=O)O1 62a_100009817552_100000073702 [1,1,0,0,0,0|2,0,0]=4 5086 B12R1.105 C[C@@H](O)CSC[C@@H]1CCC(=O)N1 62a_100009817552_100015189358 [1,1,0,0,0,0|2,0,0]=4 5087 B12R1.105 C[C@@H](O)CSC[C@@H]1CCC(=O)N1 62a_100015189358_100009817552 [1,1,0,0,0,0|2,0,0]=4 5088 B12R1.62 C=C1CC(C1)CNCCCCC 2230a_100102567296_100000210326 [0,1,0,0,1,0|2,0,0]=4 5089 B12R1.62 C=C1CC(C1)CNCCCCC 34a_100102567296_100000718602 [0,1,0,0,1,0|2,0,0]=4 5090 B12R1.62 C=C1CC(C1)COCCCCC 34a_100011011225_100000718602 [0,1,0,0,1,0|2,0,0]=4 5091 B12R1.62 C=C1CC(C1)NCCCCCC 2230a_100132301982_100000210314 [0,1,0,0,1,0|2,0,0]=4 5092 B12R1.62 CCCCCCSC1CC(=O)C1 62a_100009894365_100000210757 [0,1,0,0,1,0|1,0,0]=3 5093 B12R1.62 CCCCCNCC1CC(=O)C1 2230a_100000209983_100009874392 [0,1,0,0,1,0|1,0,0]=3 5094 B12R1.62 CCCCCOCC1CC(=O)C1 34a_100000101936_100000718602 [0,1,0,0,1,0|1,0,0]=3 5095 B12R1.62 CCCCCOCC1CC(=O)C1 7a_100000210253_100009874392 [0,1,0,0,1,0|1,0,0]=3 5096 B12R1.62 CCCCCSCC1CC(=O)C1 62a_100000210326_100009874392 [0,1,0,0,1,0|1,0,0]=3 5097 B12R1.62 CCCCCSCC1CC(=O)C1 62a_100009874392_100000210326 [0,1,0,0,1,0|1,0,0]=3 5098 B12R1.62 CCCCOCSC1CC(=O)C1 62a_100009894365_100011995733 [0,1,0,0,1,0|2,0,0]=4 5099 B12R1.62 CCCOCCSC1CC(=O)C1 62a_100009894365_100011215938 [0,1,0,0,1,0|2,0,0]=4 5100 B12R1.62 CCOCCCSC1CC(=O)C1 62a_100009894365_100012232248 [0,1,0,0,1,0|2,0,0]=4 5101 B12R1.62 CCOCCNCC1CC(=O)C1 2230a_102516460346_100009874392 [0,1,0,0,1,0|2,0,0]=4 5102 B12R1.62 CCOCCOCC1CC(=O)C1 34a_100000101936_100000210147 [0,1,0,0,1,0|2,0,0]=4 5103 B12R1.62 CCOCCOCC1CC(=O)C1 7a_100000210136_100009874392 [0,1,0,0,1,0|2,0,0]=4 5104 B12R1.62 CCOCCSCC1CC(=O)C1 62a_100000210147_100009874392 [0,1,0,0,1,0|2,0,0]=4 5105 B12R1.62 CCOCCSCC1CC(=O)C1 62a_100009874392_100011215890 [0,1,0,0,1,0|2,0,0]=4 5106 B12R1.62 CCSCCNCC1CC(=O)C1 2230a_100000106463_100009874392 [0,1,0,0,1,0|2,0,0]=4 5107 B12R1.62 CCSCCOCC1CC(=O)C1 34a_100000101936_100000757381 [0,1,0,0,1,0|2,0,0]=4 5108 B12R1.62 CCSCCOCC1CC(=O)C1 7a_100000212035_100009874392 [0,1,0,0,1,0|2,0,0]=4 5109 B12R1.62 CCSCCSCC1CC(=O)C1 62a_100000757381_100009874392 [0,1,0,0,1,0|2,0,0]=4 5110 B12R1.62 CCSCCSCC1CC(=O)C1 62a_100009874392_100000757381 [0,1,0,0,1,0|2,0,0]=4 5111 B12R1.62 COCCCCSC1CC(=O)C1 62a_100009894365_100000730899 [0,1,0,0,1,0|2,0,0]=4 5112 B12R1.62 COCCCOCC1CC(=O)C1 34a_100000101936_100000740836 [0,1,0,0,1,0|2,0,0]=4 5113 B12R1.62 COCCCSCC1CC(=O)C1 62a_100000709357_100009874392 [0,1,0,0,1,0|2,0,0]=4 5114 B12R1.62 COCCCSCC1CC(=O)C1 62a_100009874392_100000709357 [0,1,0,0,1,0|2,0,0]=4 5115 B12R1.62 CSCCCNCC1CC(=O)C1 2230a_100000749238_100009874392 [0,1,0,0,1,0|2,0,0]=4 5116 B12R1.62 CSCCCOCC1CC(=O)C1 7a_100000690336_100009874392 [0,1,0,0,1,0|2,0,0]=4 5117 B12R1.62 O=C1CC(C1)CNCCCCO 2230a_100000750430_100009874392 [0,1,0,0,1,0|2,0,0]=4 5118 B12R1.62 O=C1CC(C1)COCCCCCl 7a_100000210776_100009874392 [0,1,0,0,1,0|2,0,0]=4 5119 B12R1.62 O=C1CC(C1)COCCCCF 34a_100000101936_100000729493 [0,1,0,0,1,0|2,0,0]=4 5120 B12R1.62 O=C1CC(C1)COCCCCF 7a_100011995726_100009874392 [0,1,0,0,1,0|2,0,0]=4 5121 B12R1.62 O=C1CC(C1)COCCCCO 34a_100000101936_100011216708 [0,1,0,0,1,0|2,0,0]=4 5122 B12R1.62 O=C1CC(C1)CSCCCCF 62a_100000729493_100009874392 [0,1,0,0,1,0|2,0,0]=4 5123 B12R1.62 O=C1CC(C1)CSCCCCF 62a_100009874392_100000729493 [0,1,0,0,1,0|2,0,0]=4 5124 B12R1.62 O=C1CC(C1)CSCCCCO 62a_100000210776_100009874392 [0,1,0,0,1,0|2,0,0]=4 5125 B12R1.62 O=C1CC(C1)CSCCCCO 62a_100009874392_100000210776 [0,1,0,0,1,0|2,0,0]=4 5126 B12R1.62 O=C1CC(C1)SCCCCCF 62a_100009894365_100000729378 [0,1,0,0,1,0|2,0,0]=4 5127 B12R1.62 O=C1CC(C1)SCCCCCO 62a_100009894365_100000746330 [0,1,0,0,1,0|2,0,0]=4 5128 B12R1.220 CC(C)CCCSC1CC(=O)C1 62a_100009894365_100011214892 [0,1,0,0,1,0|2,0,0]=4 5129 B12R1.220 CC(C)CCOCC1CC(=O)C1 34a_100000101936_100000210312 [0,1,0,0,1,0|2,0,0]=4 5130 B12R1.220 CC(C)CCOCC1CC(=O)C1 7a_100000210254_100009874392 [0,1,0,0,1,0|2,0,0]=4 5131 B12R1.220 CC(C)CCSCC1CC(=O)C1 62a_100000210312_100009874392 [0,1,0,0,1,0|2,0,0]=4 5132 B12R1.220 CC(C)CCSCC1CC(=O)C1 62a_100009874392_100000210312 [0,1,0,0,1,0|2,0,0]=4 5133 B12R1.220 CC(O)CCCSC1CC(=O)C1 62a_100009894365_200000718107 [0,1,0,0,1,0|2,0,0]=4 5134 B12R1.220 CC(O)CCNCC1CC(=O)C1 2230a_200000755665_100009874392 [0,1,0,0,1,0|2,0,0]=4 5135 B12R1.220 CC(O)CCOCC1CC(=O)C1 34a_100000101936_100012276601 [0,1,0,0,1,0|2,0,0]=4 5136 B12R1.220 CC(O)CCSCC1CC(=O)C1 62a_100009874392_100012276601 [0,1,0,0,1,0|2,0,0]=4 5137 B12R1.220 CC(O)CCSCC1CC(=O)C1 62a_100012276601_100009874392 [0,1,0,0,1,0|2,0,0]=4 5138 B12R1.394 CCC(C)CNCC1CC(=O)C1 2230a_100020588543_100009874392 [0,1,0,0,1,0|2,0,0]=4 5139 B12R1.394 CCC(C)COCC1CC(=O)C1 34a_100000101936_100000748023 [0,1,0,0,1,0|2,0,0]=4 5140 B12R1.394 CCC(C)CSCC1CC(=O)C1 62a_100000748023_100009874392 [0,1,0,0,1,0|2,0,0]=4 5141 B12R1.394 CCC(C)CSCC1CC(=O)C1 62a_100009874392_100000748023 [0,1,0,0,1,0|2,0,0]=4 5142 B12R1.394 CCC(O)CNCC1CC(=O)C1 2230a_100011218483_100009874392 [0,1,0,0,1,0|2,0,0]=4 5143 B12R1.394 CCC(O)COCC1CC(=O)C1 34a_100000101936_100011218378 [0,1,0,0,1,0|2,0,0]=4 5144 B12R1.394 CCC(O)CSCC1CC(=O)C1 62a_100009874392_100011218378 [0,1,0,0,1,0|2,0,0]=4 5145 B12R1.394 CCC(O)CSCC1CC(=O)C1 62a_100011218378_100009874392 [0,1,0,0,1,0|2,0,0]=4 5146 B12R1.394 CC[C@H](C)COCC1CC(=O)C1 34a_100000101936_100009816398 [0,1,0,0,1,0|2,0,0]=4 5147 B12R1.394 CC[C@H](C)COCC1CC(=O)C1 7a_100009816381_100009874392 [0,1,0,0,1,0|2,0,0]=4 5148 B12R1.394 CC[C@H](C)CSCC1CC(=O)C1 62a_100009816398_100009874392 [0,1,0,0,1,0|2,0,0]=4 5149 B12R1.394 CC[C@H](C)CSCC1CC(=O)C1 62a_100009874392_100009816398 [0,1,0,0,1,0|2,0,0]=4 5150 B12R1.462 CCCCC(=O)CC1CC(=O)C1 1458a_100000210183_100009874392 [0,1,0,0,1,0|1,0,1]=4 5151 B12R1.462 CCCCC(C)SC1CC(=O)C1 62a_100009894365_200011215066 [0,1,0,0,1,0|2,0,0]=4 5152 B12R1.462 CCCCN(C)CC1CC(=O)C1 2230a_100000207549_100009874392 [0,1,0,0,1,0|2,0,0]=4 5153 B12R1.462 CCCCN(C)CC1CC(=O)C1 269982a_100000207549_100009874392 [0,1,0,0,1,0|2,0,0]=4 5154 B12R1.467 CCCC(C)CSC1CC(=O)C1 62a_100009894365_100011216630 [0,1,0,0,1,0|2,0,0]=4 5155 B12R1.467 CCCC(C)NCC1CC(=O)C1 2230a_100000741246_100009874392 [0,1,0,0,1,0|2,0,0]=4 5156 B12R1.467 CCCC(C)OCC1CC(=O)C1 34a_100000101936_100000766640 [0,1,0,0,1,0|2,0,0]=4 5157 B12R1.467 CCCC(C)OCC1CC(=O)C1 7a_100000764384_100009874392 [0,1,0,0,1,0|2,0,0]=4 5158 B12R1.467 CCCC(C)SCC1CC(=O)C1 62a_100000766640_100009874392 [0,1,0,0,1,0|2,0,0]=4 5159 B12R1.467 CCCC(C)SCC1CC(=O)C1 62a_100009874392_100000766640 [0,1,0,0,1,0|2,0,0]=4 5160 B12R1.486 CCCCCC(=O)[C@@H]1CC(=O)N1 1458a_100016090685_100000210326 [0,1,0,0,1,0|1,0,1]=4 5161 B12R1.486 CCCCCN(C)C1CC(=O)C1 269982a_100000223495_100009894365 [0,1,0,0,1,0|2,0,0]=4 5162 B12R1.229 C=C(C)CSCCC1CCC1=O 62a_100000748629_200016118888 [0,1,0,0,1,0|1,0,1]=4 5163 B12R1.229 C=C(C)CSCCC1CCC1=O 62a_200016118888_100000211660 [0,1,0,0,1,0|1,0,1]=4 5164 B12R1.229 CC(=O)CCCOC1CCC1=O 34a_100000759063_100009892977 [0,1,0,0,1,0|1,0,1]=4 5165 B12R1.229 CC(=O)CCCOC1CCC1=O 7a_100000759063_100009892977 [0,1,0,0,1,0|1,0,1]=4 5166 B12R1.229 CC(=O)CCCSC1CCC1=O 62a_100009892977_100011215641 [0,1,0,0,1,0|1,0,1]=4 5167 B12R1.229 CC(=O)CCCSC1CCC1=O 62a_100011215641_100009892977 [0,1,0,0,1,0|1,0,1]=4 5168 B12R1.229 CC(C)CCCNC1CCC1=O 34a_200000737386_100009892977 [0,1,0,0,1,0|1,0,0]=3 5169 B12R1.229 CC(C)CCCOC1CCC1=O 34a_100000210774_100009892977 [0,1,0,0,1,0|1,0,0]=3 5170 B12R1.229 CC(C)CCCOC1CCC1=O 7a_100000210774_100009892977 [0,1,0,0,1,0|1,0,0]=3 5171 B12R1.229 CC(C)CCCSC1CCC1=O 62a_100009892977_100011214892 [0,1,0,0,1,0|1,0,0]=3 5172 B12R1.229 CC(C)CCCSC1CCC1=O 62a_100011214892_100009892977 [0,1,0,0,1,0|1,0,0]=3 5173 B12R1.229 CC(C)CNCCC1CCC1=O 2230a_100000210953_200016118888 [0,1,0,0,1,0|1,0,0]=3 5174 B12R1.229 CC(C)CSCCC1CCC1=O 62a_100000210624_200016118888 [0,1,0,0,1,0|1,0,0]=3 5175 B12R1.229 CC(C)CSCCC1CCC1=O 62a_200016118888_100000210760 [0,1,0,0,1,0|1,0,0]=3 5176 B12R1.229 CC(C)NCCOC1CCC1=O 34a_100000224655_100009892977 [0,1,0,0,1,0|2,0,0]=4 5177 B12R1.229 CC(C)OCCNC1CCC1=O 34a_100000701111_100009892977 [0,1,0,0,1,0|2,0,0]=4 5178 B12R1.229 CC(C)OCCOC1CCC1=O 34a_100000211219_100009892977 [0,1,0,0,1,0|2,0,0]=4 5179 B12R1.229 CC(C)OCCOC1CCC1=O 7a_100000211219_100009892977 [0,1,0,0,1,0|2,0,0]=4 5180 B12R1.229 CC(C)OCCSC1CCC1=O 62a_100000211751_100009892977 [0,1,0,0,1,0|2,0,0]=4 5181 B12R1.229 CC(C)OCCSC1CCC1=O 62a_100009892977_100000211751 [0,1,0,0,1,0|2,0,0]=4 5182 B12R1.229 CC(C)SCCNC1CCC1=O 34a_100000731138_100009892977 [0,1,0,0,1,0|2,0,0]=4 5183 B12R1.229 CC(C)SCCOC1CCC1=O 34a_200011212901_100009892977 [0,1,0,0,1,0|2,0,0]=4 5184 B12R1.229 CC(C)SCCOC1CCC1=O 7a_200011212901_100009892977 [0,1,0,0,1,0|2,0,0]=4 5185 B12R1.229 CC(C)SCCSC1CCC1=O 62a_100000730970_100009892977 [0,1,0,0,1,0|2,0,0]=4 5186 B12R1.229 CC(C)SCCSC1CCC1=O 62a_100009892977_100000730970 [0,1,0,0,1,0|2,0,0]=4 5187 B12R1.229 CC(O)CCCSC1CCC1=O 62a_100009892977_200000718107 [0,1,0,0,1,0|1,0,0]=3 5188 B12R1.229 CC(O)CCCSC1CCC1=O 62a_200000718107_100009892977 [0,1,0,0,1,0|1,0,0]=3 5189 B12R1.229 CC(O)CNCCC1CCC1=O 2230a_100000210904_200016118888 [0,1,0,0,1,0|1,0,0]=3 5190 B12R1.229 CC(O)CSCCC1CCC1=O 62a_100011218427_200016118888 [0,1,0,0,1,0|1,0,0]=3 5191 B12R1.229 CC(O)CSCCC1CCC1=O 62a_200016118888_100011218427 [0,1,0,0,1,0|1,0,0]=3 5192 B12R1.229 CN(C)CCCSC1CCC1=O 62a_100009892977_100000757444 [0,1,0,0,1,0|2,0,0]=4 5193 B12R1.229 C[C@@H](O)CSCCC1CCC1=O 62a_100009817552_200016118888 [0,1,0,0,1,0|1,0,0]=3 5194 B12R1.229 C[C@@H](O)CSCCC1CCC1=O 62a_200016118888_100009817552 [0,1,0,0,1,0|1,0,0]=3 5195 B12R1.229 O=C1CCC1CCSCC(F)F 62a_100011934356_200016118888 [0,1,0,0,1,0|2,0,0]=4 5196 B12R1.229 O=C1CCC1CCSCC(F)F 62a_200016118888_100011934356 [0,1,0,0,1,0|2,0,0]=4 5197 B12R1.311 CC(CCN)COC1CCC1=O 34a_106354213184_100009892977 [0,1,0,0,1,0|2,0,0]=4 5198 B12R1.311 CCCC(=O)CCC1CCC1=O 1458a_100000211992_200016118888 [0,1,0,0,1,0|0,0,1]=3 5199 B12R1.311 CCCC(=O)CSC1CCC1=O 62a_100000747444_100009892977 [0,1,0,0,1,0|1,0,1]=4 5200 B12R1.311 CCCC(=O)CSC1CCC1=O 62a_100009892977_100000747444 [0,1,0,0,1,0|1,0,1]=4 5201 B12R1.311 CCCC(C)COC1CCC1=O 34a_100000688023_100009892977 [0,1,0,0,1,0|1,0,0]=3 5202 B12R1.311 CCCC(C)COC1CCC1=O 7a_100000688023_100009892977 [0,1,0,0,1,0|1,0,0]=3 5203 B12R1.311 CCCC(C)CSC1CCC1=O 62a_100009892977_100011216630 [0,1,0,0,1,0|1,0,0]=3 5204 B12R1.311 CCCC(C)CSC1CCC1=O 62a_100011216630_100009892977 [0,1,0,0,1,0|1,0,0]=3 5205 B12R1.311 CCCN(C)CCC1CCC1=O 2230a_100000747261_200016118888 [0,1,0,0,1,0|1,0,0]=3 5206 B12R1.311 CCCN(C)CCC1CCC1=O 269982a_100000747261_200016118888 [0,1,0,0,1,0|1,0,0]=3 5207 B12R1.311 CCC[C@H](N)COC1CCC1=O 34a_100000732646_100009892977 [0,1,0,0,1,0|1,0,0]=3 5208 B12R1.311 CN(CCO)CCC1CCC1=O 2230a_100000210263_200016118888 [0,1,0,0,1,0|2,0,0]=4 5209 B12R1.311 CN(CCO)CCC1CCC1=O 269982a_100000210263_200016118888 [0,1,0,0,1,0|2,0,0]=4 5210 B12R1.311 COCC(=O)CCC1CCC1=O 1458a_100000210968_200016118888 [0,1,0,0,1,0|1,0,1]=4 5211 B12R1.311 COCC(N)COC1CCC1=O 34a_100000724102_100009892977 [0,1,0,0,1,0|2,0,0]=4 5212 B12R1.311 COCC(O)CNC1CCC1=O 34a_100000756049_100009892977 [0,1,0,0,1,0|2,0,0]=4 5213 B12R1.311 COCC(O)CSC1CCC1=O 62a_100009892977_100011215053 [0,1,0,0,1,0|2,0,0]=4 5214 B12R1.311 COCC(O)CSC1CCC1=O 62a_100011215053_100009892977 [0,1,0,0,1,0|2,0,0]=4 5215 B12R1.311 CSCC(=O)CCC1CCC1=O 1458a_100000184570_200016118888 [0,1,0,0,1,0|1,0,1]=4 5216 B12R1.311 O=C(CCO)CCC1CCC1=O 1458a_100011216618_200016118888 [0,1,0,0,1,0|1,0,1]=4 5217 B12R1.364 CC(CF)OCCC1CCC1=O 7a_100016041109_200016118888 [0,1,0,0,1,0|2,0,0]=4 5218 B12R1.364 CC(CO)CCNC1CCC1=O 34a_106354213184_100009892977 [0,1,0,0,1,0|2,0,0]=4 5219 B12R1.364 CC(CO)SCCC1CCC1=O 62a_100012180447_200016118888 [0,1,0,0,1,0|2,0,0]=4 5220 B12R1.364 CCC(C)CCOC1CCC1=O 7a_100011215188_100009892977 [0,1,0,0,1,0|1,0,0]=3 5221 B12R1.364 CCC(C)NCCC1CCC1=O 2230a_100000209981_200016118888 [0,1,0,0,1,0|1,0,0]=3 5222 B12R1.364 CCC(C)OCCC1CCC1=O 7a_100000210228_200016118888 [0,1,0,0,1,0|1,0,0]=3 5223 B12R1.364 CCC(C)SCCC1CCC1=O 62a_100000758301_200016118888 [0,1,0,0,1,0|1,0,0]=3 5224 B12R1.364 CCC(C)SCCC1CCC1=O 62a_200016118888_100000758301 [0,1,0,0,1,0|1,0,0]=3 5225 B12R1.364 COC(C)CCOC1CCC1=O 7a_100000764861_100009892977 [0,1,0,0,1,0|2,0,0]=4 5226 B12R1.364 COC(C)SCCC1CCC1=O 62a_100009879195_200016118888 [0,1,0,0,1,0|2,0,0]=4 5227 B12R1.364 COC(C)SCCC1CCC1=O 62a_200016118888_100009879195 [0,1,0,0,1,0|2,0,0]=4 5228 B12R1.364 C[C@H](CO)NCCC1CCC1=O 2230a_100000737577_200016118888 [0,1,0,0,1,0|2,0,0]=4 5229 B12R1.364 C[C@H](CO)SCCC1CCC1=O 62a_100016084084_200016118888 [0,1,0,0,1,0|2,0,0]=4 5230 B12R1.364 C[C@H](CO)SCCC1CCC1=O 62a_200016118888_100016084084 [0,1,0,0,1,0|2,0,0]=4 5231 B12R1.383 C#CCCCCNC1CCC1=O 34a_100000706060_100009892977 [0,1,0,0,1,0|0,0,2]=4 5232 B12R1.383 C#CCCCCOC1CCC1=O 34a_100000766709_100009892977 [0,1,0,0,1,0|0,0,2]=4 5233 B12R1.383 C#CCCCCOC1CCC1=O 7a_100000766709_100009892977 [0,1,0,0,1,0|0,0,2]=4 5234 B12R1.383 C#CCCCCSC1CCC1=O 62a_100009892977_100010269958 [0,1,0,0,1,0|0,0,2]=4 5235 B12R1.383 C#CCCCCSC1CCC1=O 62a_100010269958_100009892977 [0,1,0,0,1,0|0,0,2]=4 5236 B12R1.383 C#CCCSCCC1CCC1=O 62a_100000688953_200016118888 [0,1,0,0,1,0|0,0,2]=4 5237 B12R1.383 C#CCCSCCC1CCC1=O 62a_200016118888_100000688953 [0,1,0,0,1,0|0,0,2]=4 5238 B12R1.383 C/C=C/CSCCC1CCC1=O 62a_100102629194_200016118888 [0,1,0,0,1,0|0,0,2]=4 5239 B12R1.383 C/C=C/CSCCC1CCC1=O 62a_200016118888_100102629194 [0,1,0,0,1,0|0,0,2]=4 5240 B12R1.383 C=CCCCCNC1CCC1=O 34a_100000703577_100009892977 [0,1,0,0,1,0|0,0,2]=4 5241 B12R1.383 C=CCCCCOC1CCC1=O 34a_100000766645_100009892977 [0,1,0,0,1,0|0,0,2]=4 5242 B12R1.383 C=CCCCCOC1CCC1=O 7a_100000766645_100009892977 [0,1,0,0,1,0|0,0,2]=4 5243 B12R1.383 C=CCCCCSC1CCC1=O 62a_100009892977_100011215482 [0,1,0,0,1,0|0,0,2]=4 5244 B12R1.383 C=CCCCCSC1CCC1=O 62a_100011215482_100009892977 [0,1,0,0,1,0|0,0,2]=4 5245 B12R1.383 C=CCCNCCC1CCC1=O 2230a_100015191253_200016118888 [0,1,0,0,1,0|0,0,2]=4 5246 B12R1.383 C=CCCSCCC1CCC1=O 62a_100000754431_200016118888 [0,1,0,0,1,0|0,0,2]=4 5247 B12R1.383 C=CCCSCCC1CCC1=O 62a_200016118888_100000754431 [0,1,0,0,1,0|0,0,2]=4 5248 B12R1.383 CC#CCNCCC1CCC1=O 2230a_100000685387_200016118888 [0,1,0,0,1,0|0,0,2]=4 5249 B12R1.383 CC#CCSCCC1CCC1=O 62a_100000748600_200016118888 [0,1,0,0,1,0|0,0,2]=4 5250 B12R1.383 CC#CCSCCC1CCC1=O 62a_200016118888_100000748600 [0,1,0,0,1,0|0,0,2]=4 5251 B12R1.383 CC/C=C\CCOC1CCC1=O 34a_100016288707_100009892977 [0,1,0,0,1,0|0,0,2]=4 5252 B12R1.383 CC/C=C\CCOC1CCC1=O 7a_100016288707_100009892977 [0,1,0,0,1,0|0,0,2]=4 5253 B12R1.383 CC/C=C\CCSC1CCC1=O 62a_100009892977_100015370543 [0,1,0,0,1,0|0,0,2]=4 5254 B12R1.383 CC/C=C\CCSC1CCC1=O 62a_100015370543_100009892977 [0,1,0,0,1,0|0,0,2]=4 5255 B12R1.383 CC=CCCCOC1CCC1=O 34a_100020645299_100009892977 [0,1,0,0,1,0|0,0,2]=4 5256 B12R1.383 CC=CCSCCC1CCC1=O 62a_100000070051_200016118888 [0,1,0,0,1,0|0,0,2]=4 5257 B12R1.383 CC=CCSCCC1CCC1=O 62a_200016118888_100000070051 [0,1,0,0,1,0|0,0,2]=4 5258 B12R1.383 CCC#CCCOC1CCC1=O 34a_100000036655_100009892977 [0,1,0,0,1,0|0,0,2]=4 5259 B12R1.383 CCC#CCCOC1CCC1=O 7a_100000036655_100009892977 [0,1,0,0,1,0|0,0,2]=4 5260 B12R1.383 CCC/C=C/COC1CCC1=O 34a_100016278788_100009892977 [0,1,0,0,1,0|0,0,2]=4 5261 B12R1.383 CCC/C=C/COC1CCC1=O 7a_100016278788_100009892977 [0,1,0,0,1,0|0,0,2]=4 5262 B12R1.383 CCCC#CCOC1CCC1=O 34a_100000034806_100009892977 [0,1,0,0,1,0|0,0,2]=4 5263 B12R1.383 CCCC#CCOC1CCC1=O 7a_100000034806_100009892977 [0,1,0,0,1,0|0,0,2]=4 5264 B12R1.383 CCCCCCOC1CCC1=O 34a_100000210259_100009892977 [0,1,0,0,1,0|0,0,0]=2 5265 B12R1.383 CCCCCCOC1CCC1=O 7a_100000210259_100009892977 [0,1,0,0,1,0|0,0,0]=2 5266 B12R1.383 CCCCCCSC1CCC1=O 62a_100000210314_100009892977 [0,1,0,0,1,0|0,0,0]=2 5267 B12R1.383 CCCCCCSC1CCC1=O 62a_100009892977_100000210757 [0,1,0,0,1,0|0,0,0]=2 5268 B12R1.383 CCCCNCCC1CCC1=O 2230a_100000102301_200016118888 [0,1,0,0,1,0|0,0,0]=2 5269 B12R1.383 CCCCNCCC1CCC1=O 7a_106832991798_200016118888 [0,1,0,0,1,0|0,0,0]=2 5270 B12R1.383 CCCCOCCC1CCC1=O 7a_100000210227_200016118888 [0,1,0,0,1,0|0,0,0]=2 5271 B12R1.383 CCCCOCSC1CCC1=O 62a_100009892977_100011995733 [0,1,0,0,1,0|1,0,0]=3 5272 B12R1.383 CCCCOCSC1CCC1=O 62a_100011995733_100009892977 [0,1,0,0,1,0|1,0,0]=3 5273 B12R1.383 CCCCSCCC1CCC1=O 62a_100000210211_200016118888 [0,1,0,0,1,0|0,0,0]=2 5274 B12R1.383 CCCCSCCC1CCC1=O 62a_200016118888_100000210210 [0,1,0,0,1,0|0,0,0]=2 5275 B12R1.383 CCCOCCNC1CCC1=O 34a_100161115042_100009892977 [0,1,0,0,1,0|1,0,0]=3 5276 B12R1.383 CCCOCCOC1CCC1=O 34a_100000752267_100009892977 [0,1,0,0,1,0|1,0,0]=3 5277 B12R1.383 CCCOCCOC1CCC1=O 7a_100000752267_100009892977 [0,1,0,0,1,0|1,0,0]=3 5278 B12R1.383 CCCOCCSC1CCC1=O 62a_100009892977_100011215938 [0,1,0,0,1,0|1,0,0]=3 5279 B12R1.383 CCCOCCSC1CCC1=O 62a_100011215938_100009892977 [0,1,0,0,1,0|1,0,0]=3 5280 B12R1.383 CCCSCCOC1CCC1=O 34a_200000230433_100009892977 [0,1,0,0,1,0|1,0,0]=3 5281 B12R1.383 CCCSCCOC1CCC1=O 7a_200000230433_100009892977 [0,1,0,0,1,0|1,0,0]=3 5282 B12R1.383 CCOCCCNC1CCC1=O 34a_100000210961_100009892977 [0,1,0,0,1,0|1,0,0]=3 5283 B12R1.383 CCOCCCOC1CCC1=O 34a_100000757476_100009892977 [0,1,0,0,1,0|1,0,0]=3 5284 B12R1.383 CCOCCCOC1CCC1=O 7a_100000757476_100009892977 [0,1,0,0,1,0|1,0,0]=3 5285 B12R1.383 CCOCCCSC1CCC1=O 62a_100009892977_100012232248 [0,1,0,0,1,0|1,0,0]=3 5286 B12R1.383 CCOCCCSC1CCC1=O 62a_100012232248_100009892977 [0,1,0,0,1,0|1,0,0]=3 5287 B12R1.383 CCOCSCCC1CCC1=O 62a_100000739092_200016118888 [0,1,0,0,1,0|1,0,0]=3 5288 B12R1.383 CCOCSCCC1CCC1=O 62a_200016118888_100000739092 [0,1,0,0,1,0|1,0,0]=3 5289 B12R1.383 CCSCCCOC1CCC1=O 34a_100011216438_100009892977 [0,1,0,0,1,0|1,0,0]=3 5290 B12R1.383 CCSCCCOC1CCC1=O 7a_100011216438_100009892977 [0,1,0,0,1,0|1,0,0]=3 5291 B12R1.383 COCCCCOC1CCC1=O 34a_100000740925_100009892977 [0,1,0,0,1,0|1,0,0]=3 5292 B12R1.383 COCCCCSC1CCC1=O 62a_100000730899_100009892977 [0,1,0,0,1,0|1,0,0]=3 5293 B12R1.383 COCCCCSC1CCC1=O 62a_100009892977_100000730899 [0,1,0,0,1,0|1,0,0]=3 5294 B12R1.383 COCCNCCC1CCC1=O 2230a_100000209980_200016118888 [0,1,0,0,1,0|1,0,0]=3 5295 B12R1.383 COCCOCSC1CCC1=O 62a_100000231047_100009892977 [0,1,0,0,1,0|2,0,0]=4 5296 B12R1.383 COCCOCSC1CCC1=O 62a_100009892977_100000231047 [0,1,0,0,1,0|2,0,0]=4 5297 B12R1.383 COCCSCCC1CCC1=O 62a_100000233755_200016118888 [0,1,0,0,1,0|1,0,0]=3 5298 B12R1.383 COCCSCCC1CCC1=O 62a_200016118888_100000233755 [0,1,0,0,1,0|1,0,0]=3 5299 B12R1.383 CSCCCCOC1CCC1=O 34a_100011217163_100009892977 [0,1,0,0,1,0|1,0,0]=3 5300 B12R1.383 CSCCCCOC1CCC1=O 7a_100011217163_100009892977 [0,1,0,0,1,0|1,0,0]=3 5301 B12R1.383 CSCCNCCC1CCC1=O 2230a_100020590264_200016118888 [0,1,0,0,1,0|1,0,0]=3 5302 B12R1.383 CSCCOCCC1CCC1=O 7a_100000230434_200016118888 [0,1,0,0,1,0|1,0,0]=3 5303 B12R1.383 CSCCSCCC1CCC1=O 62a_100000212216_200016118888 [0,1,0,0,1,0|1,0,0]=3 5304 B12R1.383 CSCCSCCC1CCC1=O 62a_200016118888_100000751147 [0,1,0,0,1,0|1,0,0]=3 5305 B12R1.383 N#CCCCCSC1CCC1=O 62a_100009892977_100000211819 [0,1,0,0,1,0|1,0,1]=4 5306 B12R1.383 N#CCCCCSC1CCC1=O 62a_100011219923_100009892977 [0,1,0,0,1,0|1,0,1]=4 5307 B12R1.383 N#CCCSCCC1CCC1=O 62a_100011215226_200016118888 [0,1,0,0,1,0|1,0,1]=4 5308 B12R1.383 N#CCCSCCC1CCC1=O 62a_200016118888_100011215226 [0,1,0,0,1,0|1,0,1]=4 5309 B12R1.383 NCCCCCOC1CCC1=O 34a_100000762737_100009892977 [0,1,0,0,1,0|1,0,0]=3 5310 B12R1.383 NCCOCCOC1CCC1=O 34a_100000211614_100009892977 [0,1,0,0,1,0|2,0,0]=4 5311 B12R1.383 O=C1CCC1CCNCCCF 2230a_100015189416_200016118888 [0,1,0,0,1,0|1,0,0]=3 5312 B12R1.383 O=C1CCC1CCSCCCF 62a_100011934791_200016118888 [0,1,0,0,1,0|1,0,0]=3 5313 B12R1.383 O=C1CCC1CCSCCCF 62a_200016118888_100011934791 [0,1,0,0,1,0|1,0,0]=3 5314 B12R1.383 O=C1CCC1CCSCCCO 62a_100011215043_200016118888 [0,1,0,0,1,0|1,0,0]=3 5315 B12R1.383 O=C1CCC1CCSCCCO 62a_200016118888_100011215043 [0,1,0,0,1,0|1,0,0]=3 5316 B12R1.383 O=C1CCC1NCCCCCO 34a_100000762737_100009892977 [0,1,0,0,1,0|1,0,0]=3 5317 B12R1.383 O=C1CCC1NCCOCCO 34a_100000211614_100009892977 [0,1,0,0,1,0|2,0,0]=4 5318 B12R1.383 O=C1CCC1OCCCCCBr 34a_100000746331_100009892977 [0,1,0,0,1,0|1,0,0]=3 5319 B12R1.383 O=C1CCC1OCCCCCBr 7a_100000746331_100009892977 [0,1,0,0,1,0|1,0,0]=3 5320 B12R1.383 O=C1CCC1OCCCCCCl 34a_100000746330_100009892977 [0,1,0,0,1,0|1,0,0]=3 5321 B12R1.383 O=C1CCC1OCCCCCCl 7a_100000746330_100009892977 [0,1,0,0,1,0|1,0,0]=3 5322 B12R1.383 O=C1CCC1OCCCCCI 34a_200012148887_100009892977 [0,1,0,0,1,0|1,0,0]=3 5323 B12R1.383 O=C1CCC1OCCCCCI 7a_200012148887_100009892977 [0,1,0,0,1,0|1,0,0]=3 5324 B12R1.383 O=C1CCC1OCCOCCBr 34a_100000692535_100009892977 [0,1,0,0,1,0|2,0,0]=4 5325 B12R1.383 O=C1CCC1OCCOCCBr 7a_100000692535_100009892977 [0,1,0,0,1,0|2,0,0]=4 5326 B12R1.383 O=C1CCC1OCCOCCCl 34a_100011215305_100009892977 [0,1,0,0,1,0|2,0,0]=4 5327 B12R1.383 O=C1CCC1OCCOCCCl 7a_100011215305_100009892977 [0,1,0,0,1,0|2,0,0]=4 5328 B12R1.383 O=C1CCC1OCCOCCF 34a_200015357709_100009892977 [0,1,0,0,1,0|2,0,0]=4 5329 B12R1.383 O=C1CCC1OCCOCCF 7a_200015357709_100009892977 [0,1,0,0,1,0|2,0,0]=4 5330 B12R1.383 O=C1CCC1OCCOCCI 34a_100012149058_100009892977 [0,1,0,0,1,0|2,0,0]=4 5331 B12R1.383 O=C1CCC1OCCOCCI 7a_100012149058_100009892977 [0,1,0,0,1,0|2,0,0]=4 5332 B12R1.383 O=C1CCC1SCCCCCF 62a_100000729378_100009892977 [0,1,0,0,1,0|1,0,0]=3 5333 B12R1.383 O=C1CCC1SCCCCCF 62a_100009892977_100000729378 [0,1,0,0,1,0|1,0,0]=3 5334 B12R1.383 O=C1CCC1SCCCCCO 62a_100000746330_100009892977 [0,1,0,0,1,0|1,0,0]=3 5335 B12R1.383 O=C1CCC1SCCCCCO 62a_100009892977_100000746330 [0,1,0,0,1,0|1,0,0]=3 5336 B12R1.383 O=C1CCC1SCCOCCO 62a_100009892977_100011215305 [0,1,0,0,1,0|2,0,0]=4 5337 B12R1.383 O=C1CCC1SCCOCCO 62a_100011215305_100009892977 [0,1,0,0,1,0|2,0,0]=4 5338 B12R1.383 O=CCCCCSC1CCC1=O 62a_100000139335_100009892977 [0,1,0,0,1,0|1,0,1]=4 5339 B12R1.383 O=CCCCCSC1CCC1=O 62a_100009892977_100000139335 [0,1,0,0,1,0|1,0,1]=4 5340 B12R1.485 CCCCCC(=O)C1CCC1=O 1458a_100000212188_100009892977 [0,1,0,0,1,0|0,0,1]=3 5341 B12R1.485 CCCCCN(C)C1CCC1=O 269982a_100000223495_100009892977 [0,1,0,0,1,0|1,0,0]=3 5342 B12R1.485 CCCOCC(=O)C1CCC1=O 1458a_100000745993_100009892977 [0,1,0,0,1,0|1,0,1]=4 5343 B12R1.485 CCCSCC(=O)C1CCC1=O 1458a_100000217233_100009892977 [0,1,0,0,1,0|1,0,1]=4 5344 B12R1.485 CCOCCC(=O)C1CCC1=O 1458a_100000749530_100009892977 [0,1,0,0,1,0|1,0,1]=4 5345 B12R1.485 CCSCCC(=O)C1CCC1=O 1458a_100000230768_100009892977 [0,1,0,0,1,0|1,0,1]=4 5346 B12R1.485 CN(CCCCO)C1CCC1=O 269982a_100000717598_100009892977 [0,1,0,0,1,0|2,0,0]=4 5347 B12R1.485 COCCCC(=O)C1CCC1=O 1458a_100000741012_100009892977 [0,1,0,0,1,0|1,0,1]=4 5348 B12R1.485 COCCCN(C)C1CCC1=O 269982a_100000224831_100009892977 [0,1,0,0,1,0|2,0,0]=4 5349 B12R1.485 CSCCCC(=O)C1CCC1=O 1458a_100000173376_100009892977 [0,1,0,0,1,0|1,0,1]=4 5350 B12R1.485 O=C(CCCCO)C1CCC1=O 1458a_100000695505_100009892977 [0,1,0,0,1,0|1,0,1]=4 5351 B12R1.925 CC(CCCCl)OC1CCC1=O 34a_200000718107_100009892977 [0,1,0,0,1,0|2,0,0]=4 5352 B12R1.925 CC(CCCCl)OC1CCC1=O 7a_200000718107_100009892977 [0,1,0,0,1,0|2,0,0]=4 5353 B12R1.925 CCCCC(C)OC1CCC1=O 34a_100000687866_100009892977 [0,1,0,0,1,0|1,0,0]=3 5354 B12R1.925 CCCCC(C)OC1CCC1=O 7a_100000687866_100009892977 [0,1,0,0,1,0|1,0,0]=3 5355 B12R1.925 CCCCC(C)SC1CCC1=O 62a_100009892977_200011215066 [0,1,0,0,1,0|1,0,0]=3 5356 B12R1.925 CCCCC(C)SC1CCC1=O 62a_200011215066_100009892977 [0,1,0,0,1,0|1,0,0]=3 5357 B12R1.925 CCOCC(C)OC1CCC1=O 34a_100000718985_100009892977 [0,1,0,0,1,0|2,0,0]=4 5358 B12R1.925 CCOCC(C)OC1CCC1=O 7a_100000718985_100009892977 [0,1,0,0,1,0|2,0,0]=4 5359 B14R1.9 CCCCCCN1CCNC(=O)C1C 2230a_100000750721_100000210314 [0,1,0,0,0,1|2,0,0]=4 5360 B14R1.9 CCCCCCN1CCNC(=O)C1C 269982a_100000750721_100000210757 [0,1,0,0,0,1|2,0,0]=4 5361 B14R1.9 CCCCCCN1CCNC(=O)C1C 34a_100000750721_100000210314 [0,1,0,0,0,1|2,0,0]=4 5362 B14R1.9 CCCCNCC1CCCC(=O)N1C 2230a_200010383782_100000210211 [0,1,0,0,0,1|2,0,0]=4 5363 B14R1.9 CCCCNCC1CCCC(=O)N1C 34a_200010383782_100000210210 [0,1,0,0,0,1|2,0,0]=4 5364 B14R1.20 CCCCCC(=O)C1CCNC(=O)C1 1458a_100000132800_100000210326 [0,1,0,0,0,1|1,0,1]=4 5365 B14R1.20 CCCCCC(=O)C1CSCC(=O)N1 1458a_100000045068_100000210326 [0,1,0,0,0,1|1,0,1]=4 5366 B14R1.20 CCCCCC(=O)[C@H]1CCCC(=O)N1 1458a_100000705292_100000210326 [0,1,0,0,0,1|1,0,1]=4 5367 B14R1.20 CCCCCC(C)N1CCNC(=O)C1 2230a_100000184651_200011218191 [0,1,0,0,0,1|2,0,0]=4 5368 B14R1.20 CCCCCC(C)N1CCNC(=O)C1 270004a_100000184651_100000211708 [0,1,0,0,0,1|2,0,0]=4 5369 B14R1.20 CCCCCC(C)N1CCOC(=O)C1 2230a_100000131268_200011218191 [0,1,0,0,0,1|2,0,0]=4 5370 B14R1.20 CCCCCC(C)N1CCOC(=O)C1 270004a_100000131268_100000211708 [0,1,0,0,0,1|2,0,0]=4 5371 B14R1.26 CCCCCCCN1CCNC(=O)C1 2230a_100000184651_100000210681 [0,1,0,0,0,1|2,0,0]=4 5372 B14R1.26 CCCCCCCN1CCOC(=O)C1 2230a_100000131268_100000210681 [0,1,0,0,0,1|2,0,0]=4 5373 B14R1.26 CCCCCCNC1CCNC(=O)C1 2230a_100016994916_100000210314 [0,1,0,0,0,1|1,0,0]=3 5374 B14R1.26 CCCCCCNC1CCNC(=O)C1 34a_100016994916_100000210314 [0,1,0,0,0,1|1,0,0]=3 5375 B14R1.26 CCCCCCOC1C=C(CCC1)C 34a_100011218613_100000210314 [0,1,0,0,0,1|2,0,0]=4 5376 B14R1.26 CCCCCCOC1CCCC(=O)C1 34a_100012613340_100000210314 [0,1,0,0,0,1|1,0,0]=3 5377 B14R1.26 CCCCCCO[C@@H]1CCNC(=O)C1 34a_100015189427_100000210314 [0,1,0,0,0,1|1,0,0]=3 5378 B14R1.26 CCCCCOCC1CCCC(=O)N1 34a_200000102386_100000718602 [0,1,0,0,0,1|1,0,0]=3 5379 B14R1.26 CCCCCOCC1CCNC(=O)C1 34a_100009886756_100000718602 [0,1,0,0,0,1|1,0,0]=3 5380 B14R1.26 CCCCCOCC1COCC(=O)N1 34a_200000101122_100000718602 [0,1,0,0,0,1|1,0,0]=3 5381 B14R1.26 CCCCOCCN1CCNC(=O)C1 2230a_100000184651_100000743108 [0,1,0,0,0,1|2,0,0]=4 5382 B14R1.26 CCCCOCCN1CCOC(=O)C1 2230a_100000131268_100000743108 [0,1,0,0,0,1|2,0,0]=4 5383 B14R1.26 CCCCOCNC1CCNC(=O)C1 2230a_100016994916_100011995733 [0,1,0,0,0,1|2,0,0]=4 5384 B14R1.26 CCCCOCNC1CCNC(=O)C1 34a_100016994916_100011995733 [0,1,0,0,0,1|2,0,0]=4 5385 B14R1.26 CCCCOCOC1CCCC(=O)C1 34a_100012613340_100011995733 [0,1,0,0,0,1|2,0,0]=4 5386 B14R1.26 CCCCOCO[C@@H]1CCNC(=O)C1 34a_100015189427_100011995733 [0,1,0,0,0,1|2,0,0]=4 5387 B14R1.26 CCCNCCCN1CCNC(=O)C1 2230a_100000757908_100000210303 [0,1,0,0,0,1|2,0,0]=4 5388 B14R1.26 CCCOCCNC1CCNC(=O)C1 2230a_100016994916_100011215938 [0,1,0,0,0,1|2,0,0]=4 5389 B14R1.26 CCCOCCNC1CCNC(=O)C1 34a_100016994916_100011215938 [0,1,0,0,0,1|2,0,0]=4 5390 B14R1.26 CCCOCCOC1CCCC(=O)C1 34a_100012613340_100011215938 [0,1,0,0,0,1|2,0,0]=4 5391 B14R1.26 CCCOCCO[C@@H]1CCNC(=O)C1 34a_100015189427_100011215938 [0,1,0,0,0,1|2,0,0]=4 5392 B14R1.26 CCOCCCNC1CCNC(=O)C1 2230a_100016994916_100012232248 [0,1,0,0,0,1|2,0,0]=4 5393 B14R1.26 CCOCCCNC1CCNC(=O)C1 34a_100016994916_100012232248 [0,1,0,0,0,1|2,0,0]=4 5394 B14R1.26 CCOCCCOC1CCCC(=O)C1 34a_100012613340_100012232248 [0,1,0,0,0,1|2,0,0]=4 5395 B14R1.26 CCOCCCO[C@@H]1CCNC(=O)C1 34a_100015189427_100012232248 [0,1,0,0,0,1|2,0,0]=4 5396 B14R1.26 CCOCCOCC1CCCC(=O)N1 34a_200000102386_100000210147 [0,1,0,0,0,1|2,0,0]=4 5397 B14R1.26 CCOCCOCC1CCNC(=O)C1 34a_100009886756_100000210147 [0,1,0,0,0,1|2,0,0]=4 5398 B14R1.26 CCOCCOCC1COCC(=O)N1 34a_200000101122_100000210147 [0,1,0,0,0,1|2,0,0]=4 5399 B14R1.26 CCSCCOCC1CCCC(=O)N1 34a_200000102386_100000757381 [0,1,0,0,0,1|2,0,0]=4 5400 B14R1.26 CCSCCOCC1CCNC(=O)C1 34a_100009886756_100000757381 [0,1,0,0,0,1|2,0,0]=4 5401 B14R1.26 CCSCCOCC1COCC(=O)N1 34a_200000101122_100000757381 [0,1,0,0,0,1|2,0,0]=4 5402 B14R1.26 COCCCCNC1CCNC(=O)C1 2230a_100016994916_100000730899 [0,1,0,0,0,1|2,0,0]=4 5403 B14R1.26 COCCCCNC1CCNC(=O)C1 34a_100016994916_100000755781 [0,1,0,0,0,1|2,0,0]=4 5404 B14R1.26 COCCCCOC1CCCC(=O)C1 34a_100012613340_100000755781 [0,1,0,0,0,1|2,0,0]=4 5405 B14R1.26 COCCCCO[C@@H]1CCNC(=O)C1 34a_100015189427_100000755781 [0,1,0,0,0,1|2,0,0]=4 5406 B14R1.26 COCCCOCC1CCCC(=O)N1 34a_200000102386_100000740836 [0,1,0,0,0,1|2,0,0]=4 5407 B14R1.26 COCCCOCC1CCNC(=O)C1 34a_100009886756_100000740836 [0,1,0,0,0,1|2,0,0]=4 5408 B14R1.26 COCCCOCC1COCC(=O)N1 34a_200000101122_100000740836 [0,1,0,0,0,1|2,0,0]=4 5409 B14R1.26 O=C1CC(CCN1)COCCCCF 34a_100009886756_100000729493 [0,1,0,0,0,1|2,0,0]=4 5410 B14R1.26 O=C1CC(CCN1)COCCCCO 34a_100009886756_100011216708 [0,1,0,0,0,1|2,0,0]=4 5411 B14R1.26 O=C1CC(CCN1)NCCCCCF 2230a_100016994916_100000729378 [0,1,0,0,0,1|2,0,0]=4 5412 B14R1.26 O=C1CC(CCN1)NCCCCCF 34a_100016994916_100000729378 [0,1,0,0,0,1|2,0,0]=4 5413 B14R1.26 O=C1CC(CCN1)NCCCCCO 2230a_100016994916_100000746330 [0,1,0,0,0,1|2,0,0]=4 5414 B14R1.26 O=C1CC(CCN1)NCCCCCO 34a_100016994916_100000746330 [0,1,0,0,0,1|2,0,0]=4 5415 B14R1.26 O=C1CCCC(C1)OCCCCCF 34a_100012613340_100000729378 [0,1,0,0,0,1|2,0,0]=4 5416 B14R1.26 O=C1CCCC(C1)OCCCCCO 34a_100012613340_100000746330 [0,1,0,0,0,1|2,0,0]=4 5417 B14R1.26 O=C1CCCC(N1)COCCCCF 34a_200000102386_100000729493 [0,1,0,0,0,1|2,0,0]=4 5418 B14R1.26 O=C1CCCC(N1)COCCCCO 34a_200000102386_100011216708 [0,1,0,0,0,1|2,0,0]=4 5419 B14R1.26 O=C1CN(CCN1)CCCCCCF 2230a_100000184651_100015922095 [0,1,0,0,0,1|2,0,0]=4 5420 B14R1.26 O=C1CN(CCN1)CCCCCCO 2230a_100000184651_100000766143 [0,1,0,0,0,1|2,0,0]=4 5421 B14R1.26 O=C1CN(CCO1)CCCCCCF 2230a_100000131268_100015922095 [0,1,0,0,0,1|2,0,0]=4 5422 B14R1.26 O=C1CN(CCO1)CCCCCCO 2230a_100000131268_100000766143 [0,1,0,0,0,1|2,0,0]=4 5423 B14R1.26 O=C1COCC(N1)COCCCCF 34a_200000101122_100000729493 [0,1,0,0,0,1|2,0,0]=4 5424 B14R1.26 O=C1COCC(N1)COCCCCO 34a_200000101122_100011216708 [0,1,0,0,0,1|2,0,0]=4 5425 B14R1.26 O=C1C[C@@H](CCN1)OCCCCCF 34a_100015189427_100000729378 [0,1,0,0,0,1|2,0,0]=4 5426 B14R1.26 O=C1C[C@@H](CCN1)OCCCCCO 34a_100015189427_100000746330 [0,1,0,0,0,1|2,0,0]=4 5427 B14R1.32 CCCC(C)CNC1CCNC(=O)C1 2230a_100016994916_100011216630 [0,1,0,0,0,1|2,0,0]=4 5428 B14R1.32 CCCC(C)CNC1CCNC(=O)C1 34a_100016994916_100011216630 [0,1,0,0,0,1|2,0,0]=4 5429 B14R1.32 CCCC(C)COC1CCCC(=O)C1 34a_100012613340_100011216630 [0,1,0,0,0,1|2,0,0]=4 5430 B14R1.32 CCCC(C)CO[C@@H]1CCNC(=O)C1 34a_100015189427_100011216630 [0,1,0,0,0,1|2,0,0]=4 5431 B14R1.32 CCCC(C)OCC1CCCC(=O)N1 34a_200000102386_100000766640 [0,1,0,0,0,1|2,0,0]=4 5432 B14R1.32 CCCC(C)OCC1CCNC(=O)C1 34a_100009886756_100000766640 [0,1,0,0,0,1|2,0,0]=4 5433 B14R1.32 CCCC(C)OCC1COCC(=O)N1 34a_200000101122_100000766640 [0,1,0,0,0,1|2,0,0]=4 5434 B14R1.34 CCCCC(C)NC1CCNC(=O)C1 2230a_100016994916_200011215066 [0,1,0,0,0,1|2,0,0]=4 5435 B14R1.34 CCCCC(C)NC1CCNC(=O)C1 34a_100016994916_200011215066 [0,1,0,0,0,1|2,0,0]=4 5436 B14R1.34 CCCCC(C)OC1CCCC(=O)C1 34a_100012613340_200011215066 [0,1,0,0,0,1|2,0,0]=4 5437 B14R1.34 CCCCC(C)O[C@@H]1CCNC(=O)C1 34a_100015189427_200011215066 [0,1,0,0,0,1|2,0,0]=4 5438 B14R1.148 CC(C)CCCCN1CCNC(=O)C1 2230a_100000184651_100011216152 [0,1,0,0,0,1|2,0,0]=4 5439 B14R1.148 CC(C)CCCCN1CCOC(=O)C1 2230a_100000131268_100011216152 [0,1,0,0,0,1|2,0,0]=4 5440 B14R1.148 CC(C)CCCNC1CCNC(=O)C1 2230a_100016994916_100011214892 [0,1,0,0,0,1|2,0,0]=4 5441 B14R1.148 CC(C)CCCNC1CCNC(=O)C1 34a_100016994916_100011214892 [0,1,0,0,0,1|2,0,0]=4 5442 B14R1.148 CC(C)CCCOC1CCCC(=O)C1 34a_100012613340_100011214892 [0,1,0,0,0,1|2,0,0]=4 5443 B14R1.148 CC(C)CCCO[C@@H]1CCNC(=O)C1 34a_100015189427_100011214892 [0,1,0,0,0,1|2,0,0]=4 5444 B14R1.148 CC(C)CCOCC1CCCC(=O)N1 34a_200000102386_100000210312 [0,1,0,0,0,1|2,0,0]=4 5445 B14R1.148 CC(C)CCOCC1CCNC(=O)C1 34a_100009886756_100000210312 [0,1,0,0,0,1|2,0,0]=4 5446 B14R1.148 CC(C)CCOCC1COCC(=O)N1 34a_200000101122_100000210312 [0,1,0,0,0,1|2,0,0]=4 5447 B14R1.148 CC(O)CCCNC1CCNC(=O)C1 2230a_100016994916_200000718107 [0,1,0,0,0,1|2,0,0]=4 5448 B14R1.148 CC(O)CCCNC1CCNC(=O)C1 34a_100016994916_200000718107 [0,1,0,0,0,1|2,0,0]=4 5449 B14R1.148 CC(O)CCCOC1CCCC(=O)C1 34a_100012613340_200000718107 [0,1,0,0,0,1|2,0,0]=4 5450 B14R1.148 CC(O)CCCO[C@@H]1CCNC(=O)C1 34a_100015189427_200000718107 [0,1,0,0,0,1|2,0,0]=4 5451 B14R1.148 CC(O)CCOCC1CCCC(=O)N1 34a_200000102386_100012276601 [0,1,0,0,0,1|2,0,0]=4 5452 B14R1.148 CC(O)CCOCC1CCNC(=O)C1 34a_100009886756_100012276601 [0,1,0,0,0,1|2,0,0]=4 5453 B14R1.148 CC(O)CCOCC1COCC(=O)N1 34a_200000101122_100012276601 [0,1,0,0,0,1|2,0,0]=4 5454 B14R1.232 CCCCCCN1CCN(C(=O)C1)C 2230a_100000187256_100000210314 [0,1,0,0,0,1|2,0,0]=4 5455 B14R1.232 CCCCCCN1CCN(C(=O)C1)C 269982a_100000187256_100000210757 [0,1,0,0,0,1|2,0,0]=4 5456 B14R1.232 CCCCCNC1CCN(C(=O)C1)C 2230a_100000126938_100000210326 [0,1,0,0,0,1|2,0,0]=4 5457 B14R1.232 CCCCCNC1CCN(C(=O)C1)C 34a_100000126938_100000718602 [0,1,0,0,0,1|2,0,0]=4 5458 B14R1.1025 CCC(C)COCC1CCCC(=O)N1 34a_200000102386_100000748023 [0,1,0,0,0,1|2,0,0]=4 5459 B14R1.1025 CCC(C)COCC1CCNC(=O)C1 34a_100009886756_100000748023 [0,1,0,0,0,1|2,0,0]=4 5460 B14R1.1025 CCC(C)COCC1COCC(=O)N1 34a_200000101122_100000748023 [0,1,0,0,0,1|2,0,0]=4 5461 B14R1.1025 CCC(O)COCC1CCCC(=O)N1 34a_200000102386_100011218378 [0,1,0,0,0,1|2,0,0]=4 5462 B14R1.1025 CCC(O)COCC1CCNC(=O)C1 34a_100009886756_100011218378 [0,1,0,0,0,1|2,0,0]=4 5463 B14R1.1025 CCC(O)COCC1COCC(=O)N1 34a_200000101122_100011218378 [0,1,0,0,0,1|2,0,0]=4 5464 B14R1.1025 CC[C@H](C)COCC1CCCC(=O)N1 34a_200000102386_100009816398 [0,1,0,0,0,1|2,0,0]=4 5465 B14R1.1025 CC[C@H](C)COCC1CCNC(=O)C1 34a_100009886756_100009816398 [0,1,0,0,0,1|2,0,0]=4 5466 B14R1.1025 CC[C@H](C)COCC1COCC(=O)N1 34a_200000101122_100009816398 [0,1,0,0,0,1|2,0,0]=4 5467 B14R1.13 CCC(C)COCC1CCC(=O)CC1 34a_100000062911_100000748023 [0,1,0,0,0,1|2,0,0]=4 5468 B14R1.13 CCC(O)COCC1CCC(=O)CC1 34a_100000062911_100011218378 [0,1,0,0,0,1|2,0,0]=4 5469 B14R1.13 CC[C@H](C)COCC1CCC(=O)CC1 34a_100000062911_100009816398 [0,1,0,0,0,1|2,0,0]=4 5470 B14R1.14 C=C1CCC(CC1)COCCCCC 34a_100000074039_100000718602 [0,1,0,0,0,1|2,0,0]=4 5471 B14R1.14 C=C1CCC(CC1)NCCCCCC 270004a_100000210581_100010272673 [0,1,0,0,0,1|2,0,0]=4 5472 B14R1.14 CCCCCCNC1CCC(=O)NC1 2230a_100000748762_100000210314 [0,1,0,0,0,1|1,0,0]=3 5473 B14R1.14 CCCCCCNC1CCC(=O)NC1 34a_100000748762_100000210314 [0,1,0,0,0,1|1,0,0]=3 5474 B14R1.14 CCCCCCOC1CCC(=O)CC1 34a_100000764474_100000210314 [0,1,0,0,0,1|1,0,0]=3 5475 B14R1.14 CCCCCCOC1CCC(=O)CC1 7a_100000764474_100000210314 [0,1,0,0,0,1|1,0,0]=3 5476 B14R1.14 CCCCCCOC1CCC(=O)NC1 34a_100000079199_100000210314 [0,1,0,0,0,1|1,0,0]=3 5477 B14R1.14 CCCCCCOC1CNC(=O)NC1 34a_100000080929_100000210314 [0,1,0,0,0,1|2,0,0]=4 5478 B14R1.14 CCCCCOCC1CCC(=O)CC1 34a_100000062911_100000718602 [0,1,0,0,0,1|1,0,0]=3 5479 B14R1.14 CCCCOCNC1CCC(=O)NC1 2230a_100000748762_100011995733 [0,1,0,0,0,1|2,0,0]=4 5480 B14R1.14 CCCCOCNC1CCC(=O)NC1 34a_100000748762_100011995733 [0,1,0,0,0,1|2,0,0]=4 5481 B14R1.14 CCCCOCOC1CCC(=O)CC1 34a_100000764474_100011995733 [0,1,0,0,0,1|2,0,0]=4 5482 B14R1.14 CCCCOCOC1CCC(=O)NC1 34a_100000079199_100011995733 [0,1,0,0,0,1|2,0,0]=4 5483 B14R1.14 CCCOCCNC1CCC(=O)NC1 2230a_100000748762_100011215938 [0,1,0,0,0,1|2,0,0]=4 5484 B14R1.14 CCCOCCNC1CCC(=O)NC1 34a_100000748762_100011215938 [0,1,0,0,0,1|2,0,0]=4 5485 B14R1.14 CCCOCCOC1CCC(=O)CC1 34a_100000764474_100011215938 [0,1,0,0,0,1|2,0,0]=4 5486 B14R1.14 CCCOCCOC1CCC(=O)CC1 7a_100000764474_100011215938 [0,1,0,0,0,1|2,0,0]=4 5487 B14R1.14 CCCOCCOC1CCC(=O)NC1 34a_100000079199_100011215938 [0,1,0,0,0,1|2,0,0]=4 5488 B14R1.14 CCOCCCNC1CCC(=O)NC1 2230a_100000748762_100012232248 [0,1,0,0,0,1|2,0,0]=4 5489 B14R1.14 CCOCCCNC1CCC(=O)NC1 34a_100000748762_100012232248 [0,1,0,0,0,1|2,0,0]=4 5490 B14R1.14 CCOCCCOC1CCC(=O)CC1 34a_100000764474_100012232248 [0,1,0,0,0,1|2,0,0]=4 5491 B14R1.14 CCOCCCOC1CCC(=O)CC1 7a_100000764474_100012232248 [0,1,0,0,0,1|2,0,0]=4 5492 B14R1.14 CCOCCCOC1CCC(=O)NC1 34a_100000079199_100012232248 [0,1,0,0,0,1|2,0,0]=4 5493 B14R1.14 CCOCCOCC1CCC(=O)CC1 34a_100000062911_100000210147 [0,1,0,0,0,1|2,0,0]=4 5494 B14R1.14 CCSCCOCC1CCC(=O)CC1 34a_100000062911_100000757381 [0,1,0,0,0,1|2,0,0]=4 5495 B14R1.14 COCCCCNC1CCC(=O)NC1 2230a_100000748762_100000730899 [0,1,0,0,0,1|2,0,0]=4 5496 B14R1.14 COCCCCNC1CCC(=O)NC1 34a_100000748762_100000755781 [0,1,0,0,0,1|2,0,0]=4 5497 B14R1.14 COCCCCOC1CCC(=O)CC1 34a_100000764474_100000755781 [0,1,0,0,0,1|2,0,0]=4 5498 B14R1.14 COCCCCOC1CCC(=O)CC1 7a_100000764474_100000730899 [0,1,0,0,0,1|2,0,0]=4 5499 B14R1.14 COCCCCOC1CCC(=O)NC1 34a_100000079199_100000755781 [0,1,0,0,0,1|2,0,0]=4 5500 B14R1.14 COCCCOCC1CCC(=O)CC1 34a_100000062911_100000740836 [0,1,0,0,0,1|2,0,0]=4 5501 B14R1.14 O=C1CCC(CC1)COCCCCF 34a_100000062911_100000729493 [0,1,0,0,0,1|2,0,0]=4 5502 B14R1.14 O=C1CCC(CC1)COCCCCO 34a_100000062911_100011216708 [0,1,0,0,0,1|2,0,0]=4 5503 B14R1.14 O=C1CCC(CC1)OCCCCCF 34a_100000764474_100000729378 [0,1,0,0,0,1|2,0,0]=4 5504 B14R1.14 O=C1CCC(CC1)OCCCCCF 7a_100000764474_100000729378 [0,1,0,0,0,1|2,0,0]=4 5505 B14R1.14 O=C1CCC(CC1)OCCCCCO 34a_100000764474_100000746330 [0,1,0,0,0,1|2,0,0]=4 5506 B14R1.14 O=C1CCC(CC1)OCCCCCO 7a_100000764474_100000746330 [0,1,0,0,0,1|2,0,0]=4 5507 B14R1.14 O=C1CCC(CN1)NCCCCCF 2230a_100000748762_100000729378 [0,1,0,0,0,1|2,0,0]=4 5508 B14R1.14 O=C1CCC(CN1)NCCCCCF 34a_100000748762_100000729378 [0,1,0,0,0,1|2,0,0]=4 5509 B14R1.14 O=C1CCC(CN1)NCCCCCO 2230a_100000748762_100000746330 [0,1,0,0,0,1|2,0,0]=4 5510 B14R1.14 O=C1CCC(CN1)NCCCCCO 34a_100000748762_100000746330 [0,1,0,0,0,1|2,0,0]=4 5511 B14R1.14 O=C1CCC(CN1)OCCCCCF 34a_100000079199_100000729378 [0,1,0,0,0,1|2,0,0]=4 5512 B14R1.14 O=C1CCC(CN1)OCCCCCO 34a_100000079199_100000746330 [0,1,0,0,0,1|2,0,0]=4 5513 B14R1.19 CCCCCC(=O)C1CCC(=O)NC1 1458a_100000740907_100000210326 [0,1,0,0,0,1|1,0,1]=4 5514 B14R1.33 CCCCC(C)NC1CCC(=O)NC1 2230a_100000748762_200011215066 [0,1,0,0,0,1|2,0,0]=4 5515 B14R1.33 CCCCC(C)NC1CCC(=O)NC1 270004a_100000748762_100000210087 [0,1,0,0,0,1|2,0,0]=4 5516 B14R1.33 CCCCC(C)NC1CCC(=O)NC1 34a_100000748762_200011215066 [0,1,0,0,0,1|2,0,0]=4 5517 B14R1.33 CCCCC(C)OC1CCC(=O)CC1 34a_100000764474_200011215066 [0,1,0,0,0,1|2,0,0]=4 5518 B14R1.33 CCCCC(C)OC1CCC(=O)CC1 7a_100000764474_200011215066 [0,1,0,0,0,1|2,0,0]=4 5519 B14R1.33 CCCCC(C)OC1CCC(=O)NC1 34a_100000079199_200011215066 [0,1,0,0,0,1|2,0,0]=4 5520 B14R1.502 CCCC(C)CNC1CCC(=O)NC1 2230a_100000748762_100011216630 [0,1,0,0,0,1|2,0,0]=4 5521 B14R1.502 CCCC(C)CNC1CCC(=O)NC1 270004a_100000748762_100000243154 [0,1,0,0,0,1|2,0,0]=4 5522 B14R1.502 CCCC(C)CNC1CCC(=O)NC1 34a_100000748762_100011216630 [0,1,0,0,0,1|2,0,0]=4 5523 B14R1.502 CCCC(C)COC1CCC(=O)CC1 34a_100000764474_100011216630 [0,1,0,0,0,1|2,0,0]=4 5524 B14R1.502 CCCC(C)COC1CCC(=O)CC1 7a_100000764474_100011216630 [0,1,0,0,0,1|2,0,0]=4 5525 B14R1.502 CCCC(C)COC1CCC(=O)NC1 34a_100000079199_100011216630 [0,1,0,0,0,1|2,0,0]=4 5526 B14R1.502 CCCC(C)OCC1CCC(=O)CC1 34a_100000062911_100000766640 [0,1,0,0,0,1|2,0,0]=4 5527 B14R1.677 CC(C)CCCNC1CCC(=O)NC1 2230a_100000748762_100011214892 [0,1,0,0,0,1|2,0,0]=4 5528 B14R1.677 CC(C)CCCNC1CCC(=O)NC1 34a_100000748762_100011214892 [0,1,0,0,0,1|2,0,0]=4 5529 B14R1.677 CC(C)CCCOC1CCC(=O)CC1 34a_100000764474_100011214892 [0,1,0,0,0,1|2,0,0]=4 5530 B14R1.677 CC(C)CCCOC1CCC(=O)CC1 7a_100000764474_100011214892 [0,1,0,0,0,1|2,0,0]=4 5531 B14R1.677 CC(C)CCCOC1CCC(=O)NC1 34a_100000079199_100011214892 [0,1,0,0,0,1|2,0,0]=4 5532 B14R1.677 CC(C)CCOCC1CCC(=O)CC1 34a_100000062911_100000210312 [0,1,0,0,0,1|2,0,0]=4 5533 B14R1.677 CC(O)CCCNC1CCC(=O)NC1 2230a_100000748762_200000718107 [0,1,0,0,0,1|2,0,0]=4 5534 B14R1.677 CC(O)CCCNC1CCC(=O)NC1 34a_100000748762_200000718107 [0,1,0,0,0,1|2,0,0]=4 5535 B14R1.677 CC(O)CCCOC1CCC(=O)CC1 34a_100000764474_200000718107 [0,1,0,0,0,1|2,0,0]=4 5536 B14R1.677 CC(O)CCCOC1CCC(=O)CC1 7a_100000764474_200000718107 [0,1,0,0,0,1|2,0,0]=4 5537 B14R1.677 CC(O)CCCOC1CCC(=O)NC1 34a_100000079199_200000718107 [0,1,0,0,0,1|2,0,0]=4 5538 B14R1.677 CC(O)CCOCC1CCC(=O)CC1 34a_100000062911_100012276601 [0,1,0,0,0,1|2,0,0]=4 5539 B14R1.774 CCCCCNC1CCC(=O)NC1=O 2230a_100000209983_100000694648 [0,1,0,0,0,1|2,0,0]=4 5540 B14R1.774 CCCCCNC1CCC(=O)NC1=O 2230a_100000691121_100000210326 [0,1,0,0,0,1|2,0,0]=4 5541 B14R1.774 CCCCCNC1CCC(=O)NC1=O 34a_100000691121_100000718602 [0,1,0,0,0,1|2,0,0]=4 5542 B14R1.774 CCCCCOC1CCC(=O)NC1=O 7a_100000210253_100000694648 [0,1,0,0,0,1|2,0,0]=4 5543 B14R1.774 CCCCCSC1CCC(=O)NC1=O 62a_100000210326_100000694648 [0,1,0,0,0,1|2,0,0]=4 5544 B14R1.774 CCCCCSC1CCC(=O)NC1=O 62a_100000694648_100000210326 [0,1,0,0,0,1|2,0,0]=4 5545 B14R1.20332 CCCCCOC1(CCC(=O)CC1)C 34a_100012184276_100000718602 [0,1,0,0,0,1|2,0,0]=4 5546 B14R1.20332 CCCCCOC1(CCC(=O)CC1)C 7a_100012184276_100000210326 [0,1,0,0,0,1|2,0,0]=4 5547 B14R1.28 CCCC(=O)CC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_100000747444 [0,2,0,0,0,0|0,0,2]=4 5548 B14R1.28 CCCC(C)CC(=O)C1CCC(=O)N1 1458a_100000210400_100011216630 [0,2,0,0,0,0|1,0,1]=4 5549 B14R1.28 CCCC(C)CC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_100011216630 [0,2,0,0,0,0|0,0,1]=3 5550 B14R1.28 CCCC(C)NC(=O)[C@@H]1CCC(=O)O1 11a_100000741246_100009814974 [0,2,0,0,0,0|1,0,1]=4 5551 B14R1.28 CCCC(C)NC(=O)[C@@H]1CCC(=O)O1 1626a_100000741246_100009814974 [0,2,0,0,0,0|1,0,1]=4 5552 B14R1.28 CCCC(C)NC(=O)[C@@H]1CCC(=O)O1 240690a_100000741246_100009814974 [0,2,0,0,0,0|1,0,1]=4 5553 B14R1.28 CCCC(C)NC(=O)[C@@H]1CCC(=O)O1 527a_100000741246_100009814974 [0,2,0,0,0,0|1,0,1]=4 5554 B14R1.37 C#CCCCCC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_100010269958 [0,2,0,0,0,0|0,0,2]=4 5555 B14R1.37 C=CCCCCC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_100011215482 [0,2,0,0,0,0|0,0,2]=4 5556 B14R1.37 CC/C=C\CCC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_100015370543 [0,2,0,0,0,0|0,0,2]=4 5557 B14R1.37 CCCCCCC(=O)C1CCC(=O)N1 1458a_100000210400_100000210757 [0,2,0,0,0,0|1,0,0]=3 5558 B14R1.37 CCCCCCC(=O)C1CNC(=O)C1 1458a_100000747279_100000210757 [0,2,0,0,0,0|2,0,0]=4 5559 B14R1.37 CCCCCCC(=O)C1CNC(=O)N1 1458a_100000033324_100000210757 [0,2,0,0,0,0|2,0,0]=4 5560 B14R1.37 CCCCCCC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_100000210757 [0,2,0,0,0,0|0,0,0]=2 5561 B14R1.37 CCCCCCC(=O)[C@@H]1CSC(=O)N1 1458a_100000735014_100000210757 [0,2,0,0,0,0|2,0,0]=4 5562 B14R1.37 CCCCCNC(=O)C1CCC(=O)N1 240690a_100000209983_100000210400 [0,2,0,0,0,0|1,0,1]=4 5563 B14R1.37 CCCCCNC(=O)[C@@H]1CCC(=O)O1 11a_100000209983_100009814974 [0,2,0,0,0,0|0,0,1]=3 5564 B14R1.37 CCCCCNC(=O)[C@@H]1CCC(=O)O1 1626a_100000209983_100009814974 [0,2,0,0,0,0|0,0,1]=3 5565 B14R1.37 CCCCCNC(=O)[C@@H]1CCC(=O)O1 240690a_100000209983_100009814974 [0,2,0,0,0,0|0,0,1]=3 5566 B14R1.37 CCCCCNC(=O)[C@@H]1CCC(=O)O1 527a_100000209983_100009814974 [0,2,0,0,0,0|0,0,1]=3 5567 B14R1.37 CCCCNNC(=O)[C@@H]1CCC(=O)O1 22a_100025702795_100009814974 [0,2,0,0,0,0|1,0,1]=4 5568 B14R1.37 CCCCOCC(=O)C1CCC(=O)N1 1458a_100000210400_100011995733 [0,2,0,0,0,0|1,0,1]=4 5569 B14R1.37 CCCCOCC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_100011995733 [0,2,0,0,0,0|0,0,1]=3 5570 B14R1.37 CCCOCCC(=O)C1CCC(=O)N1 1458a_100000210400_100011215938 [0,2,0,0,0,0|1,0,1]=4 5571 B14R1.37 CCCOCCC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_100011215938 [0,2,0,0,0,0|0,0,1]=3 5572 B14R1.37 CCOCCCC(=O)C1CCC(=O)N1 1458a_100000210400_100012232248 [0,2,0,0,0,0|1,0,1]=4 5573 B14R1.37 CCOCCCC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_100012232248 [0,2,0,0,0,0|0,0,1]=3 5574 B14R1.37 CCOCCNC(=O)[C@@H]1CCC(=O)O1 11a_100011200944_100009814974 [0,2,0,0,0,0|1,0,1]=4 5575 B14R1.37 CCOCCNC(=O)[C@@H]1CCC(=O)O1 1626a_102516460346_100009814974 [0,2,0,0,0,0|1,0,1]=4 5576 B14R1.37 CCOCCNC(=O)[C@@H]1CCC(=O)O1 240690a_100011200944_100009814974 [0,2,0,0,0,0|1,0,1]=4 5577 B14R1.37 CCOCCNC(=O)[C@@H]1CCC(=O)O1 527a_100011200944_100009814974 [0,2,0,0,0,0|1,0,1]=4 5578 B14R1.37 CCSCCNC(=O)[C@@H]1CCC(=O)O1 11a_100000106463_100009814974 [0,2,0,0,0,0|1,0,1]=4 5579 B14R1.37 CCSCCNC(=O)[C@@H]1CCC(=O)O1 1626a_100000106463_100009814974 [0,2,0,0,0,0|1,0,1]=4 5580 B14R1.37 CCSCCNC(=O)[C@@H]1CCC(=O)O1 240690a_100000106463_100009814974 [0,2,0,0,0,0|1,0,1]=4 5581 B14R1.37 CCSCCNC(=O)[C@@H]1CCC(=O)O1 527a_100000106463_100009814974 [0,2,0,0,0,0|1,0,1]=4 5582 B14R1.37 COCCCCC(=O)C1CCC(=O)N1 1458a_100000210400_100000755781 [0,2,0,0,0,0|1,0,1]=4 5583 B14R1.37 COCCCCC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_100000755781 [0,2,0,0,0,0|0,0,1]=3 5584 B14R1.37 COCCCNC(=O)[C@@H]1CCC(=O)O1 1626a_100150723488_100009814974 [0,2,0,0,0,0|1,0,1]=4 5585 B14R1.37 COCCCNC(=O)[C@@H]1CCC(=O)O1 240690a_100150723488_100009814974 [0,2,0,0,0,0|1,0,1]=4 5586 B14R1.37 COCCCNC(=O)[C@@H]1CCC(=O)O1 527a_100150723488_100009814974 [0,2,0,0,0,0|1,0,1]=4 5587 B14R1.37 CSCCCNC(=O)[C@@H]1CCC(=O)O1 11a_100000749238_100009814974 [0,2,0,0,0,0|1,0,1]=4 5588 B14R1.37 CSCCCNC(=O)[C@@H]1CCC(=O)O1 1626a_100000749238_100009814974 [0,2,0,0,0,0|1,0,1]=4 5589 B14R1.37 CSCCCNC(=O)[C@@H]1CCC(=O)O1 240690a_100000749238_100009814974 [0,2,0,0,0,0|1,0,1]=4 5590 B14R1.37 CSCCCNC(=O)[C@@H]1CCC(=O)O1 527a_100000749238_100009814974 [0,2,0,0,0,0|1,0,1]=4 5591 B14R1.37 N#CCCCCC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_100000211819 [0,2,0,0,0,0|0,0,2]=4 5592 B14R1.37 O=C1CCC(N1)C(=O)CCCCCF 1458a_100000210400_100000729378 [0,2,0,0,0,0|1,0,1]=4 5593 B14R1.37 O=C1CCC(N1)C(=O)CCCCCO 1458a_100000210400_100000746330 [0,2,0,0,0,0|1,0,1]=4 5594 B14R1.37 O=C1CC[C@H](O1)C(=O)CCCCCF 1458a_100009814974_100000729378 [0,2,0,0,0,0|0,0,1]=3 5595 B14R1.37 O=C1CC[C@H](O1)C(=O)CCCCCO 1458a_100009814974_100000746330 [0,2,0,0,0,0|0,0,1]=3 5596 B14R1.37 O=C1CC[C@H](O1)C(=O)CCOCCO 1458a_100009814974_100011215305 [0,2,0,0,0,0|1,0,1]=4 5597 B14R1.37 O=C1CC[C@H](O1)C(=O)NCCCCO 240690a_100000750430_100009814974 [0,2,0,0,0,0|1,0,1]=4 5598 B14R1.37 O=C1CC[C@H](O1)C(=O)NCCCCO 527a_100000750430_100009814974 [0,2,0,0,0,0|1,0,1]=4 5599 B14R1.162 CCC(C)CNC(=O)[C@@H]1CCC(=O)O1 11a_100020588543_100009814974 [0,2,0,0,0,0|1,0,1]=4 5600 B14R1.162 CCC(C)CNC(=O)[C@@H]1CCC(=O)O1 1626a_100020588543_100009814974 [0,2,0,0,0,0|1,0,1]=4 5601 B14R1.162 CCC(C)CNC(=O)[C@@H]1CCC(=O)O1 240690a_100020588543_100009814974 [0,2,0,0,0,0|1,0,1]=4 5602 B14R1.162 CCC(C)CNC(=O)[C@@H]1CCC(=O)O1 527a_100020588543_100009814974 [0,2,0,0,0,0|1,0,1]=4 5603 B14R1.162 CCC(O)CNC(=O)[C@@H]1CCC(=O)O1 11a_100011218483_100009814974 [0,2,0,0,0,0|1,0,1]=4 5604 B14R1.162 CCC(O)CNC(=O)[C@@H]1CCC(=O)O1 240690a_100011218483_100009814974 [0,2,0,0,0,0|1,0,1]=4 5605 B14R1.162 CCC(O)CNC(=O)[C@@H]1CCC(=O)O1 527a_100011218483_100009814974 [0,2,0,0,0,0|1,0,1]=4 5606 B14R1.165 CCCCC(C)C(=O)C1CCC(=O)N1 1458a_100000210400_200011215066 [0,2,0,0,0,0|1,0,1]=4 5607 B14R1.165 CCCCC(C)C(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_200011215066 [0,2,0,0,0,0|0,0,1]=3 5608 B14R1.165 CCCCN(C)C(=O)[C@@H]1CCC(=O)O1 11a_100000207549_100009814974 [0,2,0,0,0,0|1,0,1]=4 5609 B14R1.165 CCCCN(C)C(=O)[C@@H]1CCC(=O)O1 1626a_100000207549_100009814974 [0,2,0,0,0,0|1,0,1]=4 5610 B14R1.165 CCCCN(C)C(=O)[C@@H]1CCC(=O)O1 240690a_100000207549_100009814974 [0,2,0,0,0,0|1,0,1]=4 5611 B14R1.165 CCCCN(C)C(=O)[C@@H]1CCC(=O)O1 527a_100000207549_100009814974 [0,2,0,0,0,0|1,0,1]=4 5612 B14R1.3022 CCCCCC(=O)[C@H]1CCC(=O)N1C 1458a_100010979499_100000210326 [0,2,0,0,0,0|1,0,1]=4 5613 B14R1.4268 CC(=O)CCCC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_100011215641 [0,2,0,0,0,0|0,0,2]=4 5614 B14R1.4268 CC(C)CCCC(=O)C1CCC(=O)N1 1458a_100000210400_100011214892 [0,2,0,0,0,0|1,0,1]=4 5615 B14R1.4268 CC(C)CCCC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_100011214892 [0,2,0,0,0,0|0,0,1]=3 5616 B14R1.4268 CC(C)CCNC(=O)[C@@H]1CCC(=O)O1 11a_100000210545_100009814974 [0,2,0,0,0,0|1,0,1]=4 5617 B14R1.4268 CC(C)CCNC(=O)[C@@H]1CCC(=O)O1 1626a_100000210545_100009814974 [0,2,0,0,0,0|1,0,1]=4 5618 B14R1.4268 CC(C)CCNC(=O)[C@@H]1CCC(=O)O1 240690a_100000210545_100009814974 [0,2,0,0,0,0|1,0,1]=4 5619 B14R1.4268 CC(C)CCNC(=O)[C@@H]1CCC(=O)O1 527a_100000210545_100009814974 [0,2,0,0,0,0|1,0,1]=4 5620 B14R1.4268 CC(C)OCCC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_100000211751 [0,2,0,0,0,0|1,0,1]=4 5621 B14R1.4268 CC(C)SCCC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_100000730970 [0,2,0,0,0,0|1,0,1]=4 5622 B14R1.4268 CC(O)CCCC(=O)C1CCC(=O)N1 1458a_100000210400_200000718107 [0,2,0,0,0,0|1,0,1]=4 5623 B14R1.4268 CC(O)CCCC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_200000718107 [0,2,0,0,0,0|0,0,1]=3 5624 B14R1.4268 CC(O)CCNC(=O)[C@@H]1CCC(=O)O1 240690a_200000755665_100009814974 [0,2,0,0,0,0|1,0,1]=4 5625 B14R1.4268 CC(O)CCNC(=O)[C@@H]1CCC(=O)O1 527a_200000755665_100009814974 [0,2,0,0,0,0|1,0,1]=4 5626 B14R1.4268 CN(C)CCCC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_100000695564 [0,2,0,0,0,0|1,0,1]=4 5627 B14R1.122 C#CCCCCCOC1CCC(=O)C1 34a_100012614533_100012094781 [0,2,0,0,0,0|1,0,1]=4 5628 B14R1.122 C#CCCCCCOC1COC(=O)O1 34a_100000766912_100000032252 [0,2,0,0,0,0|1,0,1]=4 5629 B14R1.122 C#CCCCCCSC1COC(=O)O1 62a_100012094781_100000032252 [0,2,0,0,0,0|1,0,1]=4 5630 B14R1.122 C#CCCCCNCC1CNC(=O)O1 2230a_100000706060_100000181169 [0,2,0,0,0,0|1,0,1]=4 5631 B14R1.122 C#CCCCCNCC1CNC(=O)O1 34a_100000706060_100000181169 [0,2,0,0,0,0|1,0,1]=4 5632 B14R1.122 C#CCCCCNCC1COC(=O)O1 34a_100000706060_100000073702 [0,2,0,0,0,0|1,0,1]=4 5633 B14R1.122 C#CCCCCNC[C@@H]1CCC(=O)N1 2230a_100000706060_100015189358 [0,2,0,0,0,0|1,0,1]=4 5634 B14R1.122 C#CCCCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100010269958 [0,2,0,0,0,0|1,0,1]=4 5635 B14R1.122 C#CCCCCNC[C@H]1CCC(=O)N1 34a_100015423886_100010269958 [0,2,0,0,0,0|1,0,1]=4 5636 B14R1.122 C#CCCCCOCC1CCC(=O)N1 34a_100000737831_100010269958 [0,2,0,0,0,0|1,0,1]=4 5637 B14R1.122 C#CCCCCOCC1CNC(=O)O1 34a_100000766709_100000181169 [0,2,0,0,0,0|1,0,1]=4 5638 B14R1.122 C#CCCCCOCC1CNC(=O)O1 34a_100011315639_100010269958 [0,2,0,0,0,0|1,0,1]=4 5639 B14R1.122 C#CCCCCOCC1CNC(=O)O1 7a_100000766709_100000181169 [0,2,0,0,0,0|1,0,1]=4 5640 B14R1.122 C#CCCCCOCC1COC(=O)O1 34a_100000766709_100000073702 [0,2,0,0,0,0|1,0,1]=4 5641 B14R1.122 C#CCCCCOC[C@@H]1CCC(=O)N1 7a_100000766709_100015189358 [0,2,0,0,0,0|1,0,1]=4 5642 B14R1.122 C#CCCCCSCC1CNC(=O)O1 62a_100000181169_100010269958 [0,2,0,0,0,0|1,0,1]=4 5643 B14R1.122 C#CCCCCSCC1CNC(=O)O1 62a_100010269958_100000181169 [0,2,0,0,0,0|1,0,1]=4 5644 B14R1.122 C#CCCCCSCC1COC(=O)O1 62a_100000073702_100010269958 [0,2,0,0,0,0|1,0,1]=4 5645 B14R1.122 C#CCCCCSCC1COC(=O)O1 62a_100010269958_100000073702 [0,2,0,0,0,0|1,0,1]=4 5646 B14R1.122 C#CCCCCSC[C@@H]1CCC(=O)N1 62a_100010269958_100015189358 [0,2,0,0,0,0|1,0,1]=4 5647 B14R1.122 C#CCCCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100010269958 [0,2,0,0,0,0|1,0,1]=4 5648 B14R1.122 C=CCCCCCOC1CCC(=O)C1 34a_100012614533_100000700193 [0,2,0,0,0,0|1,0,1]=4 5649 B14R1.122 C=CCCCCCOC1COC(=O)O1 34a_100011216702_100000032252 [0,2,0,0,0,0|1,0,1]=4 5650 B14R1.122 C=CCCCCCSC1COC(=O)O1 62a_100000700193_100000032252 [0,2,0,0,0,0|1,0,1]=4 5651 B14R1.122 C=CCCCCNCC1CNC(=O)O1 2230a_100000703577_100000181169 [0,2,0,0,0,0|1,0,1]=4 5652 B14R1.122 C=CCCCCNCC1CNC(=O)O1 34a_100000703577_100000181169 [0,2,0,0,0,0|1,0,1]=4 5653 B14R1.122 C=CCCCCNCC1COC(=O)O1 34a_100000703577_100000073702 [0,2,0,0,0,0|1,0,1]=4 5654 B14R1.122 C=CCCCCNC[C@@H]1CCC(=O)N1 2230a_100000703577_100015189358 [0,2,0,0,0,0|1,0,1]=4 5655 B14R1.122 C=CCCCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100011215482 [0,2,0,0,0,0|1,0,1]=4 5656 B14R1.122 C=CCCCCNC[C@H]1CCC(=O)N1 34a_100015423886_100011215482 [0,2,0,0,0,0|1,0,1]=4 5657 B14R1.122 C=CCCCCOCC1CCC(=O)N1 34a_100000737831_100011215482 [0,2,0,0,0,0|1,0,1]=4 5658 B14R1.122 C=CCCCCOCC1CNC(=O)O1 34a_100000766645_100000181169 [0,2,0,0,0,0|1,0,1]=4 5659 B14R1.122 C=CCCCCOCC1CNC(=O)O1 34a_100011315639_100011215482 [0,2,0,0,0,0|1,0,1]=4 5660 B14R1.122 C=CCCCCOCC1CNC(=O)O1 7a_100000766645_100000181169 [0,2,0,0,0,0|1,0,1]=4 5661 B14R1.122 C=CCCCCOCC1COC(=O)O1 34a_100000766645_100000073702 [0,2,0,0,0,0|1,0,1]=4 5662 B14R1.122 C=CCCCCOC[C@@H]1CCC(=O)N1 7a_100000766645_100015189358 [0,2,0,0,0,0|1,0,1]=4 5663 B14R1.122 C=CCCCCSCC1CNC(=O)O1 62a_100000181169_100011215482 [0,2,0,0,0,0|1,0,1]=4 5664 B14R1.122 C=CCCCCSCC1CNC(=O)O1 62a_100011215482_100000181169 [0,2,0,0,0,0|1,0,1]=4 5665 B14R1.122 C=CCCCCSCC1COC(=O)O1 62a_100000073702_100011215482 [0,2,0,0,0,0|1,0,1]=4 5666 B14R1.122 C=CCCCCSCC1COC(=O)O1 62a_100011215482_100000073702 [0,2,0,0,0,0|1,0,1]=4 5667 B14R1.122 C=CCCCCSC[C@@H]1CCC(=O)N1 62a_100011215482_100015189358 [0,2,0,0,0,0|1,0,1]=4 5668 B14R1.122 C=CCCCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100011215482 [0,2,0,0,0,0|1,0,1]=4 5669 B14R1.122 CC/C=C/CCCOC1COC(=O)O1 34a_100016287902_100000032252 [0,2,0,0,0,0|1,0,1]=4 5670 B14R1.122 CC/C=C\CCNC[C@H]1CCC(=O)N1 2230a_100015423886_100015370543 [0,2,0,0,0,0|1,0,1]=4 5671 B14R1.122 CC/C=C\CCNC[C@H]1CCC(=O)N1 34a_100015423886_100015370543 [0,2,0,0,0,0|1,0,1]=4 5672 B14R1.122 CC/C=C\CCOCC1CCC(=O)N1 34a_100000737831_100015370543 [0,2,0,0,0,0|1,0,1]=4 5673 B14R1.122 CC/C=C\CCOCC1CNC(=O)O1 34a_100011315639_100015370543 [0,2,0,0,0,0|1,0,1]=4 5674 B14R1.122 CC/C=C\CCOCC1CNC(=O)O1 34a_100016288707_100000181169 [0,2,0,0,0,0|1,0,1]=4 5675 B14R1.122 CC/C=C\CCOCC1CNC(=O)O1 7a_100016288707_100000181169 [0,2,0,0,0,0|1,0,1]=4 5676 B14R1.122 CC/C=C\CCOCC1COC(=O)O1 34a_100016288707_100000073702 [0,2,0,0,0,0|1,0,1]=4 5677 B14R1.122 CC/C=C\CCOC[C@@H]1CCC(=O)N1 7a_100016288707_100015189358 [0,2,0,0,0,0|1,0,1]=4 5678 B14R1.122 CC/C=C\CCSCC1CNC(=O)O1 62a_100000181169_100015370543 [0,2,0,0,0,0|1,0,1]=4 5679 B14R1.122 CC/C=C\CCSCC1CNC(=O)O1 62a_100015370543_100000181169 [0,2,0,0,0,0|1,0,1]=4 5680 B14R1.122 CC/C=C\CCSCC1COC(=O)O1 62a_100000073702_100015370543 [0,2,0,0,0,0|1,0,1]=4 5681 B14R1.122 CC/C=C\CCSCC1COC(=O)O1 62a_100015370543_100000073702 [0,2,0,0,0,0|1,0,1]=4 5682 B14R1.122 CC/C=C\CCSC[C@@H]1CCC(=O)N1 62a_100015189358_100015370543 [0,2,0,0,0,0|1,0,1]=4 5683 B14R1.122 CC/C=C\CCSC[C@@H]1CCC(=O)N1 62a_100015370543_100015189358 [0,2,0,0,0,0|1,0,1]=4 5684 B14R1.122 CC=CCCCOCC1CNC(=O)O1 34a_100020645299_100000181169 [0,2,0,0,0,0|1,0,1]=4 5685 B14R1.122 CC=CCCCOCC1COC(=O)O1 34a_100020645299_100000073702 [0,2,0,0,0,0|1,0,1]=4 5686 B14R1.122 CCC#CCCOCC1CNC(=O)O1 34a_100000036655_100000181169 [0,2,0,0,0,0|1,0,1]=4 5687 B14R1.122 CCC#CCCOCC1CNC(=O)O1 7a_100000036655_100000181169 [0,2,0,0,0,0|1,0,1]=4 5688 B14R1.122 CCC#CCCOCC1COC(=O)O1 34a_100000036655_100000073702 [0,2,0,0,0,0|1,0,1]=4 5689 B14R1.122 CCC#CCCOC[C@@H]1CCC(=O)N1 7a_100000036655_100015189358 [0,2,0,0,0,0|1,0,1]=4 5690 B14R1.122 CCC/C=C/COCC1CNC(=O)O1 34a_100016278788_100000181169 [0,2,0,0,0,0|1,0,1]=4 5691 B14R1.122 CCC/C=C/COCC1CNC(=O)O1 7a_100016278788_100000181169 [0,2,0,0,0,0|1,0,1]=4 5692 B14R1.122 CCC/C=C/COCC1COC(=O)O1 34a_100016278788_100000073702 [0,2,0,0,0,0|1,0,1]=4 5693 B14R1.122 CCC/C=C/COC[C@@H]1CCC(=O)N1 7a_100016278788_100015189358 [0,2,0,0,0,0|1,0,1]=4 5694 B14R1.122 CCCC#CCCOC1COC(=O)O1 34a_100000042726_100000032252 [0,2,0,0,0,0|1,0,1]=4 5695 B14R1.122 CCCC#CCOCC1CNC(=O)O1 34a_100000034806_100000181169 [0,2,0,0,0,0|1,0,1]=4 5696 B14R1.122 CCCC#CCOCC1CNC(=O)O1 7a_100000034806_100000181169 [0,2,0,0,0,0|1,0,1]=4 5697 B14R1.122 CCCC#CCOCC1COC(=O)O1 34a_100000034806_100000073702 [0,2,0,0,0,0|1,0,1]=4 5698 B14R1.122 CCCC#CCOC[C@@H]1CCC(=O)N1 7a_100000034806_100015189358 [0,2,0,0,0,0|1,0,1]=4 5699 B14R1.122 CCCC/C=C/COC1COC(=O)O1 34a_200016272032_100000032252 [0,2,0,0,0,0|1,0,1]=4 5700 B14R1.122 CCCCC#CCOC1COC(=O)O1 34a_200000034558_100000032252 [0,2,0,0,0,0|1,0,1]=4 5701 B14R1.122 CCCCCCCNC1CNC(=O)C1 2230a_100000697751_100000210681 [0,2,0,0,0,0|2,0,0]=4 5702 B14R1.122 CCCCCCCOC1CCC(=O)C1 34a_100012614533_100000210614 [0,2,0,0,0,0|1,0,0]=3 5703 B14R1.122 CCCCCCCOC1CNC(=O)C1 34a_100000690082_100000210614 [0,2,0,0,0,0|2,0,0]=4 5704 B14R1.122 CCCCCCCOC1COC(=O)O1 34a_100000210272_100000032252 [0,2,0,0,0,0|1,0,0]=3 5705 B14R1.122 CCCCCCCSC1COC(=O)O1 62a_100000210614_100000032252 [0,2,0,0,0,0|1,0,0]=3 5706 B14R1.122 CCCCCCNCC1CNC(=O)C1 2230a_100016993742_100000210314 [0,2,0,0,0,0|2,0,0]=4 5707 B14R1.122 CCCCCCNCC1CNC(=O)C1 34a_100016993742_100000210314 [0,2,0,0,0,0|2,0,0]=4 5708 B14R1.122 CCCCCCNCC1CNC(=O)O1 2230a_100000210581_100000181169 [0,2,0,0,0,0|1,0,0]=3 5709 B14R1.122 CCCCCCNC[C@@H]1CCC(=O)N1 2230a_100000210581_100015189358 [0,2,0,0,0,0|1,0,0]=3 5710 B14R1.122 CCCCCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000210314 [0,2,0,0,0,0|1,0,0]=3 5711 B14R1.122 CCCCCCNC[C@H]1CCC(=O)N1 34a_100015423886_100000210314 [0,2,0,0,0,0|1,0,0]=3 5712 B14R1.122 CCCCCCNC[C@H]1COC(=O)N1 2230a_100000210581_100015307671 [0,2,0,0,0,0|2,0,0]=4 5713 B14R1.122 CCCCCCOCC1CCC(=O)N1 34a_100000737831_100000210314 [0,2,0,0,0,0|1,0,0]=3 5714 B14R1.122 CCCCCCOCC1CNC(=O)C1 34a_100016041077_100000210314 [0,2,0,0,0,0|2,0,0]=4 5715 B14R1.122 CCCCCCOCC1CNC(=O)O1 34a_100000210259_100000181169 [0,2,0,0,0,0|1,0,0]=3 5716 B14R1.122 CCCCCCOCC1CNC(=O)O1 34a_100011315639_100000210314 [0,2,0,0,0,0|1,0,0]=3 5717 B14R1.122 CCCCCCOCC1CNC(=O)O1 7a_100000210259_100000181169 [0,2,0,0,0,0|1,0,0]=3 5718 B14R1.122 CCCCCCOCC1COC(=O)O1 34a_100000210259_100000073702 [0,2,0,0,0,0|1,0,0]=3 5719 B14R1.122 CCCCCCOC[C@@H]1CCC(=O)N1 7a_100000210259_100015189358 [0,2,0,0,0,0|1,0,0]=3 5720 B14R1.122 CCCCCCOC[C@H]1COC(=O)N1 34a_100000210259_100015307671 [0,2,0,0,0,0|2,0,0]=4 5721 B14R1.122 CCCCCCOC[C@H]1COC(=O)N1 7a_100000210259_100015307671 [0,2,0,0,0,0|2,0,0]=4 5722 B14R1.122 CCCCCCSCC1CNC(=O)O1 62a_100000181169_100000210757 [0,2,0,0,0,0|1,0,0]=3 5723 B14R1.122 CCCCCCSCC1CNC(=O)O1 62a_100000210314_100000181169 [0,2,0,0,0,0|1,0,0]=3 5724 B14R1.122 CCCCCCSCC1COC(=O)O1 62a_100000073702_100000210757 [0,2,0,0,0,0|1,0,0]=3 5725 B14R1.122 CCCCCCSCC1COC(=O)O1 62a_100000210314_100000073702 [0,2,0,0,0,0|1,0,0]=3 5726 B14R1.122 CCCCCCSC[C@@H]1CCC(=O)N1 62a_100000210314_100015189358 [0,2,0,0,0,0|1,0,0]=3 5727 B14R1.122 CCCCCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000210757 [0,2,0,0,0,0|1,0,0]=3 5728 B14R1.122 CCCCCCSC[C@H]1COC(=O)N1 62a_100000210314_100015307671 [0,2,0,0,0,0|2,0,0]=4 5729 B14R1.122 CCCCCCSC[C@H]1COC(=O)N1 62a_100015307671_100000210757 [0,2,0,0,0,0|2,0,0]=4 5730 B14R1.122 CCCCCOCCC1COS(=O)O1 7a_100000210253_100009840081 [0,2,0,0,0,0|2,0,0]=4 5731 B14R1.122 CCCCCSCCC1COS(=O)O1 62a_100000210326_100009840081 [0,2,0,0,0,0|2,0,0]=4 5732 B14R1.122 CCCCOCCNC1CNC(=O)C1 2230a_100000697751_100000743108 [0,2,0,0,0,0|2,0,0]=4 5733 B14R1.122 CCCCOCCOC1CCC(=O)C1 34a_100012614533_100000743108 [0,2,0,0,0,0|1,0,0]=3 5734 B14R1.122 CCCCOCCOC1CNC(=O)C1 34a_100000690082_100000743108 [0,2,0,0,0,0|2,0,0]=4 5735 B14R1.122 CCCCOCCOC1COC(=O)O1 34a_100000210238_100000032252 [0,2,0,0,0,0|1,0,0]=3 5736 B14R1.122 CCCCOCCSC1COC(=O)O1 62a_100000743108_100000032252 [0,2,0,0,0,0|1,0,0]=3 5737 B14R1.122 CCCCOCNCC1CNC(=O)C1 2230a_100016993742_100011995733 [0,2,0,0,0,0|2,0,0]=4 5738 B14R1.122 CCCCOCNCC1CNC(=O)C1 34a_100016993742_100011995733 [0,2,0,0,0,0|2,0,0]=4 5739 B14R1.122 CCCCOCNC[C@H]1CCC(=O)N1 2230a_100015423886_100011995733 [0,2,0,0,0,0|1,0,0]=3 5740 B14R1.122 CCCCOCNC[C@H]1CCC(=O)N1 34a_100015423886_100011995733 [0,2,0,0,0,0|1,0,0]=3 5741 B14R1.122 CCCCOCOCC1CCC(=O)N1 34a_100000737831_100011995733 [0,2,0,0,0,0|1,0,0]=3 5742 B14R1.122 CCCCOCOCC1CNC(=O)C1 34a_100016041077_100011995733 [0,2,0,0,0,0|2,0,0]=4 5743 B14R1.122 CCCCOCOCC1CNC(=O)O1 34a_100011315639_100011995733 [0,2,0,0,0,0|1,0,0]=3 5744 B14R1.122 CCCCOCSCC1CNC(=O)O1 62a_100000181169_100011995733 [0,2,0,0,0,0|1,0,0]=3 5745 B14R1.122 CCCCOCSCC1CNC(=O)O1 62a_100011995733_100000181169 [0,2,0,0,0,0|1,0,0]=3 5746 B14R1.122 CCCCOCSCC1COC(=O)O1 62a_100000073702_100011995733 [0,2,0,0,0,0|1,0,0]=3 5747 B14R1.122 CCCCOCSCC1COC(=O)O1 62a_100011995733_100000073702 [0,2,0,0,0,0|1,0,0]=3 5748 B14R1.122 CCCCOCSC[C@@H]1CCC(=O)N1 62a_100011995733_100015189358 [0,2,0,0,0,0|1,0,0]=3 5749 B14R1.122 CCCCOCSC[C@@H]1CCC(=O)N1 62a_100015189358_100011995733 [0,2,0,0,0,0|1,0,0]=3 5750 B14R1.122 CCCCOCSC[C@H]1COC(=O)N1 62a_100011995733_100015307671 [0,2,0,0,0,0|2,0,0]=4 5751 B14R1.122 CCCCOCSC[C@H]1COC(=O)N1 62a_100015307671_100011995733 [0,2,0,0,0,0|2,0,0]=4 5752 B14R1.122 CCCCSCCOC1COC(=O)O1 34a_200000230436_100000032252 [0,2,0,0,0,0|1,0,0]=3 5753 B14R1.122 CCCOCCCNC1COC(=O)O1 34a_100011217757_100000032252 [0,2,0,0,0,0|1,0,0]=3 5754 B14R1.122 CCCOCCNCC1CNC(=O)C1 2230a_100016993742_100011215938 [0,2,0,0,0,0|2,0,0]=4 5755 B14R1.122 CCCOCCNCC1CNC(=O)C1 34a_100016993742_100011215938 [0,2,0,0,0,0|2,0,0]=4 5756 B14R1.122 CCCOCCNCC1CNC(=O)O1 2230a_100161115042_100000181169 [0,2,0,0,0,0|1,0,0]=3 5757 B14R1.122 CCCOCCNCC1CNC(=O)O1 34a_100161115042_100000181169 [0,2,0,0,0,0|1,0,0]=3 5758 B14R1.122 CCCOCCNCC1COC(=O)O1 34a_100161115042_100000073702 [0,2,0,0,0,0|1,0,0]=3 5759 B14R1.122 CCCOCCNC[C@@H]1CCC(=O)N1 2230a_100161115042_100015189358 [0,2,0,0,0,0|1,0,0]=3 5760 B14R1.122 CCCOCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100011215938 [0,2,0,0,0,0|1,0,0]=3 5761 B14R1.122 CCCOCCNC[C@H]1CCC(=O)N1 34a_100015423886_100011215938 [0,2,0,0,0,0|1,0,0]=3 5762 B14R1.122 CCCOCCNC[C@H]1COC(=O)N1 2230a_100161115042_100015307671 [0,2,0,0,0,0|2,0,0]=4 5763 B14R1.122 CCCOCCNC[C@H]1COC(=O)N1 34a_100161115042_100015307671 [0,2,0,0,0,0|2,0,0]=4 5764 B14R1.122 CCCOCCOCC1CCC(=O)N1 34a_100000737831_100011215938 [0,2,0,0,0,0|1,0,0]=3 5765 B14R1.122 CCCOCCOCC1CNC(=O)C1 34a_100016041077_100011215938 [0,2,0,0,0,0|2,0,0]=4 5766 B14R1.122 CCCOCCOCC1CNC(=O)O1 34a_100000752267_100000181169 [0,2,0,0,0,0|1,0,0]=3 5767 B14R1.122 CCCOCCOCC1CNC(=O)O1 34a_100011315639_100011215938 [0,2,0,0,0,0|1,0,0]=3 5768 B14R1.122 CCCOCCOCC1CNC(=O)O1 7a_100000752267_100000181169 [0,2,0,0,0,0|1,0,0]=3 5769 B14R1.122 CCCOCCOCC1COC(=O)O1 34a_100000752267_100000073702 [0,2,0,0,0,0|1,0,0]=3 5770 B14R1.122 CCCOCCOC[C@@H]1CCC(=O)N1 7a_100000752267_100015189358 [0,2,0,0,0,0|1,0,0]=3 5771 B14R1.122 CCCOCCOC[C@H]1COC(=O)N1 34a_100000752267_100015307671 [0,2,0,0,0,0|2,0,0]=4 5772 B14R1.122 CCCOCCOC[C@H]1COC(=O)N1 7a_100000752267_100015307671 [0,2,0,0,0,0|2,0,0]=4 5773 B14R1.122 CCCOCCSCC1CNC(=O)O1 62a_100000181169_100011215938 [0,2,0,0,0,0|1,0,0]=3 5774 B14R1.122 CCCOCCSCC1CNC(=O)O1 62a_100011215938_100000181169 [0,2,0,0,0,0|1,0,0]=3 5775 B14R1.122 CCCOCCSCC1COC(=O)O1 62a_100000073702_100011215938 [0,2,0,0,0,0|1,0,0]=3 5776 B14R1.122 CCCOCCSCC1COC(=O)O1 62a_100011215938_100000073702 [0,2,0,0,0,0|1,0,0]=3 5777 B14R1.122 CCCOCCSC[C@@H]1CCC(=O)N1 62a_100011215938_100015189358 [0,2,0,0,0,0|1,0,0]=3 5778 B14R1.122 CCCOCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100011215938 [0,2,0,0,0,0|1,0,0]=3 5779 B14R1.122 CCCOCCSC[C@H]1COC(=O)N1 62a_100011215938_100015307671 [0,2,0,0,0,0|2,0,0]=4 5780 B14R1.122 CCCOCCSC[C@H]1COC(=O)N1 62a_100015307671_100011215938 [0,2,0,0,0,0|2,0,0]=4 5781 B14R1.122 CCCSCCNCC1CNC(=O)O1 2230a_100020603323_100000181169 [0,2,0,0,0,0|1,0,0]=3 5782 B14R1.122 CCCSCCNC[C@@H]1CCC(=O)N1 2230a_100020603323_100015189358 [0,2,0,0,0,0|1,0,0]=3 5783 B14R1.122 CCCSCCNC[C@H]1COC(=O)N1 2230a_100020603323_100015307671 [0,2,0,0,0,0|2,0,0]=4 5784 B14R1.122 CCCSCCOCC1CNC(=O)O1 34a_200000230433_100000181169 [0,2,0,0,0,0|1,0,0]=3 5785 B14R1.122 CCCSCCOCC1CNC(=O)O1 7a_200000230433_100000181169 [0,2,0,0,0,0|1,0,0]=3 5786 B14R1.122 CCCSCCOCC1COC(=O)O1 34a_200000230433_100000073702 [0,2,0,0,0,0|1,0,0]=3 5787 B14R1.122 CCCSCCOC[C@@H]1CCC(=O)N1 7a_200000230433_100015189358 [0,2,0,0,0,0|1,0,0]=3 5788 B14R1.122 CCCSCCOC[C@H]1COC(=O)N1 34a_200000230433_100015307671 [0,2,0,0,0,0|2,0,0]=4 5789 B14R1.122 CCCSCCOC[C@H]1COC(=O)N1 7a_200000230433_100015307671 [0,2,0,0,0,0|2,0,0]=4 5790 B14R1.122 CCOCCCNCC1CNC(=O)C1 2230a_100016993742_100012232248 [0,2,0,0,0,0|2,0,0]=4 5791 B14R1.122 CCOCCCNCC1CNC(=O)C1 34a_100016993742_100012232248 [0,2,0,0,0,0|2,0,0]=4 5792 B14R1.122 CCOCCCNCC1CNC(=O)O1 2230a_100000210961_100000181169 [0,2,0,0,0,0|1,0,0]=3 5793 B14R1.122 CCOCCCNCC1CNC(=O)O1 34a_100000210961_100000181169 [0,2,0,0,0,0|1,0,0]=3 5794 B14R1.122 CCOCCCNCC1COC(=O)O1 34a_100000210961_100000073702 [0,2,0,0,0,0|1,0,0]=3 5795 B14R1.122 CCOCCCNC[C@@H]1CCC(=O)N1 2230a_100000210961_100015189358 [0,2,0,0,0,0|1,0,0]=3 5796 B14R1.122 CCOCCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100012232248 [0,2,0,0,0,0|1,0,0]=3 5797 B14R1.122 CCOCCCNC[C@H]1CCC(=O)N1 34a_100015423886_100012232248 [0,2,0,0,0,0|1,0,0]=3 5798 B14R1.122 CCOCCCNC[C@H]1COC(=O)N1 2230a_100000210961_100015307671 [0,2,0,0,0,0|2,0,0]=4 5799 B14R1.122 CCOCCCNC[C@H]1COC(=O)N1 34a_100000210961_100015307671 [0,2,0,0,0,0|2,0,0]=4 5800 B14R1.122 CCOCCCOCC1CCC(=O)N1 34a_100000737831_100012232248 [0,2,0,0,0,0|1,0,0]=3 5801 B14R1.122 CCOCCCOCC1CNC(=O)C1 34a_100016041077_100012232248 [0,2,0,0,0,0|2,0,0]=4 5802 B14R1.122 CCOCCCOCC1CNC(=O)O1 34a_100000757476_100000181169 [0,2,0,0,0,0|1,0,0]=3 5803 B14R1.122 CCOCCCOCC1CNC(=O)O1 34a_100011315639_100012232248 [0,2,0,0,0,0|1,0,0]=3 5804 B14R1.122 CCOCCCOCC1CNC(=O)O1 7a_100000757476_100000181169 [0,2,0,0,0,0|1,0,0]=3 5805 B14R1.122 CCOCCCOCC1COC(=O)O1 34a_100000757476_100000073702 [0,2,0,0,0,0|1,0,0]=3 5806 B14R1.122 CCOCCCOC[C@@H]1CCC(=O)N1 7a_100000757476_100015189358 [0,2,0,0,0,0|1,0,0]=3 5807 B14R1.122 CCOCCCOC[C@H]1COC(=O)N1 34a_100000757476_100015307671 [0,2,0,0,0,0|2,0,0]=4 5808 B14R1.122 CCOCCCOC[C@H]1COC(=O)N1 7a_100000757476_100015307671 [0,2,0,0,0,0|2,0,0]=4 5809 B14R1.122 CCOCCCSCC1CNC(=O)O1 62a_100000181169_100012232248 [0,2,0,0,0,0|1,0,0]=3 5810 B14R1.122 CCOCCCSCC1CNC(=O)O1 62a_100012232248_100000181169 [0,2,0,0,0,0|1,0,0]=3 5811 B14R1.122 CCOCCCSCC1COC(=O)O1 62a_100000073702_100012232248 [0,2,0,0,0,0|1,0,0]=3 5812 B14R1.122 CCOCCCSCC1COC(=O)O1 62a_100012232248_100000073702 [0,2,0,0,0,0|1,0,0]=3 5813 B14R1.122 CCOCCCSC[C@@H]1CCC(=O)N1 62a_100012232248_100015189358 [0,2,0,0,0,0|1,0,0]=3 5814 B14R1.122 CCOCCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100012232248 [0,2,0,0,0,0|1,0,0]=3 5815 B14R1.122 CCOCCCSC[C@H]1COC(=O)N1 62a_100012232248_100015307671 [0,2,0,0,0,0|2,0,0]=4 5816 B14R1.122 CCOCCCSC[C@H]1COC(=O)N1 62a_100015307671_100012232248 [0,2,0,0,0,0|2,0,0]=4 5817 B14R1.122 CCOCCOCCC1COS(=O)O1 7a_100000210136_100009840081 [0,2,0,0,0,0|2,0,0]=4 5818 B14R1.122 CCOCCSCCC1COS(=O)O1 62a_100000210147_100009840081 [0,2,0,0,0,0|2,0,0]=4 5819 B14R1.122 CCSCCCOCC1CNC(=O)O1 34a_100011216438_100000181169 [0,2,0,0,0,0|1,0,0]=3 5820 B14R1.122 CCSCCCOCC1CNC(=O)O1 7a_100011216438_100000181169 [0,2,0,0,0,0|1,0,0]=3 5821 B14R1.122 CCSCCCOCC1COC(=O)O1 34a_100011216438_100000073702 [0,2,0,0,0,0|1,0,0]=3 5822 B14R1.122 CCSCCCOC[C@@H]1CCC(=O)N1 7a_100011216438_100015189358 [0,2,0,0,0,0|1,0,0]=3 5823 B14R1.122 CCSCCCOC[C@H]1COC(=O)N1 34a_100011216438_100015307671 [0,2,0,0,0,0|2,0,0]=4 5824 B14R1.122 CCSCCCOC[C@H]1COC(=O)N1 7a_100011216438_100015307671 [0,2,0,0,0,0|2,0,0]=4 5825 B14R1.122 CCSCCOCCC1COS(=O)O1 7a_100000212035_100009840081 [0,2,0,0,0,0|2,0,0]=4 5826 B14R1.122 CCSCCSCCC1COS(=O)O1 62a_100000757381_100009840081 [0,2,0,0,0,0|2,0,0]=4 5827 B14R1.122 CNCCCCCOC1COC(=O)O1 34a_100000722520_100000032252 [0,2,0,0,0,0|1,0,0]=3 5828 B14R1.122 CNCCOCCOC1COC(=O)O1 34a_100000228057_100000032252 [0,2,0,0,0,0|2,0,0]=4 5829 B14R1.122 COCCCCCNC1COC(=O)O1 34a_100000747528_100000032252 [0,2,0,0,0,0|1,0,0]=3 5830 B14R1.122 COCCCCNCC1CNC(=O)C1 2230a_100016993742_100000730899 [0,2,0,0,0,0|2,0,0]=4 5831 B14R1.122 COCCCCNCC1CNC(=O)C1 34a_100016993742_100000755781 [0,2,0,0,0,0|2,0,0]=4 5832 B14R1.122 COCCCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000730899 [0,2,0,0,0,0|1,0,0]=3 5833 B14R1.122 COCCCCNC[C@H]1CCC(=O)N1 34a_100015423886_100000755781 [0,2,0,0,0,0|1,0,0]=3 5834 B14R1.122 COCCCCOCC1CCC(=O)N1 34a_100000737831_100000755781 [0,2,0,0,0,0|1,0,0]=3 5835 B14R1.122 COCCCCOCC1CNC(=O)C1 34a_100016041077_100000755781 [0,2,0,0,0,0|2,0,0]=4 5836 B14R1.122 COCCCCOCC1CNC(=O)O1 34a_100000740925_100000181169 [0,2,0,0,0,0|1,0,0]=3 5837 B14R1.122 COCCCCOCC1CNC(=O)O1 34a_100011315639_100000755781 [0,2,0,0,0,0|1,0,0]=3 5838 B14R1.122 COCCCCOCC1COC(=O)O1 34a_100000740925_100000073702 [0,2,0,0,0,0|1,0,0]=3 5839 B14R1.122 COCCCCOC[C@H]1COC(=O)N1 34a_100000740925_100015307671 [0,2,0,0,0,0|2,0,0]=4 5840 B14R1.122 COCCCCSCC1CNC(=O)O1 62a_100000181169_100000730899 [0,2,0,0,0,0|1,0,0]=3 5841 B14R1.122 COCCCCSCC1CNC(=O)O1 62a_100000730899_100000181169 [0,2,0,0,0,0|1,0,0]=3 5842 B14R1.122 COCCCCSCC1COC(=O)O1 62a_100000073702_100000730899 [0,2,0,0,0,0|1,0,0]=3 5843 B14R1.122 COCCCCSCC1COC(=O)O1 62a_100000730899_100000073702 [0,2,0,0,0,0|1,0,0]=3 5844 B14R1.122 COCCCCSC[C@@H]1CCC(=O)N1 62a_100000730899_100015189358 [0,2,0,0,0,0|1,0,0]=3 5845 B14R1.122 COCCCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000730899 [0,2,0,0,0,0|1,0,0]=3 5846 B14R1.122 COCCCCSC[C@H]1COC(=O)N1 62a_100000730899_100015307671 [0,2,0,0,0,0|2,0,0]=4 5847 B14R1.122 COCCCCSC[C@H]1COC(=O)N1 62a_100015307671_100000730899 [0,2,0,0,0,0|2,0,0]=4 5848 B14R1.122 COCCCSCCC1COS(=O)O1 62a_100000709357_100009840081 [0,2,0,0,0,0|2,0,0]=4 5849 B14R1.122 COCCOCCNC1COC(=O)O1 34a_100000745349_100000032252 [0,2,0,0,0,0|2,0,0]=4 5850 B14R1.122 COCCOCCOC1CCC(=O)C1 34a_100012614533_100000695917 [0,2,0,0,0,0|2,0,0]=4 5851 B14R1.122 COCCOCCOC1COC(=O)O1 34a_100011215163_100000032252 [0,2,0,0,0,0|2,0,0]=4 5852 B14R1.122 COCCOCCSC1COC(=O)O1 62a_100000695917_100000032252 [0,2,0,0,0,0|2,0,0]=4 5853 B14R1.122 COCCOCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000231047 [0,2,0,0,0,0|2,0,0]=4 5854 B14R1.122 COCCOCSCC1CNC(=O)O1 62a_100000181169_100000231047 [0,2,0,0,0,0|2,0,0]=4 5855 B14R1.122 COCCOCSCC1CNC(=O)O1 62a_100000231047_100000181169 [0,2,0,0,0,0|2,0,0]=4 5856 B14R1.122 COCCOCSCC1COC(=O)O1 62a_100000073702_100000231047 [0,2,0,0,0,0|2,0,0]=4 5857 B14R1.122 COCCOCSCC1COC(=O)O1 62a_100000231047_100000073702 [0,2,0,0,0,0|2,0,0]=4 5858 B14R1.122 COCCOCSC[C@@H]1CCC(=O)N1 62a_100000231047_100015189358 [0,2,0,0,0,0|2,0,0]=4 5859 B14R1.122 COCCOCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000231047 [0,2,0,0,0,0|2,0,0]=4 5860 B14R1.122 CSCCCCOCC1CNC(=O)O1 34a_100011217163_100000181169 [0,2,0,0,0,0|1,0,0]=3 5861 B14R1.122 CSCCCCOCC1CNC(=O)O1 7a_100011217163_100000181169 [0,2,0,0,0,0|1,0,0]=3 5862 B14R1.122 CSCCCCOCC1COC(=O)O1 34a_100011217163_100000073702 [0,2,0,0,0,0|1,0,0]=3 5863 B14R1.122 CSCCCCOC[C@@H]1CCC(=O)N1 7a_100011217163_100015189358 [0,2,0,0,0,0|1,0,0]=3 5864 B14R1.122 CSCCCCOC[C@H]1COC(=O)N1 34a_100011217163_100015307671 [0,2,0,0,0,0|2,0,0]=4 5865 B14R1.122 CSCCCCOC[C@H]1COC(=O)N1 7a_100011217163_100015307671 [0,2,0,0,0,0|2,0,0]=4 5866 B14R1.122 CSCCCOCCC1COS(=O)O1 7a_100000690336_100009840081 [0,2,0,0,0,0|2,0,0]=4 5867 B14R1.122 N#CCCCCCSC1COC(=O)O1 62a_100009813376_100000032252 [0,2,0,0,0,0|1,0,1]=4 5868 B14R1.122 N#CCCCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000211819 [0,2,0,0,0,0|1,0,1]=4 5869 B14R1.122 N#CCCCCSCC1CNC(=O)O1 62a_100000181169_100000211819 [0,2,0,0,0,0|1,0,1]=4 5870 B14R1.122 N#CCCCCSCC1CNC(=O)O1 62a_100011219923_100000181169 [0,2,0,0,0,0|1,0,1]=4 5871 B14R1.122 N#CCCCCSCC1COC(=O)O1 62a_100000073702_100000211819 [0,2,0,0,0,0|1,0,1]=4 5872 B14R1.122 N#CCCCCSCC1COC(=O)O1 62a_100011219923_100000073702 [0,2,0,0,0,0|1,0,1]=4 5873 B14R1.122 N#CCCCCSC[C@@H]1CCC(=O)N1 62a_100011219923_100015189358 [0,2,0,0,0,0|1,0,1]=4 5874 B14R1.122 N#CCCCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000211819 [0,2,0,0,0,0|1,0,1]=4 5875 B14R1.122 NCCCCCCOC1COC(=O)O1 34a_100000686447_100000032252 [0,2,0,0,0,0|1,0,0]=3 5876 B14R1.122 NCCCCCOCC1CNC(=O)O1 34a_100000762737_100000181169 [0,2,0,0,0,0|1,0,0]=3 5877 B14R1.122 NCCCCCOCC1COC(=O)O1 34a_100000762737_100000073702 [0,2,0,0,0,0|1,0,0]=3 5878 B14R1.122 NCCCCCOC[C@H]1COC(=O)N1 34a_100000762737_100015307671 [0,2,0,0,0,0|2,0,0]=4 5879 B14R1.122 NCCOCCOCC1CNC(=O)O1 34a_100000211614_100000181169 [0,2,0,0,0,0|2,0,0]=4 5880 B14R1.122 NCCOCCOCC1COC(=O)O1 34a_100000211614_100000073702 [0,2,0,0,0,0|2,0,0]=4 5881 B14R1.122 O=C1CC(CN1)CNCCCCCF 2230a_100016993742_100000729378 [0,2,0,0,0,0|2,0,0]=4 5882 B14R1.122 O=C1CC(CN1)CNCCCCCF 34a_100016993742_100000729378 [0,2,0,0,0,0|2,0,0]=4 5883 B14R1.122 O=C1CC(CN1)CNCCCCCO 2230a_100016993742_100000746330 [0,2,0,0,0,0|2,0,0]=4 5884 B14R1.122 O=C1CC(CN1)CNCCCCCO 34a_100016993742_100000746330 [0,2,0,0,0,0|2,0,0]=4 5885 B14R1.122 O=C1CC(CN1)COCCCCCF 34a_100016041077_100000729378 [0,2,0,0,0,0|2,0,0]=4 5886 B14R1.122 O=C1CC(CN1)COCCCCCO 34a_100016041077_100000746330 [0,2,0,0,0,0|2,0,0]=4 5887 B14R1.122 O=C1CC(CN1)NCCCCCCF 2230a_100000697751_100015922095 [0,2,0,0,0,0|2,0,0]=4 5888 B14R1.122 O=C1CC(CN1)NCCCCCCO 2230a_100000697751_100000766143 [0,2,0,0,0,0|2,0,0]=4 5889 B14R1.122 O=C1CC(CN1)OCCCCCCF 34a_100000690082_100015922095 [0,2,0,0,0,0|2,0,0]=4 5890 B14R1.122 O=C1CC(CN1)OCCCCCCO 34a_100000690082_100000766143 [0,2,0,0,0,0|2,0,0]=4 5891 B14R1.122 O=C1CCC(C1)OCCCCCCF 34a_100012614533_100015922095 [0,2,0,0,0,0|1,0,0]=3 5892 B14R1.122 O=C1CCC(C1)OCCCCCCO 34a_100012614533_100000766143 [0,2,0,0,0,0|1,0,0]=3 5893 B14R1.122 O=C1CCC(N1)COCCCCCF 34a_100000737831_100000729378 [0,2,0,0,0,0|1,0,0]=3 5894 B14R1.122 O=C1CCC(N1)COCCCCCO 34a_100000737831_100000746330 [0,2,0,0,0,0|1,0,0]=3 5895 B14R1.122 O=C1CCC(N1)COCCOCCO 34a_100000737831_100000692535 [0,2,0,0,0,0|2,0,0]=4 5896 B14R1.122 O=C1CC[C@@H](N1)CNCCCCCF 2230a_100015423886_100000729378 [0,2,0,0,0,0|1,0,0]=3 5897 B14R1.122 O=C1CC[C@@H](N1)CNCCCCCF 34a_100015423886_100000729378 [0,2,0,0,0,0|1,0,0]=3 5898 B14R1.122 O=C1CC[C@@H](N1)CNCCCCCO 2230a_100015423886_100000746330 [0,2,0,0,0,0|1,0,0]=3 5899 B14R1.122 O=C1CC[C@@H](N1)CNCCCCCO 34a_100015423886_100000746330 [0,2,0,0,0,0|1,0,0]=3 5900 B14R1.122 O=C1CC[C@@H](N1)CNCCOCCO 2230a_100015423886_100011215305 [0,2,0,0,0,0|2,0,0]=4 5901 B14R1.122 O=C1CC[C@@H](N1)CNCCOCCO 34a_100015423886_100000692535 [0,2,0,0,0,0|2,0,0]=4 5902 B14R1.122 O=C1CC[C@H](N1)CNCCCCCO 2230a_100000762737_100015189358 [0,2,0,0,0,0|1,0,0]=3 5903 B14R1.122 O=C1CC[C@H](N1)CNCCOCCO 2230a_100000211614_100015189358 [0,2,0,0,0,0|2,0,0]=4 5904 B14R1.122 O=C1CC[C@H](N1)CNCCSCCO 2230a_100011219999_100015189358 [0,2,0,0,0,0|2,0,0]=4 5905 B14R1.122 O=C1CC[C@H](N1)COCCCCCBr 7a_100000746331_100015189358 [0,2,0,0,0,0|1,0,0]=3 5906 B14R1.122 O=C1CC[C@H](N1)COCCCCCCl 7a_100000746330_100015189358 [0,2,0,0,0,0|1,0,0]=3 5907 B14R1.122 O=C1CC[C@H](N1)COCCCCCI 7a_200012148887_100015189358 [0,2,0,0,0,0|1,0,0]=3 5908 B14R1.122 O=C1CC[C@H](N1)COCCOCCBr 7a_100000692535_100015189358 [0,2,0,0,0,0|2,0,0]=4 5909 B14R1.122 O=C1CC[C@H](N1)COCCOCCCl 7a_100011215305_100015189358 [0,2,0,0,0,0|2,0,0]=4 5910 B14R1.122 O=C1CC[C@H](N1)COCCOCCF 7a_200015357709_100015189358 [0,2,0,0,0,0|2,0,0]=4 5911 B14R1.122 O=C1CC[C@H](N1)COCCOCCI 7a_100012149058_100015189358 [0,2,0,0,0,0|2,0,0]=4 5912 B14R1.122 O=C1CC[C@H](N1)CSCCCCCF 62a_100000729378_100015189358 [0,2,0,0,0,0|1,0,0]=3 5913 B14R1.122 O=C1CC[C@H](N1)CSCCCCCF 62a_100015189358_100000729378 [0,2,0,0,0,0|1,0,0]=3 5914 B14R1.122 O=C1CC[C@H](N1)CSCCCCCO 62a_100000746330_100015189358 [0,2,0,0,0,0|1,0,0]=3 5915 B14R1.122 O=C1CC[C@H](N1)CSCCCCCO 62a_100015189358_100000746330 [0,2,0,0,0,0|1,0,0]=3 5916 B14R1.122 O=C1CC[C@H](N1)CSCCOCCO 62a_100011215305_100015189358 [0,2,0,0,0,0|2,0,0]=4 5917 B14R1.122 O=C1CC[C@H](N1)CSCCOCCO 62a_100015189358_100011215305 [0,2,0,0,0,0|2,0,0]=4 5918 B14R1.122 O=C1NCC(O1)CNCCCCCO 2230a_100000762737_100000181169 [0,2,0,0,0,0|1,0,0]=3 5919 B14R1.122 O=C1NCC(O1)CNCCCCCO 34a_100000762737_100000181169 [0,2,0,0,0,0|1,0,0]=3 5920 B14R1.122 O=C1NCC(O1)CNCCOCCO 2230a_100000211614_100000181169 [0,2,0,0,0,0|2,0,0]=4 5921 B14R1.122 O=C1NCC(O1)CNCCOCCO 34a_100000211614_100000181169 [0,2,0,0,0,0|2,0,0]=4 5922 B14R1.122 O=C1NCC(O1)CNCCSCCO 2230a_100011219999_100000181169 [0,2,0,0,0,0|2,0,0]=4 5923 B14R1.122 O=C1NCC(O1)COCCCCCBr 34a_100000746331_100000181169 [0,2,0,0,0,0|1,0,0]=3 5924 B14R1.122 O=C1NCC(O1)COCCCCCBr 7a_100000746331_100000181169 [0,2,0,0,0,0|1,0,0]=3 5925 B14R1.122 O=C1NCC(O1)COCCCCCCl 34a_100000746330_100000181169 [0,2,0,0,0,0|1,0,0]=3 5926 B14R1.122 O=C1NCC(O1)COCCCCCCl 7a_100000746330_100000181169 [0,2,0,0,0,0|1,0,0]=3 5927 B14R1.122 O=C1NCC(O1)COCCCCCF 34a_100011315639_100000729378 [0,2,0,0,0,0|1,0,0]=3 5928 B14R1.122 O=C1NCC(O1)COCCCCCI 34a_200012148887_100000181169 [0,2,0,0,0,0|1,0,0]=3 5929 B14R1.122 O=C1NCC(O1)COCCCCCI 7a_200012148887_100000181169 [0,2,0,0,0,0|1,0,0]=3 5930 B14R1.122 O=C1NCC(O1)COCCCCCO 34a_100011315639_100000746330 [0,2,0,0,0,0|1,0,0]=3 5931 B14R1.122 O=C1NCC(O1)COCCOCCBr 34a_100000692535_100000181169 [0,2,0,0,0,0|2,0,0]=4 5932 B14R1.122 O=C1NCC(O1)COCCOCCBr 7a_100000692535_100000181169 [0,2,0,0,0,0|2,0,0]=4 5933 B14R1.122 O=C1NCC(O1)COCCOCCCl 34a_100011215305_100000181169 [0,2,0,0,0,0|2,0,0]=4 5934 B14R1.122 O=C1NCC(O1)COCCOCCCl 7a_100011215305_100000181169 [0,2,0,0,0,0|2,0,0]=4 5935 B14R1.122 O=C1NCC(O1)COCCOCCF 34a_200015357709_100000181169 [0,2,0,0,0,0|2,0,0]=4 5936 B14R1.122 O=C1NCC(O1)COCCOCCF 7a_200015357709_100000181169 [0,2,0,0,0,0|2,0,0]=4 5937 B14R1.122 O=C1NCC(O1)COCCOCCI 34a_100012149058_100000181169 [0,2,0,0,0,0|2,0,0]=4 5938 B14R1.122 O=C1NCC(O1)COCCOCCI 7a_100012149058_100000181169 [0,2,0,0,0,0|2,0,0]=4 5939 B14R1.122 O=C1NCC(O1)COCCOCCO 34a_100011315639_100000692535 [0,2,0,0,0,0|2,0,0]=4 5940 B14R1.122 O=C1NCC(O1)CSCCCCCF 62a_100000181169_100000729378 [0,2,0,0,0,0|1,0,0]=3 5941 B14R1.122 O=C1NCC(O1)CSCCCCCF 62a_100000729378_100000181169 [0,2,0,0,0,0|1,0,0]=3 5942 B14R1.122 O=C1NCC(O1)CSCCCCCO 62a_100000181169_100000746330 [0,2,0,0,0,0|1,0,0]=3 5943 B14R1.122 O=C1NCC(O1)CSCCCCCO 62a_100000746330_100000181169 [0,2,0,0,0,0|1,0,0]=3 5944 B14R1.122 O=C1NCC(O1)CSCCOCCO 62a_100000181169_100011215305 [0,2,0,0,0,0|2,0,0]=4 5945 B14R1.122 O=C1NCC(O1)CSCCOCCO 62a_100011215305_100000181169 [0,2,0,0,0,0|2,0,0]=4 5946 B14R1.122 O=C1N[C@H](CO1)CNCCCCCO 2230a_100000762737_100015307671 [0,2,0,0,0,0|2,0,0]=4 5947 B14R1.122 O=C1N[C@H](CO1)CNCCCCCO 34a_100000762737_100015307671 [0,2,0,0,0,0|2,0,0]=4 5948 B14R1.122 O=C1N[C@H](CO1)COCCCCCBr 34a_100000746331_100015307671 [0,2,0,0,0,0|2,0,0]=4 5949 B14R1.122 O=C1N[C@H](CO1)COCCCCCBr 7a_100000746331_100015307671 [0,2,0,0,0,0|2,0,0]=4 5950 B14R1.122 O=C1N[C@H](CO1)COCCCCCCl 34a_100000746330_100015307671 [0,2,0,0,0,0|2,0,0]=4 5951 B14R1.122 O=C1N[C@H](CO1)COCCCCCCl 7a_100000746330_100015307671 [0,2,0,0,0,0|2,0,0]=4 5952 B14R1.122 O=C1N[C@H](CO1)COCCCCCI 34a_200012148887_100015307671 [0,2,0,0,0,0|2,0,0]=4 5953 B14R1.122 O=C1N[C@H](CO1)COCCCCCI 7a_200012148887_100015307671 [0,2,0,0,0,0|2,0,0]=4 5954 B14R1.122 O=C1N[C@H](CO1)CSCCCCCF 62a_100000729378_100015307671 [0,2,0,0,0,0|2,0,0]=4 5955 B14R1.122 O=C1N[C@H](CO1)CSCCCCCF 62a_100015307671_100000729378 [0,2,0,0,0,0|2,0,0]=4 5956 B14R1.122 O=C1N[C@H](CO1)CSCCCCCO 62a_100000746330_100015307671 [0,2,0,0,0,0|2,0,0]=4 5957 B14R1.122 O=C1N[C@H](CO1)CSCCCCCO 62a_100015307671_100000746330 [0,2,0,0,0,0|2,0,0]=4 5958 B14R1.122 O=C1OCC(O1)CNCCCCCO 34a_100000762737_100000073702 [0,2,0,0,0,0|1,0,0]=3 5959 B14R1.122 O=C1OCC(O1)CNCCOCCO 34a_100000211614_100000073702 [0,2,0,0,0,0|2,0,0]=4 5960 B14R1.122 O=C1OCC(O1)COCCCCCBr 34a_100000746331_100000073702 [0,2,0,0,0,0|1,0,0]=3 5961 B14R1.122 O=C1OCC(O1)COCCCCCCl 34a_100000746330_100000073702 [0,2,0,0,0,0|1,0,0]=3 5962 B14R1.122 O=C1OCC(O1)COCCCCCI 34a_200012148887_100000073702 [0,2,0,0,0,0|1,0,0]=3 5963 B14R1.122 O=C1OCC(O1)COCCOCCBr 34a_100000692535_100000073702 [0,2,0,0,0,0|2,0,0]=4 5964 B14R1.122 O=C1OCC(O1)COCCOCCCl 34a_100011215305_100000073702 [0,2,0,0,0,0|2,0,0]=4 5965 B14R1.122 O=C1OCC(O1)COCCOCCF 34a_200015357709_100000073702 [0,2,0,0,0,0|2,0,0]=4 5966 B14R1.122 O=C1OCC(O1)COCCOCCI 34a_100012149058_100000073702 [0,2,0,0,0,0|2,0,0]=4 5967 B14R1.122 O=C1OCC(O1)CSCCCCCF 62a_100000073702_100000729378 [0,2,0,0,0,0|1,0,0]=3 5968 B14R1.122 O=C1OCC(O1)CSCCCCCF 62a_100000729378_100000073702 [0,2,0,0,0,0|1,0,0]=3 5969 B14R1.122 O=C1OCC(O1)CSCCCCCO 62a_100000073702_100000746330 [0,2,0,0,0,0|1,0,0]=3 5970 B14R1.122 O=C1OCC(O1)CSCCCCCO 62a_100000746330_100000073702 [0,2,0,0,0,0|1,0,0]=3 5971 B14R1.122 O=C1OCC(O1)CSCCOCCO 62a_100000073702_100011215305 [0,2,0,0,0,0|2,0,0]=4 5972 B14R1.122 O=C1OCC(O1)CSCCOCCO 62a_100011215305_100000073702 [0,2,0,0,0,0|2,0,0]=4 5973 B14R1.122 O=C1OCC(O1)NCCCCCCO 34a_100000686447_100000032252 [0,2,0,0,0,0|1,0,0]=3 5974 B14R1.122 O=C1OCC(O1)OCCCCCCBr 34a_100011215345_100000032252 [0,2,0,0,0,0|1,0,0]=3 5975 B14R1.122 O=C1OCC(O1)OCCCCCCCl 34a_100000766143_100000032252 [0,2,0,0,0,0|1,0,0]=3 5976 B14R1.122 O=C1OCC(O1)OCCCCCCF 34a_100000732779_100000032252 [0,2,0,0,0,0|1,0,0]=3 5977 B14R1.122 O=C1OCC(O1)SCCCCCCF 62a_100015922095_100000032252 [0,2,0,0,0,0|1,0,0]=3 5978 B14R1.122 O=C1OCC(O1)SCCCCCCO 62a_100000766143_100000032252 [0,2,0,0,0,0|1,0,0]=3 5979 B14R1.122 O=CCCCCCSC1COC(=O)O1 62a_100000139337_100000032252 [0,2,0,0,0,0|1,0,1]=4 5980 B14R1.122 O=CCCCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000139335 [0,2,0,0,0,0|1,0,1]=4 5981 B14R1.122 O=CCCCCSCC1CNC(=O)O1 62a_100000139335_100000181169 [0,2,0,0,0,0|1,0,1]=4 5982 B14R1.122 O=CCCCCSCC1CNC(=O)O1 62a_100000181169_100000139335 [0,2,0,0,0,0|1,0,1]=4 5983 B14R1.122 O=CCCCCSCC1COC(=O)O1 62a_100000073702_100000139335 [0,2,0,0,0,0|1,0,1]=4 5984 B14R1.122 O=CCCCCSCC1COC(=O)O1 62a_100000139335_100000073702 [0,2,0,0,0,0|1,0,1]=4 5985 B14R1.122 O=CCCCCSC[C@@H]1CCC(=O)N1 62a_100000139335_100015189358 [0,2,0,0,0,0|1,0,1]=4 5986 B14R1.122 O=CCCCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000139335 [0,2,0,0,0,0|1,0,1]=4 5987 B14R1.122 O=S1OCC(O1)CCOCCCCCl 7a_100000210776_100009840081 [0,2,0,0,0,0|2,0,0]=4 5988 B14R1.122 O=S1OCC(O1)CCOCCCCF 7a_100011995726_100009840081 [0,2,0,0,0,0|2,0,0]=4 5989 B14R1.122 O=S1OCC(O1)CCSCCCCF 62a_100000729493_100009840081 [0,2,0,0,0,0|2,0,0]=4 5990 B14R1.122 O=S1OCC(O1)CCSCCCCO 62a_100000210776_100009840081 [0,2,0,0,0,0|2,0,0]=4 5991 B14R1.128 CC(=O)CCCCOC1CCC(=O)C1 34a_100012614533_100009817362 [0,2,0,0,0,0|1,0,1]=4 5992 B14R1.128 CC(=O)CCCCSC1COC(=O)O1 62a_100000735457_100000032252 [0,2,0,0,0,0|1,0,1]=4 5993 B14R1.128 CC(=O)CCCNC[C@H]1CCC(=O)N1 34a_100015423886_100000685027 [0,2,0,0,0,0|1,0,1]=4 5994 B14R1.128 CC(=O)CCCOCC1CCC(=O)N1 34a_100000737831_100000685027 [0,2,0,0,0,0|1,0,1]=4 5995 B14R1.128 CC(=O)CCCOCC1CNC(=O)O1 34a_100000759063_100000181169 [0,2,0,0,0,0|1,0,1]=4 5996 B14R1.128 CC(=O)CCCOCC1CNC(=O)O1 34a_100011315639_100000685027 [0,2,0,0,0,0|1,0,1]=4 5997 B14R1.128 CC(=O)CCCOCC1CNC(=O)O1 7a_100000759063_100000181169 [0,2,0,0,0,0|1,0,1]=4 5998 B14R1.128 CC(=O)CCCOCC1COC(=O)O1 34a_100000759063_100000073702 [0,2,0,0,0,0|1,0,1]=4 5999 B14R1.128 CC(=O)CCCOC[C@@H]1CCC(=O)N1 7a_100000759063_100015189358 [0,2,0,0,0,0|1,0,1]=4 6000 B14R1.128 CC(=O)CCCSCC1CNC(=O)O1 62a_100000181169_100011215641 [0,2,0,0,0,0|1,0,1]=4 6001 B14R1.128 CC(=O)CCCSCC1CNC(=O)O1 62a_100011215641_100000181169 [0,2,0,0,0,0|1,0,1]=4 6002 B14R1.128 CC(=O)CCCSCC1COC(=O)O1 62a_100000073702_100011215641 [0,2,0,0,0,0|1,0,1]=4 6003 B14R1.128 CC(=O)CCCSCC1COC(=O)O1 62a_100011215641_100000073702 [0,2,0,0,0,0|1,0,1]=4 6004 B14R1.128 CC(=O)CCCSC[C@@H]1CCC(=O)N1 62a_100011215641_100015189358 [0,2,0,0,0,0|1,0,1]=4 6005 B14R1.128 CC(=O)CCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100011215641 [0,2,0,0,0,0|1,0,1]=4 6006 B14R1.128 CC(C)CCCCNC1CNC(=O)C1 2230a_100000697751_100011216152 [0,2,0,0,0,0|2,0,0]=4 6007 B14R1.128 CC(C)CCCCOC1CCC(=O)C1 34a_100012614533_100011216152 [0,2,0,0,0,0|1,0,0]=3 6008 B14R1.128 CC(C)CCCCOC1CNC(=O)C1 34a_100000690082_100011216152 [0,2,0,0,0,0|2,0,0]=4 6009 B14R1.128 CC(C)CCCCOC1COC(=O)O1 34a_100011214890_100000032252 [0,2,0,0,0,0|1,0,0]=3 6010 B14R1.128 CC(C)CCCCSC1COC(=O)O1 62a_100011216152_100000032252 [0,2,0,0,0,0|1,0,0]=3 6011 B14R1.128 CC(C)CCCNCC1CNC(=O)C1 2230a_100016993742_100011214892 [0,2,0,0,0,0|2,0,0]=4 6012 B14R1.128 CC(C)CCCNCC1CNC(=O)C1 34a_100016993742_100011214892 [0,2,0,0,0,0|2,0,0]=4 6013 B14R1.128 CC(C)CCCNCC1CNC(=O)O1 2230a_200000737386_100000181169 [0,2,0,0,0,0|1,0,0]=3 6014 B14R1.128 CC(C)CCCNCC1CNC(=O)O1 34a_200000737386_100000181169 [0,2,0,0,0,0|1,0,0]=3 6015 B14R1.128 CC(C)CCCNCC1COC(=O)O1 34a_200000737386_100000073702 [0,2,0,0,0,0|1,0,0]=3 6016 B14R1.128 CC(C)CCCNC[C@@H]1CCC(=O)N1 2230a_200000737386_100015189358 [0,2,0,0,0,0|1,0,0]=3 6017 B14R1.128 CC(C)CCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100011214892 [0,2,0,0,0,0|1,0,0]=3 6018 B14R1.128 CC(C)CCCNC[C@H]1CCC(=O)N1 34a_100015423886_100011214892 [0,2,0,0,0,0|1,0,0]=3 6019 B14R1.128 CC(C)CCCNC[C@H]1COC(=O)N1 2230a_200000737386_100015307671 [0,2,0,0,0,0|2,0,0]=4 6020 B14R1.128 CC(C)CCCNC[C@H]1COC(=O)N1 34a_200000737386_100015307671 [0,2,0,0,0,0|2,0,0]=4 6021 B14R1.128 CC(C)CCCOCC1CCC(=O)N1 34a_100000737831_100011214892 [0,2,0,0,0,0|1,0,0]=3 6022 B14R1.128 CC(C)CCCOCC1CNC(=O)C1 34a_100016041077_100011214892 [0,2,0,0,0,0|2,0,0]=4 6023 B14R1.128 CC(C)CCCOCC1CNC(=O)O1 34a_100000210774_100000181169 [0,2,0,0,0,0|1,0,0]=3 6024 B14R1.128 CC(C)CCCOCC1CNC(=O)O1 34a_100011315639_100011214892 [0,2,0,0,0,0|1,0,0]=3 6025 B14R1.128 CC(C)CCCOCC1CNC(=O)O1 7a_100000210774_100000181169 [0,2,0,0,0,0|1,0,0]=3 6026 B14R1.128 CC(C)CCCOCC1COC(=O)O1 34a_100000210774_100000073702 [0,2,0,0,0,0|1,0,0]=3 6027 B14R1.128 CC(C)CCCOC[C@@H]1CCC(=O)N1 7a_100000210774_100015189358 [0,2,0,0,0,0|1,0,0]=3 6028 B14R1.128 CC(C)CCCOC[C@H]1COC(=O)N1 34a_100000210774_100015307671 [0,2,0,0,0,0|2,0,0]=4 6029 B14R1.128 CC(C)CCCOC[C@H]1COC(=O)N1 7a_100000210774_100015307671 [0,2,0,0,0,0|2,0,0]=4 6030 B14R1.128 CC(C)CCCSCC1CNC(=O)O1 62a_100000181169_100011214892 [0,2,0,0,0,0|1,0,0]=3 6031 B14R1.128 CC(C)CCCSCC1CNC(=O)O1 62a_100011214892_100000181169 [0,2,0,0,0,0|1,0,0]=3 6032 B14R1.128 CC(C)CCCSCC1COC(=O)O1 62a_100000073702_100011214892 [0,2,0,0,0,0|1,0,0]=3 6033 B14R1.128 CC(C)CCCSCC1COC(=O)O1 62a_100011214892_100000073702 [0,2,0,0,0,0|1,0,0]=3 6034 B14R1.128 CC(C)CCCSC[C@@H]1CCC(=O)N1 62a_100011214892_100015189358 [0,2,0,0,0,0|1,0,0]=3 6035 B14R1.128 CC(C)CCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100011214892 [0,2,0,0,0,0|1,0,0]=3 6036 B14R1.128 CC(C)CCCSC[C@H]1COC(=O)N1 62a_100011214892_100015307671 [0,2,0,0,0,0|2,0,0]=4 6037 B14R1.128 CC(C)CCCSC[C@H]1COC(=O)N1 62a_100015307671_100011214892 [0,2,0,0,0,0|2,0,0]=4 6038 B14R1.128 CC(C)CCOCCC1COS(=O)O1 7a_100000210254_100009840081 [0,2,0,0,0,0|2,0,0]=4 6039 B14R1.128 CC(C)CCSCCC1COS(=O)O1 62a_100000210312_100009840081 [0,2,0,0,0,0|2,0,0]=4 6040 B14R1.128 CC(C)CNCCOC1COC(=O)O1 34a_100015185251_100000032252 [0,2,0,0,0,0|2,0,0]=4 6041 B14R1.128 CC(C)COCCOC1COC(=O)O1 34a_100000703358_100000032252 [0,2,0,0,0,0|2,0,0]=4 6042 B14R1.128 CC(C)CSCCOC1COC(=O)O1 34a_200000230437_100000032252 [0,2,0,0,0,0|2,0,0]=4 6043 B14R1.128 CC(C)NCCCOC1COC(=O)O1 34a_100000182298_100000032252 [0,2,0,0,0,0|2,0,0]=4 6044 B14R1.128 CC(C)NCCOCC1CNC(=O)O1 34a_100000224655_100000181169 [0,2,0,0,0,0|2,0,0]=4 6045 B14R1.128 CC(C)NCCOCC1COC(=O)O1 34a_100000224655_100000073702 [0,2,0,0,0,0|2,0,0]=4 6046 B14R1.128 CC(C)OCCCNC1COC(=O)O1 34a_100000737246_100000032252 [0,2,0,0,0,0|2,0,0]=4 6047 B14R1.128 CC(C)OCCNCC1CNC(=O)O1 2230a_100000701111_100000181169 [0,2,0,0,0,0|2,0,0]=4 6048 B14R1.128 CC(C)OCCNCC1CNC(=O)O1 34a_100000701111_100000181169 [0,2,0,0,0,0|2,0,0]=4 6049 B14R1.128 CC(C)OCCNCC1COC(=O)O1 34a_100000701111_100000073702 [0,2,0,0,0,0|2,0,0]=4 6050 B14R1.128 CC(C)OCCNC[C@@H]1CCC(=O)N1 2230a_100000701111_100015189358 [0,2,0,0,0,0|2,0,0]=4 6051 B14R1.128 CC(C)OCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000211751 [0,2,0,0,0,0|2,0,0]=4 6052 B14R1.128 CC(C)OCCNC[C@H]1CCC(=O)N1 34a_100015423886_100000211751 [0,2,0,0,0,0|2,0,0]=4 6053 B14R1.128 CC(C)OCCOCC1CCC(=O)N1 34a_100000737831_100000211751 [0,2,0,0,0,0|2,0,0]=4 6054 B14R1.128 CC(C)OCCOCC1CNC(=O)O1 34a_100000211219_100000181169 [0,2,0,0,0,0|2,0,0]=4 6055 B14R1.128 CC(C)OCCOCC1CNC(=O)O1 34a_100011315639_100000211751 [0,2,0,0,0,0|2,0,0]=4 6056 B14R1.128 CC(C)OCCOCC1CNC(=O)O1 7a_100000211219_100000181169 [0,2,0,0,0,0|2,0,0]=4 6057 B14R1.128 CC(C)OCCOCC1COC(=O)O1 34a_100000211219_100000073702 [0,2,0,0,0,0|2,0,0]=4 6058 B14R1.128 CC(C)OCCOC[C@@H]1CCC(=O)N1 7a_100000211219_100015189358 [0,2,0,0,0,0|2,0,0]=4 6059 B14R1.128 CC(C)OCCSCC1CNC(=O)O1 62a_100000181169_100000211751 [0,2,0,0,0,0|2,0,0]=4 6060 B14R1.128 CC(C)OCCSCC1CNC(=O)O1 62a_100000211751_100000181169 [0,2,0,0,0,0|2,0,0]=4 6061 B14R1.128 CC(C)OCCSCC1COC(=O)O1 62a_100000073702_100000211751 [0,2,0,0,0,0|2,0,0]=4 6062 B14R1.128 CC(C)OCCSCC1COC(=O)O1 62a_100000211751_100000073702 [0,2,0,0,0,0|2,0,0]=4 6063 B14R1.128 CC(C)OCCSC[C@@H]1CCC(=O)N1 62a_100000211751_100015189358 [0,2,0,0,0,0|2,0,0]=4 6064 B14R1.128 CC(C)OCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000211751 [0,2,0,0,0,0|2,0,0]=4 6065 B14R1.128 CC(C)SCCNCC1CNC(=O)O1 2230a_100000731138_100000181169 [0,2,0,0,0,0|2,0,0]=4 6066 B14R1.128 CC(C)SCCNCC1CNC(=O)O1 34a_100000731138_100000181169 [0,2,0,0,0,0|2,0,0]=4 6067 B14R1.128 CC(C)SCCNCC1COC(=O)O1 34a_100000731138_100000073702 [0,2,0,0,0,0|2,0,0]=4 6068 B14R1.128 CC(C)SCCNC[C@@H]1CCC(=O)N1 2230a_100000731138_100015189358 [0,2,0,0,0,0|2,0,0]=4 6069 B14R1.128 CC(C)SCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000730970 [0,2,0,0,0,0|2,0,0]=4 6070 B14R1.128 CC(C)SCCNC[C@H]1CCC(=O)N1 34a_100015423886_100000730970 [0,2,0,0,0,0|2,0,0]=4 6071 B14R1.128 CC(C)SCCOCC1CCC(=O)N1 34a_100000737831_100000730970 [0,2,0,0,0,0|2,0,0]=4 6072 B14R1.128 CC(C)SCCOCC1CNC(=O)O1 34a_100011315639_100000730970 [0,2,0,0,0,0|2,0,0]=4 6073 B14R1.128 CC(C)SCCOCC1CNC(=O)O1 34a_200011212901_100000181169 [0,2,0,0,0,0|2,0,0]=4 6074 B14R1.128 CC(C)SCCOCC1CNC(=O)O1 7a_200011212901_100000181169 [0,2,0,0,0,0|2,0,0]=4 6075 B14R1.128 CC(C)SCCOCC1COC(=O)O1 34a_200011212901_100000073702 [0,2,0,0,0,0|2,0,0]=4 6076 B14R1.128 CC(C)SCCOC[C@@H]1CCC(=O)N1 7a_200011212901_100015189358 [0,2,0,0,0,0|2,0,0]=4 6077 B14R1.128 CC(C)SCCSCC1CNC(=O)O1 62a_100000181169_100000730970 [0,2,0,0,0,0|2,0,0]=4 6078 B14R1.128 CC(C)SCCSCC1CNC(=O)O1 62a_100000730970_100000181169 [0,2,0,0,0,0|2,0,0]=4 6079 B14R1.128 CC(C)SCCSCC1COC(=O)O1 62a_100000073702_100000730970 [0,2,0,0,0,0|2,0,0]=4 6080 B14R1.128 CC(C)SCCSCC1COC(=O)O1 62a_100000730970_100000073702 [0,2,0,0,0,0|2,0,0]=4 6081 B14R1.128 CC(C)SCCSC[C@@H]1CCC(=O)N1 62a_100000730970_100015189358 [0,2,0,0,0,0|2,0,0]=4 6082 B14R1.128 CC(C)SCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000730970 [0,2,0,0,0,0|2,0,0]=4 6083 B14R1.128 CC(O)CCCNCC1CNC(=O)C1 2230a_100016993742_200000718107 [0,2,0,0,0,0|2,0,0]=4 6084 B14R1.128 CC(O)CCCNCC1CNC(=O)C1 34a_100016993742_200000718107 [0,2,0,0,0,0|2,0,0]=4 6085 B14R1.128 CC(O)CCCNC[C@H]1CCC(=O)N1 2230a_100015423886_200000718107 [0,2,0,0,0,0|1,0,0]=3 6086 B14R1.128 CC(O)CCCNC[C@H]1CCC(=O)N1 34a_100015423886_200000718107 [0,2,0,0,0,0|1,0,0]=3 6087 B14R1.128 CC(O)CCCOCC1CCC(=O)N1 34a_100000737831_200000718107 [0,2,0,0,0,0|1,0,0]=3 6088 B14R1.128 CC(O)CCCOCC1CNC(=O)C1 34a_100016041077_200000718107 [0,2,0,0,0,0|2,0,0]=4 6089 B14R1.128 CC(O)CCCOCC1CNC(=O)O1 34a_100011315639_200000718107 [0,2,0,0,0,0|1,0,0]=3 6090 B14R1.128 CC(O)CCCSCC1CNC(=O)O1 62a_100000181169_200000718107 [0,2,0,0,0,0|1,0,0]=3 6091 B14R1.128 CC(O)CCCSCC1CNC(=O)O1 62a_200000718107_100000181169 [0,2,0,0,0,0|1,0,0]=3 6092 B14R1.128 CC(O)CCCSCC1COC(=O)O1 62a_100000073702_200000718107 [0,2,0,0,0,0|1,0,0]=3 6093 B14R1.128 CC(O)CCCSCC1COC(=O)O1 62a_200000718107_100000073702 [0,2,0,0,0,0|1,0,0]=3 6094 B14R1.128 CC(O)CCCSC[C@@H]1CCC(=O)N1 62a_100015189358_200000718107 [0,2,0,0,0,0|1,0,0]=3 6095 B14R1.128 CC(O)CCCSC[C@@H]1CCC(=O)N1 62a_200000718107_100015189358 [0,2,0,0,0,0|1,0,0]=3 6096 B14R1.128 CC(O)CCCSC[C@H]1COC(=O)N1 62a_100015307671_200000718107 [0,2,0,0,0,0|2,0,0]=4 6097 B14R1.128 CC(O)CCCSC[C@H]1COC(=O)N1 62a_200000718107_100015307671 [0,2,0,0,0,0|2,0,0]=4 6098 B14R1.128 CC(O)CCSCCC1COS(=O)O1 62a_100012276601_100009840081 [0,2,0,0,0,0|2,0,0]=4 6099 B14R1.128 CN(C)CCCSCC1CNC(=O)O1 62a_100000181169_100000757444 [0,2,0,0,0,0|2,0,0]=4 6100 B14R1.128 CN(C)CCCSCC1COC(=O)O1 62a_100000073702_100000757444 [0,2,0,0,0,0|2,0,0]=4 6101 B14R1.128 CN(C)CCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000757444 [0,2,0,0,0,0|2,0,0]=4 6102 B14R1.128 CS(=O)CCCNCC1CNC(=O)O1 2230a_200000753449_100000181169 [0,2,0,0,0,0|2,0,0]=4 6103 B14R1.128 CS(=O)CCCNC[C@@H]1CCC(=O)N1 2230a_200000753449_100015189358 [0,2,0,0,0,0|2,0,0]=4 6104 B14R1.155 CC(CCCCl)OCC1CNC(=O)O1 34a_200000718107_100000181169 [0,2,0,0,0,0|2,0,0]=4 6105 B14R1.155 CC(CCCCl)OCC1CNC(=O)O1 7a_200000718107_100000181169 [0,2,0,0,0,0|2,0,0]=4 6106 B14R1.155 CC(CCCCl)OCC1COC(=O)O1 34a_200000718107_100000073702 [0,2,0,0,0,0|2,0,0]=4 6107 B14R1.155 CC(CCCCl)OC[C@@H]1CCC(=O)N1 7a_200000718107_100015189358 [0,2,0,0,0,0|2,0,0]=4 6108 B14R1.155 CCCCC(=O)CCC1COS(=O)O1 1458a_100000210183_100009840081 [0,2,0,0,0,0|2,0,0]=4 6109 B14R1.155 CCCCC(=O)NC[C@H]1CCC(=O)N1 11a_100015423886_100000210183 [0,2,0,0,0,0|1,0,1]=4 6110 B14R1.155 CCCCC(=O)NC[C@H]1CCC(=O)N1 1626a_100015423886_100000210183 [0,2,0,0,0,0|1,0,1]=4 6111 B14R1.155 CCCCC(=O)NC[C@H]1CCC(=O)N1 240690a_100015423886_100000210183 [0,2,0,0,0,0|1,0,1]=4 6112 B14R1.155 CCCCC(=O)NC[C@H]1CCC(=O)N1 527a_100015423886_100000210183 [0,2,0,0,0,0|1,0,1]=4 6113 B14R1.155 CCCCC(C)COC1COC(=O)O1 34a_100011995851_100000032252 [0,2,0,0,0,0|1,0,0]=3 6114 B14R1.155 CCCCC(C)NCC1CNC(=O)C1 2230a_100016993742_200011215066 [0,2,0,0,0,0|2,0,0]=4 6115 B14R1.155 CCCCC(C)NCC1CNC(=O)C1 34a_100016993742_200011215066 [0,2,0,0,0,0|2,0,0]=4 6116 B14R1.155 CCCCC(C)NCC1CNC(=O)O1 2230a_100000126638_100000181169 [0,2,0,0,0,0|1,0,0]=3 6117 B14R1.155 CCCCC(C)NC[C@@H]1CCC(=O)N1 2230a_100000126638_100015189358 [0,2,0,0,0,0|1,0,0]=3 6118 B14R1.155 CCCCC(C)NC[C@H]1CCC(=O)N1 2230a_100015423886_200011215066 [0,2,0,0,0,0|1,0,0]=3 6119 B14R1.155 CCCCC(C)NC[C@H]1CCC(=O)N1 270004a_100015423886_100000210087 [0,2,0,0,0,0|1,0,0]=3 6120 B14R1.155 CCCCC(C)NC[C@H]1CCC(=O)N1 34a_100015423886_200011215066 [0,2,0,0,0,0|1,0,0]=3 6121 B14R1.155 CCCCC(C)NC[C@H]1COC(=O)N1 2230a_100000126638_100015307671 [0,2,0,0,0,0|2,0,0]=4 6122 B14R1.155 CCCCC(C)OCC1CCC(=O)N1 34a_100000737831_200011215066 [0,2,0,0,0,0|1,0,0]=3 6123 B14R1.155 CCCCC(C)OCC1CNC(=O)C1 34a_100016041077_200011215066 [0,2,0,0,0,0|2,0,0]=4 6124 B14R1.155 CCCCC(C)OCC1CNC(=O)O1 34a_100000687866_100000181169 [0,2,0,0,0,0|1,0,0]=3 6125 B14R1.155 CCCCC(C)OCC1CNC(=O)O1 34a_100011315639_200011215066 [0,2,0,0,0,0|1,0,0]=3 6126 B14R1.155 CCCCC(C)OCC1CNC(=O)O1 7a_100000687866_100000181169 [0,2,0,0,0,0|1,0,0]=3 6127 B14R1.155 CCCCC(C)OCC1COC(=O)O1 34a_100000687866_100000073702 [0,2,0,0,0,0|1,0,0]=3 6128 B14R1.155 CCCCC(C)OC[C@@H]1CCC(=O)N1 7a_100000687866_100015189358 [0,2,0,0,0,0|1,0,0]=3 6129 B14R1.155 CCCCC(C)OC[C@H]1COC(=O)N1 34a_100000687866_100015307671 [0,2,0,0,0,0|2,0,0]=4 6130 B14R1.155 CCCCC(C)OC[C@H]1COC(=O)N1 7a_100000687866_100015307671 [0,2,0,0,0,0|2,0,0]=4 6131 B14R1.155 CCCCC(C)SCC1CNC(=O)O1 62a_100000181169_200011215066 [0,2,0,0,0,0|1,0,0]=3 6132 B14R1.155 CCCCC(C)SCC1CNC(=O)O1 62a_200011215066_100000181169 [0,2,0,0,0,0|1,0,0]=3 6133 B14R1.155 CCCCC(C)SCC1COC(=O)O1 62a_100000073702_200011215066 [0,2,0,0,0,0|1,0,0]=3 6134 B14R1.155 CCCCC(C)SCC1COC(=O)O1 62a_200011215066_100000073702 [0,2,0,0,0,0|1,0,0]=3 6135 B14R1.155 CCCCC(C)SC[C@@H]1CCC(=O)N1 62a_100015189358_200011215066 [0,2,0,0,0,0|1,0,0]=3 6136 B14R1.155 CCCCC(C)SC[C@@H]1CCC(=O)N1 62a_200011215066_100015189358 [0,2,0,0,0,0|1,0,0]=3 6137 B14R1.155 CCCCC(C)SC[C@H]1COC(=O)N1 62a_100015307671_200011215066 [0,2,0,0,0,0|2,0,0]=4 6138 B14R1.155 CCCCC(C)SC[C@H]1COC(=O)N1 62a_200011215066_100015307671 [0,2,0,0,0,0|2,0,0]=4 6139 B14R1.155 CCCCN(C)CCC1COS(=O)O1 269982a_100000207549_100009840081 [0,2,0,0,0,0|2,0,0]=4 6140 B14R1.155 CCCC[C@H](N)COC1COC(=O)O1 34a_100011934283_100000032252 [0,2,0,0,0,0|1,0,0]=3 6141 B14R1.155 CCCOC(C)CNC1COC(=O)O1 34a_100015185124_100000032252 [0,2,0,0,0,0|2,0,0]=4 6142 B14R1.155 CCOCC(C)OCC1CNC(=O)O1 34a_100000718985_100000181169 [0,2,0,0,0,0|2,0,0]=4 6143 B14R1.155 CCOCC(C)OCC1CNC(=O)O1 7a_100000718985_100000181169 [0,2,0,0,0,0|2,0,0]=4 6144 B14R1.155 CCOCC(C)OCC1COC(=O)O1 34a_100000718985_100000073702 [0,2,0,0,0,0|2,0,0]=4 6145 B14R1.155 CCOCC(C)OC[C@@H]1CCC(=O)N1 7a_100000718985_100015189358 [0,2,0,0,0,0|2,0,0]=4 6146 B14R1.155 CCOCC(O)CNC1COC(=O)O1 34a_102515437182_100000032252 [0,2,0,0,0,0|2,0,0]=4 6147 B14R1.155 CCSCC(C)NC[C@H]1CCC(=O)N1 270004a_100015423886_200011216171 [0,2,0,0,0,0|2,0,0]=4 6148 B14R1.155 COCCC(C)NC[C@H]1CCC(=O)N1 270004a_100015423886_100000742357 [0,2,0,0,0,0|2,0,0]=4 6149 B14R1.155 CSCCC(C)NC[C@H]1CCC(=O)N1 270004a_100015423886_100011217047 [0,2,0,0,0,0|2,0,0]=4 6150 B14R1.155 CSCC[C@H](N)COC1COC(=O)O1 34a_100011827619_100000032252 [0,2,0,0,0,0|2,0,0]=4 6151 B14R1.155 C[C@H](CCCO)CNC1COC(=O)O1 34a_100160569302_100000032252 [0,2,0,0,0,0|2,0,0]=4 6152 B14R1.157 CCCCCC(=O)CC1CCC(=O)N1 1458a_100000026770_100000210326 [0,2,0,0,0,0|1,0,0]=3 6153 B14R1.157 CCCCCC(=O)CC1CNC(=O)O1 1458a_100000212188_100000181169 [0,2,0,0,0,0|1,0,0]=3 6154 B14R1.157 CCCCCC(=O)CC1COC(=O)O1 1458a_100000212188_100000073702 [0,2,0,0,0,0|1,0,0]=3 6155 B14R1.157 CCCCCC(=O)C[C@@H]1CCC(=O)N1 1458a_100000212188_100015189358 [0,2,0,0,0,0|1,0,0]=3 6156 B14R1.157 CCCCCC(=O)C[C@H]1COC(=O)N1 1458a_100000212188_100015307671 [0,2,0,0,0,0|2,0,0]=4 6157 B14R1.157 CCCCCC(C)NC1CNC(=O)C1 2230a_100000697751_200011218191 [0,2,0,0,0,0|2,0,0]=4 6158 B14R1.157 CCCCCC(C)OC1CCC(=O)C1 34a_100012614533_200011218191 [0,2,0,0,0,0|1,0,0]=3 6159 B14R1.157 CCCCCC(C)OC1CNC(=O)C1 34a_100000690082_200011218191 [0,2,0,0,0,0|2,0,0]=4 6160 B14R1.157 CCCCCC(C)OC1COC(=O)O1 34a_100011215632_100000032252 [0,2,0,0,0,0|1,0,0]=3 6161 B14R1.157 CCCCCC(C)SC1COC(=O)O1 62a_200011218191_100000032252 [0,2,0,0,0,0|1,0,0]=3 6162 B14R1.157 CCCCCN(C)CC1CNC(=O)O1 2230a_100000223495_100000181169 [0,2,0,0,0,0|1,0,0]=3 6163 B14R1.157 CCCCCN(C)CC1CNC(=O)O1 269982a_100000223495_100000181169 [0,2,0,0,0,0|1,0,0]=3 6164 B14R1.157 CCCCCN(C)CC1COC(=O)O1 269982a_100000223495_100000073702 [0,2,0,0,0,0|1,0,0]=3 6165 B14R1.157 CCCCCN(C)C[C@@H]1CCC(=O)N1 2230a_100000223495_100015189358 [0,2,0,0,0,0|1,0,0]=3 6166 B14R1.157 CCCCCN(C)C[C@@H]1CCC(=O)N1 269982a_100000223495_100015189358 [0,2,0,0,0,0|1,0,0]=3 6167 B14R1.157 CCCCCN(C)C[C@H]1COC(=O)N1 2230a_100000223495_100015307671 [0,2,0,0,0,0|2,0,0]=4 6168 B14R1.157 CCCCCN(C)C[C@H]1COC(=O)N1 269982a_100000223495_100015307671 [0,2,0,0,0,0|2,0,0]=4 6169 B14R1.157 CCCCNC(=O)CC1CCC(=O)N1 1626a_100000102301_100000026770 [0,2,0,0,0,0|1,0,1]=4 6170 B14R1.157 CCCCNC(=O)CC1CCC(=O)N1 240690a_100000102301_100000026770 [0,2,0,0,0,0|1,0,1]=4 6171 B14R1.157 CCCOCC(=O)CC1CNC(=O)O1 1458a_100000745993_100000181169 [0,2,0,0,0,0|1,0,1]=4 6172 B14R1.157 CCCOCC(=O)CC1COC(=O)O1 1458a_100000745993_100000073702 [0,2,0,0,0,0|1,0,1]=4 6173 B14R1.157 CCCOCC(=O)C[C@@H]1CCC(=O)N1 1458a_100000745993_100015189358 [0,2,0,0,0,0|1,0,1]=4 6174 B14R1.157 CCCSCC(=O)CC1CNC(=O)O1 1458a_100000217233_100000181169 [0,2,0,0,0,0|1,0,1]=4 6175 B14R1.157 CCCSCC(=O)CC1COC(=O)O1 1458a_100000217233_100000073702 [0,2,0,0,0,0|1,0,1]=4 6176 B14R1.157 CCCSCC(=O)C[C@@H]1CCC(=O)N1 1458a_100000217233_100015189358 [0,2,0,0,0,0|1,0,1]=4 6177 B14R1.157 CCOCCC(=O)CC1CCC(=O)N1 1458a_100000026770_100011215890 [0,2,0,0,0,0|1,0,1]=4 6178 B14R1.157 CCOCCC(=O)CC1CNC(=O)O1 1458a_100000749530_100000181169 [0,2,0,0,0,0|1,0,1]=4 6179 B14R1.157 CCOCCC(=O)CC1COC(=O)O1 1458a_100000749530_100000073702 [0,2,0,0,0,0|1,0,1]=4 6180 B14R1.157 CCOCCC(=O)C[C@@H]1CCC(=O)N1 1458a_100000749530_100015189358 [0,2,0,0,0,0|1,0,1]=4 6181 B14R1.157 CCSCCC(=O)CC1CCC(=O)N1 1458a_100000026770_100000757381 [0,2,0,0,0,0|1,0,1]=4 6182 B14R1.157 CCSCCC(=O)CC1CNC(=O)O1 1458a_100000230768_100000181169 [0,2,0,0,0,0|1,0,1]=4 6183 B14R1.157 CCSCCC(=O)CC1COC(=O)O1 1458a_100000230768_100000073702 [0,2,0,0,0,0|1,0,1]=4 6184 B14R1.157 CCSCCC(=O)C[C@@H]1CCC(=O)N1 1458a_100000230768_100015189358 [0,2,0,0,0,0|1,0,1]=4 6185 B14R1.157 CN(CCCCO)CC1CNC(=O)O1 2230a_100000717598_100000181169 [0,2,0,0,0,0|2,0,0]=4 6186 B14R1.157 CN(CCCCO)CC1CNC(=O)O1 269982a_100000717598_100000181169 [0,2,0,0,0,0|2,0,0]=4 6187 B14R1.157 CN(CCCCO)CC1COC(=O)O1 269982a_100000717598_100000073702 [0,2,0,0,0,0|2,0,0]=4 6188 B14R1.157 CN(CCCCO)C[C@@H]1CCC(=O)N1 2230a_100000717598_100015189358 [0,2,0,0,0,0|2,0,0]=4 6189 B14R1.157 CN(CCCCO)C[C@@H]1CCC(=O)N1 269982a_100000717598_100015189358 [0,2,0,0,0,0|2,0,0]=4 6190 B14R1.157 COCCCC(=O)CC1CCC(=O)N1 1458a_100000026770_100000740836 [0,2,0,0,0,0|1,0,1]=4 6191 B14R1.157 COCCCC(=O)CC1CNC(=O)O1 1458a_100000741012_100000181169 [0,2,0,0,0,0|1,0,1]=4 6192 B14R1.157 COCCCC(=O)CC1COC(=O)O1 1458a_100000741012_100000073702 [0,2,0,0,0,0|1,0,1]=4 6193 B14R1.157 COCCCC(=O)C[C@@H]1CCC(=O)N1 1458a_100000741012_100015189358 [0,2,0,0,0,0|1,0,1]=4 6194 B14R1.157 COCCCC(C)OC1COC(=O)O1 34a_200011539412_100000032252 [0,2,0,0,0,0|2,0,0]=4 6195 B14R1.157 COCCCN(C)CC1CNC(=O)O1 2230a_100000224831_100000181169 [0,2,0,0,0,0|2,0,0]=4 6196 B14R1.157 COCCCN(C)CC1CNC(=O)O1 269982a_100000224831_100000181169 [0,2,0,0,0,0|2,0,0]=4 6197 B14R1.157 COCCCN(C)CC1COC(=O)O1 269982a_100000224831_100000073702 [0,2,0,0,0,0|2,0,0]=4 6198 B14R1.157 COCCCN(C)C[C@@H]1CCC(=O)N1 2230a_100000224831_100015189358 [0,2,0,0,0,0|2,0,0]=4 6199 B14R1.157 COCCCN(C)C[C@@H]1CCC(=O)N1 269982a_100000224831_100015189358 [0,2,0,0,0,0|2,0,0]=4 6200 B14R1.157 CSCCCC(=O)CC1CNC(=O)O1 1458a_100000173376_100000181169 [0,2,0,0,0,0|1,0,1]=4 6201 B14R1.157 CSCCCC(=O)CC1COC(=O)O1 1458a_100000173376_100000073702 [0,2,0,0,0,0|1,0,1]=4 6202 B14R1.157 CSCCCC(=O)C[C@@H]1CCC(=O)N1 1458a_100000173376_100015189358 [0,2,0,0,0,0|1,0,1]=4 6203 B14R1.157 O=C(CCCCF)CC1CCC(=O)N1 1458a_100000026770_100000729493 [0,2,0,0,0,0|1,0,1]=4 6204 B14R1.157 O=C(CCCCO)CC1CCC(=O)N1 1458a_100000026770_100000210776 [0,2,0,0,0,0|1,0,1]=4 6205 B14R1.157 O=C(CCCCO)CC1CNC(=O)O1 1458a_100000695505_100000181169 [0,2,0,0,0,0|1,0,1]=4 6206 B14R1.157 O=C(CCCCO)CC1COC(=O)O1 1458a_100000695505_100000073702 [0,2,0,0,0,0|1,0,1]=4 6207 B14R1.157 O=C(CCCCO)C[C@@H]1CCC(=O)N1 1458a_100000695505_100015189358 [0,2,0,0,0,0|1,0,1]=4 6208 B14R1.519 CC(CCN)COCC1CNC(=O)O1 34a_106354213184_100000181169 [0,2,0,0,0,0|2,0,0]=4 6209 B14R1.519 CC(CCN)COCC1COC(=O)O1 34a_106354213184_100000073702 [0,2,0,0,0,0|2,0,0]=4 6210 B14R1.519 CCCC(=O)CNC[C@H]1CCC(=O)N1 2230a_100015423886_100000747444 [0,2,0,0,0,0|1,0,1]=4 6211 B14R1.519 CCCC(=O)CSCC1CNC(=O)O1 62a_100000181169_100000747444 [0,2,0,0,0,0|1,0,1]=4 6212 B14R1.519 CCCC(=O)CSCC1CNC(=O)O1 62a_100000747444_100000181169 [0,2,0,0,0,0|1,0,1]=4 6213 B14R1.519 CCCC(=O)CSCC1COC(=O)O1 62a_100000073702_100000747444 [0,2,0,0,0,0|1,0,1]=4 6214 B14R1.519 CCCC(=O)CSCC1COC(=O)O1 62a_100000747444_100000073702 [0,2,0,0,0,0|1,0,1]=4 6215 B14R1.519 CCCC(=O)CSC[C@@H]1CCC(=O)N1 62a_100000747444_100015189358 [0,2,0,0,0,0|1,0,1]=4 6216 B14R1.519 CCCC(=O)CSC[C@@H]1CCC(=O)N1 62a_100015189358_100000747444 [0,2,0,0,0,0|1,0,1]=4 6217 B14R1.519 CCCC(C)CCOC1COC(=O)O1 34a_100011217855_100000032252 [0,2,0,0,0,0|1,0,0]=3 6218 B14R1.519 CCCC(C)CNCC1CNC(=O)C1 2230a_100016993742_100011216630 [0,2,0,0,0,0|2,0,0]=4 6219 B14R1.519 CCCC(C)CNCC1CNC(=O)C1 34a_100016993742_100011216630 [0,2,0,0,0,0|2,0,0]=4 6220 B14R1.519 CCCC(C)CNC[C@H]1CCC(=O)N1 2230a_100015423886_100011216630 [0,2,0,0,0,0|1,0,0]=3 6221 B14R1.519 CCCC(C)CNC[C@H]1CCC(=O)N1 270004a_100015423886_100000243154 [0,2,0,0,0,0|1,0,0]=3 6222 B14R1.519 CCCC(C)CNC[C@H]1CCC(=O)N1 34a_100015423886_100011216630 [0,2,0,0,0,0|1,0,0]=3 6223 B14R1.519 CCCC(C)COCC1CCC(=O)N1 34a_100000737831_100011216630 [0,2,0,0,0,0|1,0,0]=3 6224 B14R1.519 CCCC(C)COCC1CNC(=O)C1 34a_100016041077_100011216630 [0,2,0,0,0,0|2,0,0]=4 6225 B14R1.519 CCCC(C)COCC1CNC(=O)O1 34a_100000688023_100000181169 [0,2,0,0,0,0|1,0,0]=3 6226 B14R1.519 CCCC(C)COCC1CNC(=O)O1 34a_100011315639_100011216630 [0,2,0,0,0,0|1,0,0]=3 6227 B14R1.519 CCCC(C)COCC1CNC(=O)O1 7a_100000688023_100000181169 [0,2,0,0,0,0|1,0,0]=3 6228 B14R1.519 CCCC(C)COCC1COC(=O)O1 34a_100000688023_100000073702 [0,2,0,0,0,0|1,0,0]=3 6229 B14R1.519 CCCC(C)COC[C@@H]1CCC(=O)N1 7a_100000688023_100015189358 [0,2,0,0,0,0|1,0,0]=3 6230 B14R1.519 CCCC(C)COC[C@H]1COC(=O)N1 34a_100000688023_100015307671 [0,2,0,0,0,0|2,0,0]=4 6231 B14R1.519 CCCC(C)COC[C@H]1COC(=O)N1 7a_100000688023_100015307671 [0,2,0,0,0,0|2,0,0]=4 6232 B14R1.519 CCCC(C)CSCC1CNC(=O)O1 62a_100000181169_100011216630 [0,2,0,0,0,0|1,0,0]=3 6233 B14R1.519 CCCC(C)CSCC1CNC(=O)O1 62a_100011216630_100000181169 [0,2,0,0,0,0|1,0,0]=3 6234 B14R1.519 CCCC(C)CSCC1COC(=O)O1 62a_100000073702_100011216630 [0,2,0,0,0,0|1,0,0]=3 6235 B14R1.519 CCCC(C)CSCC1COC(=O)O1 62a_100011216630_100000073702 [0,2,0,0,0,0|1,0,0]=3 6236 B14R1.519 CCCC(C)CSC[C@@H]1CCC(=O)N1 62a_100011216630_100015189358 [0,2,0,0,0,0|1,0,0]=3 6237 B14R1.519 CCCC(C)CSC[C@@H]1CCC(=O)N1 62a_100015189358_100011216630 [0,2,0,0,0,0|1,0,0]=3 6238 B14R1.519 CCCC(C)CSC[C@H]1COC(=O)N1 62a_100011216630_100015307671 [0,2,0,0,0,0|2,0,0]=4 6239 B14R1.519 CCCC(C)CSC[C@H]1COC(=O)N1 62a_100015307671_100011216630 [0,2,0,0,0,0|2,0,0]=4 6240 B14R1.519 CCCC(C)OCCC1COS(=O)O1 7a_100000764384_100009840081 [0,2,0,0,0,0|2,0,0]=4 6241 B14R1.519 CCCC(C)SCCC1COS(=O)O1 62a_100000766640_100009840081 [0,2,0,0,0,0|2,0,0]=4 6242 B14R1.519 CCC[C@H](N)CCOC1COC(=O)O1 34a_100015193777_100000032252 [0,2,0,0,0,0|1,0,0]=3 6243 B14R1.519 CCC[C@H](N)COCC1CNC(=O)O1 34a_100000732646_100000181169 [0,2,0,0,0,0|1,0,0]=3 6244 B14R1.519 CCC[C@H](N)COCC1COC(=O)O1 34a_100000732646_100000073702 [0,2,0,0,0,0|1,0,0]=3 6245 B14R1.519 CCC[C@H](N)COC[C@H]1COC(=O)N1 34a_100000732646_100015307671 [0,2,0,0,0,0|2,0,0]=4 6246 B14R1.519 COCC(N)COCC1CNC(=O)O1 34a_100000724102_100000181169 [0,2,0,0,0,0|2,0,0]=4 6247 B14R1.519 COCC(N)COCC1COC(=O)O1 34a_100000724102_100000073702 [0,2,0,0,0,0|2,0,0]=4 6248 B14R1.519 COCC(O)CNCC1CNC(=O)O1 2230a_100000756049_100000181169 [0,2,0,0,0,0|2,0,0]=4 6249 B14R1.519 COCC(O)CNCC1CNC(=O)O1 34a_100000756049_100000181169 [0,2,0,0,0,0|2,0,0]=4 6250 B14R1.519 COCC(O)CNCC1COC(=O)O1 34a_100000756049_100000073702 [0,2,0,0,0,0|2,0,0]=4 6251 B14R1.519 COCC(O)CNC[C@@H]1CCC(=O)N1 2230a_100000756049_100015189358 [0,2,0,0,0,0|2,0,0]=4 6252 B14R1.519 COCC(O)CNC[C@H]1CCC(=O)N1 34a_100015423886_100011215053 [0,2,0,0,0,0|2,0,0]=4 6253 B14R1.519 COCC(O)COCC1CCC(=O)N1 34a_100000737831_100011215053 [0,2,0,0,0,0|2,0,0]=4 6254 B14R1.519 COCC(O)COCC1CNC(=O)O1 34a_100011315639_100011215053 [0,2,0,0,0,0|2,0,0]=4 6255 B14R1.519 COCC(O)CSCC1CNC(=O)O1 62a_100000181169_100011215053 [0,2,0,0,0,0|2,0,0]=4 6256 B14R1.519 COCC(O)CSCC1CNC(=O)O1 62a_100011215053_100000181169 [0,2,0,0,0,0|2,0,0]=4 6257 B14R1.519 COCC(O)CSCC1COC(=O)O1 62a_100000073702_100011215053 [0,2,0,0,0,0|2,0,0]=4 6258 B14R1.519 COCC(O)CSCC1COC(=O)O1 62a_100011215053_100000073702 [0,2,0,0,0,0|2,0,0]=4 6259 B14R1.519 COCC(O)CSC[C@@H]1CCC(=O)N1 62a_100011215053_100015189358 [0,2,0,0,0,0|2,0,0]=4 6260 B14R1.519 COCC(O)CSC[C@@H]1CCC(=O)N1 62a_100015189358_100011215053 [0,2,0,0,0,0|2,0,0]=4 6261 B14R1.715 CC(CO)CCNCC1CNC(=O)O1 2230a_106354213184_100000181169 [0,2,0,0,0,0|2,0,0]=4 6262 B14R1.715 CC(CO)CCNCC1CNC(=O)O1 34a_106354213184_100000181169 [0,2,0,0,0,0|2,0,0]=4 6263 B14R1.715 CC(CO)CCNCC1COC(=O)O1 34a_106354213184_100000073702 [0,2,0,0,0,0|2,0,0]=4 6264 B14R1.715 CC(CO)CCNC[C@@H]1CCC(=O)N1 2230a_106354213184_100015189358 [0,2,0,0,0,0|2,0,0]=4 6265 B14R1.715 CCC(C)CCNCC1CNC(=O)O1 2230a_100020591266_100000181169 [0,2,0,0,0,0|1,0,0]=3 6266 B14R1.715 CCC(C)CCNC[C@@H]1CCC(=O)N1 2230a_100020591266_100015189358 [0,2,0,0,0,0|1,0,0]=3 6267 B14R1.715 CCC(C)CCNC[C@H]1COC(=O)N1 2230a_100020591266_100015307671 [0,2,0,0,0,0|2,0,0]=4 6268 B14R1.715 CCC(C)CCOCC1CNC(=O)O1 7a_100011215188_100000181169 [0,2,0,0,0,0|1,0,0]=3 6269 B14R1.715 CCC(C)CCOC[C@@H]1CCC(=O)N1 7a_100011215188_100015189358 [0,2,0,0,0,0|1,0,0]=3 6270 B14R1.715 CCC(C)CCOC[C@H]1COC(=O)N1 7a_100011215188_100015307671 [0,2,0,0,0,0|2,0,0]=4 6271 B14R1.715 CCC(C)CSCCC1COS(=O)O1 62a_100000748023_100009840081 [0,2,0,0,0,0|2,0,0]=4 6272 B14R1.715 CCC(O)CSCCC1COS(=O)O1 62a_100011218378_100009840081 [0,2,0,0,0,0|2,0,0]=4 6273 B14R1.715 CC[C@H](C)COCCC1COS(=O)O1 7a_100009816381_100009840081 [0,2,0,0,0,0|2,0,0]=4 6274 B14R1.715 CC[C@H](C)CSCCC1COS(=O)O1 62a_100009816398_100009840081 [0,2,0,0,0,0|2,0,0]=4 6275 B14R1.715 COC(C)CCOCC1CNC(=O)O1 7a_100000764861_100000181169 [0,2,0,0,0,0|2,0,0]=4 6276 B14R1.715 COC(C)CCOC[C@@H]1CCC(=O)N1 7a_100000764861_100015189358 [0,2,0,0,0,0|2,0,0]=4 6277 B14R1.715 C[C@@H](CN)CCCOC1COC(=O)O1 34a_100160569302_100000032252 [0,2,0,0,0,0|2,0,0]=4 6278 B14R1.3127 CCCCCCNC1C=C(C(=O)O1)C 2230a_100000210581_200009893386 [0,2,0,0,0,0|0,0,2]=4 6279 B14R1.3127 CCCCCCNC1CC(=O)N(C1)C 2230a_100000748898_100000210314 [0,2,0,0,0,0|2,0,0]=4 6280 B14R1.3127 CCCCCCNC1CC(=O)N(C1)C 34a_100000748898_100000210314 [0,2,0,0,0,0|2,0,0]=4 6281 B14R1.3127 CCCCCCSC1C=C(C(=O)O1)C 62a_100000210314_200009893386 [0,2,0,0,0,0|0,0,2]=4 6282 B14R1.3127 CCCCCCSC1C=C(C(=O)O1)C 62a_200009893386_100000210757 [0,2,0,0,0,0|0,0,2]=4 6283 B14R1.3127 CCCCCOCC1CC(=O)N(C1)C 34a_100015185614_100000718602 [0,2,0,0,0,0|2,0,0]=4 6284 B14R1.3453 CCCCCCNC1CCS(=O)(=O)C1 2230a_100000683523_100000210314 [0,2,0,0,0,0|2,0,0]=4 6285 B14R1.3453 CCCCCCNC1CCS(=O)(=O)C1 34a_100000683523_100000210314 [0,2,0,0,0,0|2,0,0]=4 6286 B14R1.3453 CCCCCCOC1CCS(=O)(=O)C1 34a_100000186101_100000210314 [0,2,0,0,0,0|2,0,0]=4 6287 B14R1.3453 CCCCCCOC1CCS(=O)(=O)C1 7a_100000186101_100000210314 [0,2,0,0,0,0|2,0,0]=4 6288 B14R1.3453 CCCCCNCC1CCS(=O)(=O)C1 2230a_100000737051_100000210326 [0,2,0,0,0,0|2,0,0]=4 6289 B14R1.3453 CCCCCNCC1CCS(=O)(=O)C1 34a_100000737051_100000718602 [0,2,0,0,0,0|2,0,0]=4 6290 B14R1.59 CCCC(C)C(=O)CC1CCC(=O)N1 1458a_100000026770_100000766640 [0,2,0,0,0,0|1,0,1]=4 6291 B14R1.59 CCCC(C)C(=O)CC1CNC(=O)O1 1458a_100000210906_100000181169 [0,2,0,0,0,0|1,0,1]=4 6292 B14R1.59 CCCC(C)C(=O)CC1COC(=O)O1 1458a_100000210906_100000073702 [0,2,0,0,0,0|1,0,1]=4 6293 B14R1.59 CCCC(C)C(=O)C[C@@H]1CCC(=O)N1 1458a_100000210906_100015189358 [0,2,0,0,0,0|1,0,1]=4 6294 B14R1.59 CCCC(C)C(C)OC1COC(=O)O1 34a_100000708338_100000032252 [0,2,0,0,0,0|2,0,0]=4 6295 B14R1.59 CCC[C@H](O)C(=O)CC1CNC(=O)O1 1458a_100009822183_100000181169 [0,2,0,0,0,0|1,0,1]=4 6296 B14R1.59 CCC[C@H](O)C(=O)CC1COC(=O)O1 1458a_100009822183_100000073702 [0,2,0,0,0,0|1,0,1]=4 6297 B14R1.59 CCC[C@H](O)C(=O)C[C@@H]1CCC(=O)N1 1458a_100009822183_100015189358 [0,2,0,0,0,0|1,0,1]=4 6298 B14R1.755 CCC(C)C(C)NC[C@H]1CCC(=O)N1 269862a_100015423886_100000210599 [0,2,0,0,0,0|2,0,0]=4 6299 B14R1.755 CCC(C)C(C)NC[C@H]1CCC(=O)N1 270004a_100015423886_100000210599 [0,2,0,0,0,0|2,0,0]=4 6300 B14R1.755 CCC(C)C(C)OCC1CNC(=O)O1 7a_100011215189_100000181169 [0,2,0,0,0,0|2,0,0]=4 6301 B14R1.755 CCC(C)C(C)OC[C@@H]1CCC(=O)N1 7a_100011215189_100015189358 [0,2,0,0,0,0|2,0,0]=4 6302 B14R1.978 C#CC(CCC)OCC1CNC(=O)O1 34a_200011217317_100000181169 [0,2,0,0,0,0|2,0,0]=4 6303 B14R1.978 C#CC(CCC)OCC1CNC(=O)O1 7a_200011217317_100000181169 [0,2,0,0,0,0|2,0,0]=4 6304 B14R1.978 C#CC(CCC)OCC1COC(=O)O1 34a_200011217317_100000073702 [0,2,0,0,0,0|2,0,0]=4 6305 B14R1.978 C#CC(CCC)OC[C@@H]1CCC(=O)N1 7a_200011217317_100015189358 [0,2,0,0,0,0|2,0,0]=4 6306 B14R1.978 C=CC(CCC)OCC1CNC(=O)O1 34a_100011216692_100000181169 [0,2,0,0,0,0|2,0,0]=4 6307 B14R1.978 C=CC(CCC)OCC1CNC(=O)O1 7a_100011216692_100000181169 [0,2,0,0,0,0|2,0,0]=4 6308 B14R1.978 C=CC(CCC)OCC1COC(=O)O1 34a_100011216692_100000073702 [0,2,0,0,0,0|2,0,0]=4 6309 B14R1.978 C=CC(CCC)OC[C@@H]1CCC(=O)N1 7a_100011216692_100015189358 [0,2,0,0,0,0|2,0,0]=4 6310 B14R1.978 CCCC(C#N)OCC1CNC(=O)O1 34a_100000686963_100000181169 [0,2,0,0,0,0|2,0,0]=4 6311 B14R1.978 CCCC(C#N)OCC1CNC(=O)O1 7a_100000686963_100000181169 [0,2,0,0,0,0|2,0,0]=4 6312 B14R1.978 CCCC(C#N)OCC1COC(=O)O1 34a_100000686963_100000073702 [0,2,0,0,0,0|2,0,0]=4 6313 B14R1.978 CCCC(C#N)OC[C@@H]1CCC(=O)N1 7a_100000686963_100015189358 [0,2,0,0,0,0|2,0,0]=4 6314 B14R1.978 CCCC(CC)NCC1CNC(=O)O1 2230a_100000747048_100000181169 [0,2,0,0,0,0|2,0,0]=4 6315 B14R1.978 CCCC(CC)NC[C@@H]1CCC(=O)N1 2230a_100000747048_100015189358 [0,2,0,0,0,0|2,0,0]=4 6316 B14R1.978 CCCC(CC)NC[C@H]1CCC(=O)N1 270004a_100015423886_100000687865 [0,2,0,0,0,0|2,0,0]=4 6317 B14R1.978 CCCC(CC)OCC1CNC(=O)O1 34a_100000687864_100000181169 [0,2,0,0,0,0|2,0,0]=4 6318 B14R1.978 CCCC(CC)OCC1CNC(=O)O1 7a_100000687864_100000181169 [0,2,0,0,0,0|2,0,0]=4 6319 B14R1.978 CCCC(CC)OCC1COC(=O)O1 34a_100000687864_100000073702 [0,2,0,0,0,0|2,0,0]=4 6320 B14R1.978 CCCC(CC)OC[C@@H]1CCC(=O)N1 7a_100000687864_100015189358 [0,2,0,0,0,0|2,0,0]=4 6321 B14R1.978 CCCC(CC)SCC1CNC(=O)O1 62a_100000181169_100011219200 [0,2,0,0,0,0|2,0,0]=4 6322 B14R1.978 CCCC(CC)SCC1CNC(=O)O1 62a_100011219200_100000181169 [0,2,0,0,0,0|2,0,0]=4 6323 B14R1.978 CCCC(CC)SCC1COC(=O)O1 62a_100000073702_100011219200 [0,2,0,0,0,0|2,0,0]=4 6324 B14R1.978 CCCC(CC)SCC1COC(=O)O1 62a_100011219200_100000073702 [0,2,0,0,0,0|2,0,0]=4 6325 B14R1.978 CCCC(CC)SC[C@@H]1CCC(=O)N1 62a_100011219200_100015189358 [0,2,0,0,0,0|2,0,0]=4 6326 B14R1.978 CCCC(CC)SC[C@@H]1CCC(=O)N1 62a_100015189358_100011219200 [0,2,0,0,0,0|2,0,0]=4 6327 B14R1.978 CCC[C@@H](CO)NCC1CNC(=O)O1 2230a_100000732646_100000181169 [0,2,0,0,0,0|2,0,0]=4 6328 B14R1.978 CCC[C@@H](CO)NCC1CNC(=O)O1 34a_100000732646_100000181169 [0,2,0,0,0,0|2,0,0]=4 6329 B14R1.978 CCC[C@@H](CO)NCC1COC(=O)O1 34a_100000732646_100000073702 [0,2,0,0,0,0|2,0,0]=4 6330 B14R1.978 CCC[C@@H](CO)NC[C@@H]1CCC(=O)N1 2230a_100000732646_100015189358 [0,2,0,0,0,0|2,0,0]=4 6331 B14R1.4262 CC(C)CC(C)NCC1CNC(=O)O1 2230a_100000692259_100000181169 [0,2,0,0,0,0|2,0,0]=4 6332 B14R1.4262 CC(C)CC(C)NC[C@@H]1CCC(=O)N1 2230a_100000692259_100015189358 [0,2,0,0,0,0|2,0,0]=4 6333 B14R1.4262 CC(C)CC(C)NC[C@H]1CCC(=O)N1 2230a_100015423886_100000731052 [0,2,0,0,0,0|2,0,0]=4 6334 B14R1.4262 CC(C)CC(C)NC[C@H]1CCC(=O)N1 34a_100015423886_100000731052 [0,2,0,0,0,0|2,0,0]=4 6335 B14R1.4262 CC(C)CC(C)OCC1CCC(=O)N1 34a_100000737831_100000731052 [0,2,0,0,0,0|2,0,0]=4 6336 B14R1.4262 CC(C)CC(C)OCC1CNC(=O)O1 34a_100000211805_100000181169 [0,2,0,0,0,0|2,0,0]=4 6337 B14R1.4262 CC(C)CC(C)OCC1CNC(=O)O1 34a_100011315639_100000731052 [0,2,0,0,0,0|2,0,0]=4 6338 B14R1.4262 CC(C)CC(C)OCC1CNC(=O)O1 7a_100000211805_100000181169 [0,2,0,0,0,0|2,0,0]=4 6339 B14R1.4262 CC(C)CC(C)OCC1COC(=O)O1 34a_100000211805_100000073702 [0,2,0,0,0,0|2,0,0]=4 6340 B14R1.4262 CC(C)CC(C)OC[C@@H]1CCC(=O)N1 7a_100000211805_100015189358 [0,2,0,0,0,0|2,0,0]=4 6341 B14R1.4262 CC(C)CC(C)SCC1CNC(=O)O1 62a_100000181169_100000731052 [0,2,0,0,0,0|2,0,0]=4 6342 B14R1.4262 CC(C)CC(C)SCC1CNC(=O)O1 62a_100000731052_100000181169 [0,2,0,0,0,0|2,0,0]=4 6343 B14R1.4262 CC(C)CC(C)SCC1COC(=O)O1 62a_100000073702_100000731052 [0,2,0,0,0,0|2,0,0]=4 6344 B14R1.4262 CC(C)CC(C)SCC1COC(=O)O1 62a_100000731052_100000073702 [0,2,0,0,0,0|2,0,0]=4 6345 B14R1.4262 CC(C)CC(C)SC[C@@H]1CCC(=O)N1 62a_100000731052_100015189358 [0,2,0,0,0,0|2,0,0]=4 6346 B14R1.4262 CC(C)CC(C)SC[C@@H]1CCC(=O)N1 62a_100015189358_100000731052 [0,2,0,0,0,0|2,0,0]=4 6347 B14R1.4262 CC(C)C[C@H](N)COC1COC(=O)O1 34a_100011830311_100000032252 [0,2,0,0,0,0|2,0,0]=4 6348 B14R1.6828 CCCC(C)(C)OCC1CNC(=O)O1 7a_100000748436_100000181169 [0,2,0,0,0,0|2,0,0]=4 6349 B14R1.6828 CCCC(C)(C)OC[C@@H]1CCC(=O)N1 7a_100000748436_100015189358 [0,2,0,0,0,0|2,0,0]=4 6350 B14R1.129 CC(C)CCC(=O)CC1CCC(=O)N1 1458a_100000026770_100000210312 [0,2,0,0,0,0|1,0,1]=4 6351 B14R1.129 CC(C)CCC(=O)CC1CNC(=O)O1 1458a_100000181311_100000181169 [0,2,0,0,0,0|1,0,1]=4 6352 B14R1.129 CC(C)CCC(=O)CC1COC(=O)O1 1458a_100000181311_100000073702 [0,2,0,0,0,0|1,0,1]=4 6353 B14R1.129 CC(C)CCC(=O)C[C@@H]1CCC(=O)N1 1458a_100000181311_100015189358 [0,2,0,0,0,0|1,0,1]=4 6354 B14R1.129 CC(C)CCC(C)OC1CCC(=O)C1 34a_100012614533_100011261404 [0,2,0,0,0,0|2,0,0]=4 6355 B14R1.129 CC(C)CCC(C)OC1COC(=O)O1 34a_100011215350_100000032252 [0,2,0,0,0,0|2,0,0]=4 6356 B14R1.129 CC(C)CCC(C)SC1COC(=O)O1 62a_100011261404_100000032252 [0,2,0,0,0,0|2,0,0]=4 6357 B14R1.129 CC(C)CCN(C)CC1CNC(=O)O1 2230a_100000742789_100000181169 [0,2,0,0,0,0|2,0,0]=4 6358 B14R1.129 CC(C)CCN(C)CC1CNC(=O)O1 269982a_100000742789_100000181169 [0,2,0,0,0,0|2,0,0]=4 6359 B14R1.129 CC(C)CCN(C)CC1COC(=O)O1 269982a_100000742789_100000073702 [0,2,0,0,0,0|2,0,0]=4 6360 B14R1.129 CC(C)CCN(C)C[C@@H]1CCC(=O)N1 2230a_100000742789_100015189358 [0,2,0,0,0,0|2,0,0]=4 6361 B14R1.129 CC(C)CCN(C)C[C@@H]1CCC(=O)N1 269982a_100000742789_100015189358 [0,2,0,0,0,0|2,0,0]=4 6362 B14R1.129 CC(O)CCC(=O)CC1CCC(=O)N1 1458a_100000026770_100012276601 [0,2,0,0,0,0|1,0,1]=4 6363 B14R1.466 C#CC(CCCC)OC1COC(=O)O1 34a_200011217967_100000032252 [0,2,0,0,0,0|2,0,0]=4 6364 B14R1.466 C=CC(CCCC)OC1COC(=O)O1 34a_200011215037_100000032252 [0,2,0,0,0,0|2,0,0]=4 6365 B14R1.466 CCCCC(CC)OC1CCC(=O)C1 34a_100012614533_200011216223 [0,2,0,0,0,0|2,0,0]=4 6366 B14R1.466 CCCCC(CC)OC1COC(=O)O1 34a_100011215227_100000032252 [0,2,0,0,0,0|2,0,0]=4 6367 B14R1.466 CCCCC(CC)SC1COC(=O)O1 62a_200011216223_100000032252 [0,2,0,0,0,0|2,0,0]=4 6368 B14R1.466 CCCCN(CC)CC1CNC(=O)O1 2230a_100000207695_100000181169 [0,2,0,0,0,0|2,0,0]=4 6369 B14R1.466 CCCCN(CC)CC1CNC(=O)O1 269982a_100000207695_100000181169 [0,2,0,0,0,0|2,0,0]=4 6370 B14R1.466 CCCCN(CC)CC1COC(=O)O1 269982a_100000207695_100000073702 [0,2,0,0,0,0|2,0,0]=4 6371 B14R1.466 CCCCN(CC)C[C@@H]1CCC(=O)N1 2230a_100000207695_100015189358 [0,2,0,0,0,0|2,0,0]=4 6372 B14R1.466 CCCCN(CC)C[C@@H]1CCC(=O)N1 269982a_100000207695_100015189358 [0,2,0,0,0,0|2,0,0]=4 6373 B14R1.466 CCCC[C@@H](CO)NC1COC(=O)O1 34a_100011934283_100000032252 [0,2,0,0,0,0|2,0,0]=4 6374 B14R1.742 CCC(C)CC(=O)CC1CCC(=O)N1 1458a_100000026770_100000748023 [0,2,0,0,0,0|1,0,1]=4 6375 B14R1.742 CCC(C)CC(=O)CC1CNC(=O)O1 1458a_100000708755_100000181169 [0,2,0,0,0,0|1,0,1]=4 6376 B14R1.742 CCC(C)CC(=O)CC1COC(=O)O1 1458a_100000708755_100000073702 [0,2,0,0,0,0|1,0,1]=4 6377 B14R1.742 CCC(C)CC(=O)C[C@@H]1CCC(=O)N1 1458a_100000708755_100015189358 [0,2,0,0,0,0|1,0,1]=4 6378 B14R1.742 CCC(C)CN(C)CC1CNC(=O)O1 2230a_100000753921_100000181169 [0,2,0,0,0,0|2,0,0]=4 6379 B14R1.742 CCC(C)CN(C)CC1CNC(=O)O1 269982a_100000753921_100000181169 [0,2,0,0,0,0|2,0,0]=4 6380 B14R1.742 CCC(C)CN(C)CC1COC(=O)O1 269982a_100000753921_100000073702 [0,2,0,0,0,0|2,0,0]=4 6381 B14R1.742 CCC(C)CN(C)C[C@@H]1CCC(=O)N1 2230a_100000753921_100015189358 [0,2,0,0,0,0|2,0,0]=4 6382 B14R1.742 CCC(C)CN(C)C[C@@H]1CCC(=O)N1 269982a_100000753921_100015189358 [0,2,0,0,0,0|2,0,0]=4 6383 B14R1.742 CCC(O)CC(=O)CC1CCC(=O)N1 1458a_100000026770_100011218378 [0,2,0,0,0,0|1,0,1]=4 6384 B14R1.742 CCC(O)CC(=O)CC1CNC(=O)O1 1458a_100011667805_100000181169 [0,2,0,0,0,0|1,0,1]=4 6385 B14R1.742 CCC(O)CC(=O)CC1COC(=O)O1 1458a_100011667805_100000073702 [0,2,0,0,0,0|1,0,1]=4 6386 B14R1.742 CCC(O)CC(=O)C[C@@H]1CCC(=O)N1 1458a_100011667805_100015189358 [0,2,0,0,0,0|1,0,1]=4 6387 B14R1.742 CC[C@H](C)CC(=O)CC1CCC(=O)N1 1458a_100000026770_100009816398 [0,2,0,0,0,0|1,0,1]=4 6388 B14R1.130 CC(C)C(N)CCOC1COC(=O)O1 34a_100161115045_100000032252 [0,2,0,0,0,0|2,0,0]=4 6389 B14R1.130 CC(C)C(O)CNCC1CNC(=O)O1 2230a_100000759067_100000181169 [0,2,0,0,0,0|2,0,0]=4 6390 B14R1.130 CC(C)C(O)CNCC1CNC(=O)O1 34a_100000759067_100000181169 [0,2,0,0,0,0|2,0,0]=4 6391 B14R1.130 CC(C)C(O)CNCC1COC(=O)O1 34a_100000759067_100000073702 [0,2,0,0,0,0|2,0,0]=4 6392 B14R1.130 CC(C)C(O)CNC[C@@H]1CCC(=O)N1 2230a_100000759067_100015189358 [0,2,0,0,0,0|2,0,0]=4 6393 B14R1.130 CC(C)[C@@H](N)COCC1CNC(=O)O1 34a_100011830312_100000181169 [0,2,0,0,0,0|2,0,0]=4 6394 B14R1.130 CC(C)[C@@H](N)COCC1COC(=O)O1 34a_100011830312_100000073702 [0,2,0,0,0,0|2,0,0]=4 6395 B14R1.4258 CC(C)(C)CCNCC1CNC(=O)O1 2230a_100000738805_100000181169 [0,2,0,0,0,0|2,0,0]=4 6396 B14R1.4258 CC(C)(C)CCNC[C@@H]1CCC(=O)N1 2230a_100000738805_100015189358 [0,2,0,0,0,0|2,0,0]=4 6397 B14R1.4258 CC(C)(C)CCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000755188 [0,2,0,0,0,0|2,0,0]=4 6398 B14R1.4258 CC(C)(C)CCNC[C@H]1CCC(=O)N1 34a_100015423886_100000755188 [0,2,0,0,0,0|2,0,0]=4 6399 B14R1.4258 CC(C)(C)CCOCC1CCC(=O)N1 34a_100000737831_100000755188 [0,2,0,0,0,0|2,0,0]=4 6400 B14R1.4258 CC(C)(C)CCOCC1CNC(=O)O1 34a_100011315639_100000755188 [0,2,0,0,0,0|2,0,0]=4 6401 B14R1.4258 CC(C)(C)CCOCC1CNC(=O)O1 7a_100000765024_100000181169 [0,2,0,0,0,0|2,0,0]=4 6402 B14R1.4258 CC(C)(C)CCOC[C@@H]1CCC(=O)N1 7a_100000765024_100015189358 [0,2,0,0,0,0|2,0,0]=4 6403 B14R1.4258 CC(C)(C)CCSCC1CNC(=O)O1 62a_100000181169_100000755188 [0,2,0,0,0,0|2,0,0]=4 6404 B14R1.4258 CC(C)(C)CCSCC1CNC(=O)O1 62a_100000755188_100000181169 [0,2,0,0,0,0|2,0,0]=4 6405 B14R1.4258 CC(C)(C)CCSCC1COC(=O)O1 62a_100000073702_100000755188 [0,2,0,0,0,0|2,0,0]=4 6406 B14R1.4258 CC(C)(C)CCSCC1COC(=O)O1 62a_100000755188_100000073702 [0,2,0,0,0,0|2,0,0]=4 6407 B14R1.4258 CC(C)(C)CCSC[C@@H]1CCC(=O)N1 62a_100000755188_100015189358 [0,2,0,0,0,0|2,0,0]=4 6408 B14R1.4258 CC(C)(C)CCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000755188 [0,2,0,0,0,0|2,0,0]=4 6409 B14R1.4258 CC(C)(F)CCNCC1CNC(=O)O1 2230a_100016253952_100000181169 [0,2,0,0,0,0|2,0,0]=4 6410 B14R1.4258 CC(C)(F)CCNC[C@@H]1CCC(=O)N1 2230a_100016253952_100015189358 [0,2,0,0,0,0|2,0,0]=4 6411 B14R1.4258 CC(C)(O)CCCOC1CCC(=O)C1 34a_100012614533_100009888830 [0,2,0,0,0,0|2,0,0]=4 6412 B14R1.4258 CC(C)(O)CCCSC1COC(=O)O1 62a_100009888830_100000032252 [0,2,0,0,0,0|2,0,0]=4 6413 B14R1.4258 CC(C)(O)CCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000702414 [0,2,0,0,0,0|2,0,0]=4 6414 B14R1.4258 CC(C)(O)CCNC[C@H]1CCC(=O)N1 34a_100015423886_100000702414 [0,2,0,0,0,0|2,0,0]=4 6415 B14R1.4258 CC(C)(O)CCOCC1CCC(=O)N1 34a_100000737831_100000702414 [0,2,0,0,0,0|2,0,0]=4 6416 B14R1.4258 CC(C)(O)CCOCC1CNC(=O)O1 34a_100011315639_100000702414 [0,2,0,0,0,0|2,0,0]=4 6417 B14R1.4258 CC(C)(O)CCSCC1CNC(=O)O1 62a_100000181169_100000702414 [0,2,0,0,0,0|2,0,0]=4 6418 B14R1.4258 CC(C)(O)CCSCC1CNC(=O)O1 62a_100000702414_100000181169 [0,2,0,0,0,0|2,0,0]=4 6419 B14R1.4258 CC(C)(O)CCSCC1COC(=O)O1 62a_100000073702_100000702414 [0,2,0,0,0,0|2,0,0]=4 6420 B14R1.4258 CC(C)(O)CCSCC1COC(=O)O1 62a_100000702414_100000073702 [0,2,0,0,0,0|2,0,0]=4 6421 B14R1.4258 CC(C)(O)CCSC[C@@H]1CCC(=O)N1 62a_100000702414_100015189358 [0,2,0,0,0,0|2,0,0]=4 6422 B14R1.4258 CC(C)(O)CCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000702414 [0,2,0,0,0,0|2,0,0]=4 6423 B14R1.291 CCC(C)(C)COCC1CNC(=O)O1 7a_100000765029_100000181169 [0,2,0,0,0,0|2,0,0]=4 6424 B14R1.291 CCC(C)(C)COC[C@@H]1CCC(=O)N1 7a_100000765029_100015189358 [0,2,0,0,0,0|2,0,0]=4 6425 B14R1.545 CCC(CC)CNCC1CNC(=O)O1 2230a_100102946423_100000181169 [0,2,0,0,0,0|2,0,0]=4 6426 B14R1.545 CCC(CC)CNC[C@@H]1CCC(=O)N1 2230a_100102946423_100015189358 [0,2,0,0,0,0|2,0,0]=4 6427 B14R1.545 CCC(CC)CNC[C@H]1CCC(=O)N1 2230a_100015423886_100011215472 [0,2,0,0,0,0|2,0,0]=4 6428 B14R1.545 CCC(CC)CNC[C@H]1CCC(=O)N1 269862a_100015423886_100000211137 [0,2,0,0,0,0|2,0,0]=4 6429 B14R1.545 CCC(CC)CNC[C@H]1CCC(=O)N1 270004a_100015423886_100000211137 [0,2,0,0,0,0|2,0,0]=4 6430 B14R1.545 CCC(CC)CNC[C@H]1CCC(=O)N1 34a_100015423886_100011215472 [0,2,0,0,0,0|2,0,0]=4 6431 B14R1.545 CCC(CC)COCC1CCC(=O)N1 34a_100000737831_100011215472 [0,2,0,0,0,0|2,0,0]=4 6432 B14R1.545 CCC(CC)COCC1CNC(=O)O1 34a_100011315639_100011215472 [0,2,0,0,0,0|2,0,0]=4 6433 B14R1.545 CCC(CC)COCC1CNC(=O)O1 7a_100000703878_100000181169 [0,2,0,0,0,0|2,0,0]=4 6434 B14R1.545 CCC(CC)COC[C@@H]1CCC(=O)N1 7a_100000703878_100015189358 [0,2,0,0,0,0|2,0,0]=4 6435 B14R1.545 CCC(CC)CSCC1CNC(=O)O1 62a_100000181169_100011215472 [0,2,0,0,0,0|2,0,0]=4 6436 B14R1.545 CCC(CC)CSCC1CNC(=O)O1 62a_100011215472_100000181169 [0,2,0,0,0,0|2,0,0]=4 6437 B14R1.545 CCC(CC)CSCC1COC(=O)O1 62a_100000073702_100011215472 [0,2,0,0,0,0|2,0,0]=4 6438 B14R1.545 CCC(CC)CSCC1COC(=O)O1 62a_100011215472_100000073702 [0,2,0,0,0,0|2,0,0]=4 6439 B14R1.545 CCC(CC)CSC[C@@H]1CCC(=O)N1 62a_100011215472_100015189358 [0,2,0,0,0,0|2,0,0]=4 6440 B14R1.545 CCC(CC)CSC[C@@H]1CCC(=O)N1 62a_100015189358_100011215472 [0,2,0,0,0,0|2,0,0]=4 6441 B14R1.545 CCC(COCC1CNC(=O)O1)OC 34a_100011934954_100000181169 [0,2,0,0,0,0|2,0,0]=4 6442 B14R1.545 CCC(COCC1CNC(=O)O1)OC 7a_100011934954_100000181169 [0,2,0,0,0,0|2,0,0]=4 6443 B14R1.545 CCC(COCC1COC(=O)O1)OC 34a_100011934954_100000073702 [0,2,0,0,0,0|2,0,0]=4 6444 B14R1.545 CCC(COC[C@@H]1CCC(=O)N1)OC 7a_100011934954_100015189358 [0,2,0,0,0,0|2,0,0]=4 6445 B12R1.107 CC(=O)CC(C)N1CCCCC1 1458a_100015187720_200000210301 [0,0,1,1,0,0|2,0,0]=4 6446 B12R1.107 CC(=O)N[C@H](C)C1CCCCC1 11a_100025707633_100015343762 [0,0,1,1,0,0|1,0,0]=3 6447 B12R1.107 CC(=O)N[C@H](C)C1CCCCC1 1626a_100025707633_100015343762 [0,0,1,1,0,0|1,0,0]=3 6448 B12R1.107 CC(=O)N[C@H](C)C1CCCCC1 240690a_100025707633_100015343762 [0,0,1,1,0,0|1,0,0]=3 6449 B12R1.107 CC(=O)N[C@H](C)C1CCCCC1 527a_100025707633_100103153847 [0,0,1,1,0,0|1,0,0]=3 6450 B12R1.107 CC(=O)OC(C)N1CCCOC1 269982a_100000131196_100009818208 [0,0,1,1,0,0|2,0,0]=4 6451 B12R1.107 CC(=O)OC(C)N1CCOCC1 269982a_100015191051_100009818208 [0,0,1,1,0,0|2,0,0]=4 6452 B12R1.107 CC(=O)OC(C)N1CCSCC1 269982a_100000737611_100009818208 [0,0,1,1,0,0|2,0,0]=4 6453 B12R1.107 CC(C)OC(C)C1CCCCC1 34a_100011216961_100000210206 [0,0,1,1,0,0|1,0,1]=4 6454 B12R1.107 CC(C)OC(C)C1CCCCC1 7a_100011216961_100000210206 [0,0,1,1,0,0|1,0,1]=4 6455 B12R1.107 CC(CC(=O)[13CH3])N1CCCCC1 1458a_100015187720_200025704644 [0,0,1,1,0,0|2,0,0]=4 6456 B12R1.144 CC(=O)OC(C)N1CCC[C@@H]1C 269982a_100020605311_100009818208 [0,0,1,1,0,0|1,0,0]=3 6457 B12R1.144 CC(=O)OC(C)N1CCC[C@H]1C 269982a_100015189458_100009818208 [0,0,1,1,0,0|1,0,0]=3 6458 B12R1.144 CC(=O)OC(C)N1CCSC1C 269982a_200011216479_100009818208 [0,0,1,1,0,0|2,0,0]=4 6459 B12R1.182 CCCN1CC[C@@H](C1)NC(=O)C 2230a_100016989438_100000210303 [0,0,1,1,0,0|2,0,0]=4 6460 B12R1.182 CCCN1CC[C@@H](C1)NC(=O)C 269982a_100016989438_100000210303 [0,0,1,1,0,0|2,0,0]=4 6461 B12R1.260 CC(=O)NC(C)CN1CCCC1 11a_100000742930_100015343762 [0,0,1,1,0,0|2,0,0]=4 6462 B12R1.260 CC(=O)NC(C)CN1CCCC1 1626a_100000742930_100015343762 [0,0,1,1,0,0|2,0,0]=4 6463 B12R1.260 CC(=O)NC(C)CN1CCCC1 240690a_100000742930_100015343762 [0,0,1,1,0,0|2,0,0]=4 6464 B12R1.260 CC(=O)OC(C)SC1CCCC1 62a_100009818208_100000179811 [0,0,1,1,0,0|1,0,0]=3 6465 B12R1.260 CC(=O)OC(C)SC1CCCC1 62a_100011217020_100009818208 [0,0,1,1,0,0|1,0,0]=3 6466 B12R1.260 CC(=O)OC(C)SC1CCOC1 62a_100009818208_100000690089 [0,0,1,1,0,0|2,0,0]=4 6467 B12R1.332 CC(=O)OC1CN(C1)CCCF 269982a_100016994906_100011934791 [0,0,1,1,0,0|2,0,0]=4 6468 B12R1.332 CC(=O)OC1CN(C1)CCCO 269982a_100016994906_100011215043 [0,0,1,1,0,0|2,0,0]=4 6469 B12R1.332 CCCCN1CC(C1)OC(=O)C 269982a_100016994906_100000210211 [0,0,1,1,0,0|1,0,0]=3 6470 B12R1.332 CCOCN1CC(C1)OC(=O)C 269982a_100016994906_100000739092 [0,0,1,1,0,0|2,0,0]=4 6471 B12R1.332 COCCN1CC(C1)OC(=O)C 269982a_100016994906_100000233755 [0,0,1,1,0,0|2,0,0]=4 6472 B12R1.332 CSCCN1CC(C1)OC(=O)C 269982a_100016994906_100000212216 [0,0,1,1,0,0|2,0,0]=4 6473 B12R1.438 CCC1CCCC(C1)OC(C)C 7a_100011985506_100000210206 [0,0,1,1,0,0|1,0,1]=4 6474 B12R1.438 CCN1CCCC(C1)NC(=O)C 2230a_106657272119_100000210202 [0,0,1,1,0,0|2,0,0]=4 6475 B12R1.438 CCN1CCCC(C1)NC(=O)C 269982a_106657272119_100000204670 [0,0,1,1,0,0|2,0,0]=4 6476 B12R1.438 CCN1CCC[C@H](C1)NC(=O)C 11a_100025775482_100015343762 [0,0,1,1,0,0|2,0,0]=4 6477 B12R1.438 CCN1CCC[C@H](C1)NC(=O)C 1626a_100025775482_100015343762 [0,0,1,1,0,0|2,0,0]=4 6478 B12R1.438 CCN1CCC[C@H](C1)NC(=O)C 240690a_100025775482_100015343762 [0,0,1,1,0,0|2,0,0]=4 6479 B12R1.438 CCN1CCC[C@H](C1)NC(=O)C 527a_100025775482_100103153847 [0,0,1,1,0,0|2,0,0]=4 6480 B12R1.563 CCCCCCC(C)OC1CC1 34a_100000210265_100000211595 [0,0,1,1,0,0|1,0,1]=4 6481 B12R1.1376 CC(=O)OC(C)SCC1CCC1 62a_100000763275_100009818208 [0,0,1,1,0,0|1,0,0]=3 6482 B12R1.1376 CC(=O)OC(C)SCC1CCC1 62a_100009818208_100000763275 [0,0,1,1,0,0|1,0,0]=3 6483 B12R1.1376 CC(=O)OC(C)SCC1CCO1 62a_100000103362_100009818208 [0,0,1,1,0,0|2,0,0]=4 6484 B12R1.1376 CC(=O)OC(C)SCC1CCO1 62a_100009818208_100000103362 [0,0,1,1,0,0|2,0,0]=4 6485 B12R1.1376 CC(=O)OC(C)SCC1COC1 62a_100009818208_100010264016 [0,0,1,1,0,0|2,0,0]=4 6486 B12R1.1376 CC(=O)OC(C)SCC1COC1 62a_100010264016_100009818208 [0,0,1,1,0,0|2,0,0]=4 6487 B12R1.1377 CC(=O)OC(C)SCCC1CC1 62a_100000764125_100009818208 [0,0,1,1,0,0|1,0,0]=3 6488 B12R1.1377 CC(=O)OC(C)SCCC1CC1 62a_100009818208_100000764125 [0,0,1,1,0,0|1,0,0]=3 6489 B12R1.1377 CC(=O)OC(C)SCCC1CO1 62a_100000732470_100009818208 [0,0,1,1,0,0|2,0,0]=4 6490 B12R1.1377 CC(=O)OC(C)SCCC1CO1 62a_100009818208_100000732470 [0,0,1,1,0,0|2,0,0]=4 6491 B12R1.1392 CC(=O)NC1CCCCCCC1 11a_100000211152_100015343762 [0,0,1,1,0,0|1,0,0]=3 6492 B12R1.1392 CC(=O)NC1CCCCCCC1 1626a_100000211152_100015343762 [0,0,1,1,0,0|1,0,0]=3 6493 B12R1.1392 CC(=O)NC1CCCCCCC1 240690a_100000211152_100015343762 [0,0,1,1,0,0|1,0,0]=3 6494 B12R1.1392 CC(=O)NC1CCCCCCC1 527a_100000211152_100103153847 [0,0,1,1,0,0|1,0,0]=3 6495 B12R1.1392 CC(C)OC1CCCCCCC1 34a_100000210054_100000210206 [0,0,1,1,0,0|1,0,1]=4 6496 B12R1.1392 CC(C)OC1CCCCCCC1 7a_100000210054_100000210206 [0,0,1,1,0,0|1,0,1]=4 6497 B12R1.1829 CC(=O)NC1(CCCCCC1)C 11a_100000704638_100015343762 [0,0,1,1,0,0|1,0,0]=3 6498 B12R1.1829 CC(=O)NC1(CCCCCC1)C 1626a_100000704638_100015343762 [0,0,1,1,0,0|1,0,0]=3 6499 B12R1.1829 CC(=O)NC1(CCCCCC1)C 240690a_100000704638_100015343762 [0,0,1,1,0,0|1,0,0]=3 6500 B12R1.1829 CC(=O)NC1(CCCCCC1)C 527a_100000704638_100103153847 [0,0,1,1,0,0|1,0,0]=3 6501 B12R1.1829 CC(C)OC1(CCCCCC1)C 34a_100000708895_100000210206 [0,0,1,1,0,0|1,0,1]=4 6502 B12R1.1829 CC(C)OC1(CCCCCC1)C 7a_100000708895_100000210206 [0,0,1,1,0,0|1,0,1]=4 6503 B12R1.1 CCCCNC1CCC(=O)NC1 2230a_100000748762_100000210211 [0,0,1,1,0,0|2,0,0]=4 6504 B12R1.1 CCCCNC1CCC(=O)NC1 34a_100000748762_100000210210 [0,0,1,1,0,0|2,0,0]=4 6505 B12R1.1 CCCCOC1CCC(=O)CC1 34a_100000764474_100000210210 [0,0,1,1,0,0|2,0,0]=4 6506 B12R1.1 CCCCOC1CCC(=O)CC1 7a_100000764474_100000210211 [0,0,1,1,0,0|2,0,0]=4 6507 B12R1.1 CCCCOC1CCC(=O)NC1 34a_100000079199_100000210210 [0,0,1,1,0,0|2,0,0]=4 6508 B12R1.1 CCCOCC1CCC(=O)CC1 34a_100000062911_100000210303 [0,0,1,1,0,0|2,0,0]=4 6509 B12R1.25 CCCCN1CCNC(=O)C1C 2230a_100000750721_100000210211 [0,0,1,1,0,0|2,0,0]=4 6510 B12R1.25 CCCCN1CCNC(=O)C1C 269982a_100000750721_100000210211 [0,0,1,1,0,0|2,0,0]=4 6511 B12R1.25 CCCCN1CCNC(=O)C1C 34a_100000750721_100000210210 [0,0,1,1,0,0|2,0,0]=4 6512 B12R1.27 CCC(=O)C=CC1CCCCC1 1458a_100102566626_100000210202 [0,0,1,1,0,0|1,0,1]=4 6513 B12R1.27 CCC(=O)CCC1CCCCC1 1458a_100000210414_100011273959 [0,0,1,1,0,0|1,0,0]=3 6514 B12R1.27 CCC(=O)CCC1CCCCC1 1458a_100000211375_100000210202 [0,0,1,1,0,0|1,0,0]=3 6515 B12R1.27 CCC(=O)CCC1CCOCC1 1458a_100000210414_100011934994 [0,0,1,1,0,0|2,0,0]=4 6516 B12R1.27 CCC(=O)CCN1CCCCC1 1458a_100000210414_100000739454 [0,0,1,1,0,0|2,0,0]=4 6517 B12R1.27 CCC(=O)CCN1CCCCC1 1458a_100000743487_100000210202 [0,0,1,1,0,0|2,0,0]=4 6518 B12R1.27 CCC(=O)COC1CCCCC1 1458a_100000210414_100011935260 [0,0,1,1,0,0|2,0,0]=4 6519 B12R1.27 CCC(=O)COC1CCCCC1 1458a_100011223303_100000210202 [0,0,1,1,0,0|2,0,0]=4 6520 B12R1.27 CCC(=O)COC1CCCCC1 34a_100000725409_100000210327 [0,0,1,1,0,0|2,0,0]=4 6521 B12R1.27 CCC(=O)COC1CCCCC1 7a_100000210231_100000747405 [0,0,1,1,0,0|2,0,0]=4 6522 B12R1.27 CCC(=O)CSC1CCCCC1 62a_100000210327_100000747405 [0,0,1,1,0,0|2,0,0]=4 6523 B12R1.27 CCC(=O)CSC1CCCCC1 62a_100000747405_100000210327 [0,0,1,1,0,0|2,0,0]=4 6524 B12R1.27 CCC(=O)NCC1CCCCC1 11a_100000210473_100000210414 [0,0,1,1,0,0|1,0,0]=3 6525 B12R1.27 CCC(=O)NCC1CCCCC1 1626a_100000210473_100000210414 [0,0,1,1,0,0|1,0,0]=3 6526 B12R1.27 CCC(=O)NCC1CCCCC1 240690a_100000210473_100000210414 [0,0,1,1,0,0|1,0,0]=3 6527 B12R1.27 CCC(=O)NCC1CCCCC1 527a_100000210473_100000210414 [0,0,1,1,0,0|1,0,0]=3 6528 B12R1.27 CCC(=O)NCC1CCCCO1 11a_100000174945_100000210414 [0,0,1,1,0,0|2,0,0]=4 6529 B12R1.27 CCC(=O)NCC1CCCCO1 1626a_100000174945_100000210414 [0,0,1,1,0,0|2,0,0]=4 6530 B12R1.27 CCC(=O)NCC1CCCCO1 240690a_100000174945_100000210414 [0,0,1,1,0,0|2,0,0]=4 6531 B12R1.27 CCC(=O)NCC1CCCCO1 527a_100000174945_100000210414 [0,0,1,1,0,0|2,0,0]=4 6532 B12R1.27 CCC(=O)NCC1CCCOC1 11a_100000720124_100000210414 [0,0,1,1,0,0|2,0,0]=4 6533 B12R1.27 CCC(=O)NCC1CCCOC1 1626a_100000720124_100000210414 [0,0,1,1,0,0|2,0,0]=4 6534 B12R1.27 CCC(=O)NCC1CCCOC1 240690a_100000720124_100000210414 [0,0,1,1,0,0|2,0,0]=4 6535 B12R1.27 CCC(=O)NCC1CCCOC1 527a_100000720124_100000210414 [0,0,1,1,0,0|2,0,0]=4 6536 B12R1.27 CCC(=O)NCC1CCOCC1 11a_100000746373_100000210414 [0,0,1,1,0,0|2,0,0]=4 6537 B12R1.27 CCC(=O)NCC1CCOCC1 1626a_100000746373_100000210414 [0,0,1,1,0,0|2,0,0]=4 6538 B12R1.27 CCC(=O)NCC1CCOCC1 240690a_100000746373_100000210414 [0,0,1,1,0,0|2,0,0]=4 6539 B12R1.27 CCC(=O)NCC1CCOCC1 527a_100000746373_100000210414 [0,0,1,1,0,0|2,0,0]=4 6540 B12R1.27 CCC(=O)NCC1CCSCC1 11a_100015188806_100000210414 [0,0,1,1,0,0|2,0,0]=4 6541 B12R1.27 CCC(=O)NCC1CCSCC1 240690a_100015188806_100000210414 [0,0,1,1,0,0|2,0,0]=4 6542 B12R1.27 CCC(=O)NCC1CCSCC1 527a_100015188806_100000210414 [0,0,1,1,0,0|2,0,0]=4 6543 B12R1.27 CCC(=O)NNC1CCCCC1 22a_100000709804_100000210414 [0,0,1,1,0,0|2,0,0]=4 6544 B12R1.27 CCC(C)OCC1CCCCC1 34a_100000212181_100011215416 [0,0,1,1,0,0|1,0,1]=4 6545 B12R1.27 CCC(C)OCC1CCCCC1 7a_100000210228_100000211423 [0,0,1,1,0,0|1,0,1]=4 6546 B12R1.27 CCC(C)OCC1CCCCC1 7a_100000212181_100000758301 [0,0,1,1,0,0|1,0,1]=4 6547 B12R1.27 CNC(=O)CCC1CCCCC1 11a_106832991635_100000211375 [0,0,1,1,0,0|2,0,0]=4 6548 B12R1.27 CNC(=O)CCC1CCCCC1 1626a_100102657272_100000211375 [0,0,1,1,0,0|2,0,0]=4 6549 B12R1.27 CNC(=O)CCC1CCCCC1 240690a_100102657272_100000211375 [0,0,1,1,0,0|2,0,0]=4 6550 B12R1.27 CNC(=O)CCC1CCCCC1 527a_100102657272_100000211375 [0,0,1,1,0,0|2,0,0]=4 6551 B12R1.27 CNC(=O)NCC1CCCCC1 2708a_100000210473_106832991635 [0,0,1,1,0,0|2,0,0]=4 6552 B12R1.27 CNC(=O)NCC1CCCCC1 2708a_100102657272_100000210473 [0,0,1,1,0,0|2,0,0]=4 6553 B12R1.27 CNC(=O)NCC1CCCCC1 273464a_100000210473_100102657272 [0,0,1,1,0,0|2,0,0]=4 6554 B12R1.27 CNC(=O)NCC1CCCCC1 273464a_100102657272_100000210473 [0,0,1,1,0,0|2,0,0]=4 6555 B12R1.27 CNC(=O)NCC1CCCCC1 512a_106832991638_100000210473 [0,0,1,1,0,0|2,0,0]=4 6556 B12R1.27 O=C(CF)CCC1CCCCC1 1458a_100000211375_100015361967 [0,0,1,1,0,0|2,0,0]=4 6557 B12R1.27 O=C(CO)CCC1CCCCC1 1458a_100000210174_100011273959 [0,0,1,1,0,0|2,0,0]=4 6558 B12R1.27 O=C(CO)NCC1CCCCC1 240690a_100000210473_100000210174 [0,0,1,1,0,0|2,0,0]=4 6559 B12R1.27 O=C(CO)NCC1CCCCC1 527a_100000210473_100000210174 [0,0,1,1,0,0|2,0,0]=4 6560 B12R1.77 CCC(=O)C1CCCCN1CC 1458a_100000743832_100000210202 [0,0,1,1,0,0|2,0,0]=4 6561 B12R1.77 CCC(=O)N1CCCCC1CC 11a_100000210034_100000210414 [0,0,1,1,0,0|1,0,0]=3 6562 B12R1.77 CCC(=O)N1CCCCC1CC 1626a_100000210034_100000210414 [0,0,1,1,0,0|1,0,0]=3 6563 B12R1.77 CCC(=O)N1CCCCC1CC 240690a_100000210034_100000210414 [0,0,1,1,0,0|1,0,0]=3 6564 B12R1.77 CCC(=O)N1CCCCC1CC 527a_100000210034_100000210414 [0,0,1,1,0,0|1,0,0]=3 6565 B12R1.77 CCC(=O)N1CCCCC1CO 240690a_100000210821_100000210414 [0,0,1,1,0,0|2,0,0]=4 6566 B12R1.77 CCC(=O)N1CCOC[C@@H]1CC 11a_100016988097_100000210414 [0,0,1,1,0,0|2,0,0]=4 6567 B12R1.77 CCC(=O)N1CCOC[C@@H]1CC 1626a_100016988097_100000210414 [0,0,1,1,0,0|2,0,0]=4 6568 B12R1.77 CCC(=O)N1CCOC[C@@H]1CC 240690a_100016988097_100000210414 [0,0,1,1,0,0|2,0,0]=4 6569 B12R1.77 CCC(=O)N1CCOC[C@@H]1CC 527a_100016988097_100000210414 [0,0,1,1,0,0|2,0,0]=4 6570 B12R1.77 CCC1CCCCN1C(=O)CO 240690a_100000210034_100000210174 [0,0,1,1,0,0|2,0,0]=4 6571 B12R1.77 CCC1CCCCN1C(=O)CO 527a_100000210034_100000210174 [0,0,1,1,0,0|2,0,0]=4 6572 B12R1.77 CCC1CCCCN1C(=O)NC 2708a_100102657272_100000210034 [0,0,1,1,0,0|2,0,0]=4 6573 B12R1.77 CCC1CCCCN1C(=O)NC 273464a_100102657272_100000210034 [0,0,1,1,0,0|2,0,0]=4 6574 B12R1.82 CCC(=O)CN1CCCC1CC 269982a_100000754278_100000747405 [0,0,1,1,0,0|2,0,0]=4 6575 B12R1.272 CCCCCCCOC1CCC1 34a_100000210272_100000749161 [0,0,1,1,0,0|1,0,1]=4 6576 B12R1.272 CCCCCCCOC1CCC1 34a_100000748187_100000210614 [0,0,1,1,0,0|1,0,1]=4 6577 B12R1.291 CCC(=O)N1CCC[C@H]1COC 11a_100020646714_100000210414 [0,0,1,1,0,0|2,0,0]=4 6578 B12R1.291 CCC(=O)N1CCC[C@H]1COC 1626a_100020646714_100000210414 [0,0,1,1,0,0|2,0,0]=4 6579 B12R1.291 CCC(=O)N1CCC[C@H]1COC 240690a_100020646714_100000210414 [0,0,1,1,0,0|2,0,0]=4 6580 B12R1.348 CCCCN1CCNC(=O)CC1 2230a_100000698595_100000210211 [0,0,1,1,0,0|2,0,0]=4 6581 B12R1.348 CCCCN1CCNC(=O)CC1 269982a_100000698595_100000210211 [0,0,1,1,0,0|2,0,0]=4 6582 B12R1.353 CCC(=O)CCC1CCCN1C 1458a_100000210414_100000005710 [0,0,1,1,0,0|2,0,0]=4 6583 B12R1.353 CCC(=O)COC1CCCC1C 7a_100011216460_100000747405 [0,0,1,1,0,0|2,0,0]=4 6584 B12R1.353 CCC(=O)NC[C@@H]1CCCN1C 240690a_100009821018_100000210414 [0,0,1,1,0,0|2,0,0]=4 6585 B12R1.353 CCC(=O)NC[C@@H]1CCCN1C 527a_100009821018_100000210414 [0,0,1,1,0,0|2,0,0]=4 6586 B12R1.356 CCC(=O)NCCNC1CCC1 270004a_100132302217_100000241760 [0,0,1,1,0,0|2,0,0]=4 6587 B12R1.356 CCC(=O)NCCNC1CCC1 34a_100132302217_100000749161 [0,0,1,1,0,0|2,0,0]=4 6588 B12R1.356 CCC(=O)NCCOC1CCC1 34a_200000158885_100000749161 [0,0,1,1,0,0|2,0,0]=4 6589 B12R1.356 CCC(=O)OCCOC1COC1 7a_200000031056_100009818527 [0,0,1,1,0,0|2,0,0]=4 6590 B12R1.356 CNC(=O)OCCNC1CCC1 34a_100000749019_200011997002 [0,0,1,1,0,0|2,0,0]=4 6591 B12R1.356 CNC(=O)OCCOC1CCC1 34a_100000748187_200011997002 [0,0,1,1,0,0|2,0,0]=4 6592 B12R1.356 CNC(=O)OCCSC1CCC1 62a_200011997002_100000749161 [0,0,1,1,0,0|2,0,0]=4 6593 B12R1.356 COC(=O)OCCOC1CCC1 34a_100010262106_100000749161 [0,0,1,1,0,0|2,0,0]=4 6594 B12R1.356 COC(=O)OCSCC1CCC1 62a_100000763275_100000139417 [0,0,1,1,0,0|2,0,0]=4 6595 B12R1.360 CCC(=O)NCCNCC1CC1 269862a_100132302217_100000741477 [0,0,1,1,0,0|2,0,0]=4 6596 B12R1.360 CCC(=O)NCCNCC1CC1 34a_100132302217_100000742324 [0,0,1,1,0,0|2,0,0]=4 6597 B12R1.360 CCC(=O)NCCOCC1CC1 34a_200000158885_100000742324 [0,0,1,1,0,0|2,0,0]=4 6598 B12R1.360 CCC(=O)NCCOCC1CC1 7a_200000158885_100000742324 [0,0,1,1,0,0|2,0,0]=4 6599 B12R1.360 CCC(=O)OCCOCC1CC1 7a_200000031056_100000742324 [0,0,1,1,0,0|1,0,0]=3 6600 B12R1.360 CCC(=O)OCCOCC1CO1 7a_200000031056_102125554688 [0,0,1,1,0,0|2,0,0]=4 6601 B12R1.360 CCC(=O)OCCOCC1CS1 7a_200000031056_100000031435 [0,0,1,1,0,0|2,0,0]=4 6602 B12R1.360 CCC(=O)OCCOC[C@@H]1CO1 7a_200000031056_100000745022 [0,0,1,1,0,0|2,0,0]=4 6603 B12R1.360 CNC(=O)OCCNCC1CC1 34a_100000735609_200011997002 [0,0,1,1,0,0|2,0,0]=4 6604 B12R1.360 CNC(=O)OCCOCC1CC1 34a_100000211283_200011997002 [0,0,1,1,0,0|2,0,0]=4 6605 B12R1.360 CNC(=O)OCCSCC1CC1 62a_100000756562_200011997002 [0,0,1,1,0,0|2,0,0]=4 6606 B12R1.360 CNC(=O)OCCSCC1CC1 62a_200011997002_100000742324 [0,0,1,1,0,0|2,0,0]=4 6607 B12R1.360 COC(=O)OCCOCC1CC1 34a_100010262106_100000742324 [0,0,1,1,0,0|2,0,0]=4 6608 B12R1.360 COC(=O)OCSCCC1CC1 62a_100000764125_100000139417 [0,0,1,1,0,0|2,0,0]=4 6609 B12R1.365 CCC(=O)C1CCCCCN1C 1458a_100015187800_100000210202 [0,0,1,1,0,0|2,0,0]=4 6610 B12R1.371 CC1CCCCC1NC(=O)CO 240690a_100000211402_100000210174 [0,0,1,1,0,0|2,0,0]=4 6611 B12R1.371 CC1CCCCC1NC(=O)CO 527a_100000211402_100000210174 [0,0,1,1,0,0|2,0,0]=4 6612 B12R1.371 CCC(=O)CC1CCCCN1C 1458a_100000210414_100015185383 [0,0,1,1,0,0|2,0,0]=4 6613 B12R1.371 CCC(=O)CN1CCCCC1C 269982a_100000211376_100000747405 [0,0,1,1,0,0|2,0,0]=4 6614 B12R1.371 CCC(=O)NC1CCCCC1C 11a_100000211402_100000210414 [0,0,1,1,0,0|1,0,0]=3 6615 B12R1.371 CCC(=O)NC1CCCCC1C 1626a_100000211402_100000210414 [0,0,1,1,0,0|1,0,0]=3 6616 B12R1.371 CCC(=O)NC1CCCCC1C 240690a_100000211402_100000210414 [0,0,1,1,0,0|1,0,0]=3 6617 B12R1.371 CCC(=O)NC1CCCCC1C 527a_100000211402_100000210414 [0,0,1,1,0,0|1,0,0]=3 6618 B12R1.371 CCC(=O)N[C@@H]1CCCC[C@@H]1O 240690a_100015191688_100000210414 [0,0,1,1,0,0|2,0,0]=4 6619 B12R1.371 CCC(=O)N[C@@H]1CCCC[C@@H]1O 527a_100015191688_100000210414 [0,0,1,1,0,0|2,0,0]=4 6620 B12R1.371 CCC(=O)N[C@@H]1CCCC[C@H]1F 11a_100015195156_100000210414 [0,0,1,1,0,0|2,0,0]=4 6621 B12R1.371 CCC(=O)N[C@@H]1CCCC[C@H]1F 1626a_100015195156_100000210414 [0,0,1,1,0,0|2,0,0]=4 6622 B12R1.371 CCC(=O)N[C@@H]1CCCC[C@H]1F 240690a_100015195156_100000210414 [0,0,1,1,0,0|2,0,0]=4 6623 B12R1.371 CCC(=O)N[C@@H]1CCCC[C@H]1F 527a_100015195156_100000210414 [0,0,1,1,0,0|2,0,0]=4 6624 B12R1.371 CCC(C)OC1CCCCC1C 34a_100000211207_100011215416 [0,0,1,1,0,0|1,0,1]=4 6625 B12R1.371 CCC(C)OC1CCCCC1C 7a_100000211207_100000758301 [0,0,1,1,0,0|1,0,1]=4 6626 B12R1.371 CNC(=O)NC1CCCCC1C 2708a_100000211402_106832991635 [0,0,1,1,0,0|2,0,0]=4 6627 B12R1.371 CNC(=O)NC1CCCCC1C 2708a_100102657272_100000211402 [0,0,1,1,0,0|2,0,0]=4 6628 B12R1.371 CNC(=O)NC1CCCCC1C 273464a_100000211402_100102657272 [0,0,1,1,0,0|2,0,0]=4 6629 B12R1.371 CNC(=O)NC1CCCCC1C 273464a_100102657272_100000211402 [0,0,1,1,0,0|2,0,0]=4 6630 B12R1.371 CNC(=O)NC1CCCCC1C 512a_100000211402_100102657272 [0,0,1,1,0,0|2,0,0]=4 6631 B12R1.371 CNC(=O)NC1CCCCC1C 512a_106832991638_100000211402 [0,0,1,1,0,0|2,0,0]=4 6632 B12R1.821 CCCCCCCOC1(CC1)C 7a_100011725673_100000210614 [0,0,1,1,0,0|1,0,1]=4 6633 B12R1.1659 CCC(=O)N1CCCCCCC1 11a_100000211400_100000210414 [0,0,1,1,0,0|1,0,0]=3 6634 B12R1.1659 CCC(=O)N1CCCCCCC1 1626a_100000211400_100000210414 [0,0,1,1,0,0|1,0,0]=3 6635 B12R1.1659 CCC(=O)N1CCCCCCC1 240690a_100000211400_100000210414 [0,0,1,1,0,0|1,0,0]=3 6636 B12R1.1659 CCC(=O)N1CCCCCCC1 527a_100000211400_100000210414 [0,0,1,1,0,0|1,0,0]=3 6637 B12R1.1659 CNC(=O)N1CCCCCCC1 2708a_100102657272_100000211400 [0,0,1,1,0,0|2,0,0]=4 6638 B12R1.1659 CNC(=O)N1CCCCCCC1 273464a_100102657272_100000211400 [0,0,1,1,0,0|2,0,0]=4 6639 B12R1.1659 O=C(CO)N1CCCCCCC1 240690a_100000211400_100000210174 [0,0,1,1,0,0|2,0,0]=4 6640 B12R1.1659 O=C(CO)N1CCCCCCC1 527a_100000211400_100000210174 [0,0,1,1,0,0|2,0,0]=4 6641 B12R1.1748 CCC(=O)C=C1CCCCCC1 1458a_100011240665_100000210202 [0,0,1,1,0,0|1,0,1]=4 6642 B12R1.1748 CCC(=O)CC1CCCCCC1 1458a_100000210414_200000696569 [0,0,1,1,0,0|1,0,0]=3 6643 B12R1.1748 CCC(=O)CC1CCCCCC1 1458a_100000685095_100000210202 [0,0,1,1,0,0|1,0,0]=3 6644 B12R1.1748 CCC(=O)CN1CCCCCC1 1458a_100000740298_100000210202 [0,0,1,1,0,0|2,0,0]=4 6645 B12R1.1748 CCC(=O)CN1CCCCCC1 269982a_100000185865_100000747405 [0,0,1,1,0,0|2,0,0]=4 6646 B12R1.1748 CCC(=O)NC1CCCCCC1 11a_100000210984_100000210414 [0,0,1,1,0,0|1,0,0]=3 6647 B12R1.1748 CCC(=O)NC1CCCCCC1 1626a_100000210984_100000210414 [0,0,1,1,0,0|1,0,0]=3 6648 B12R1.1748 CCC(=O)NC1CCCCCC1 240690a_100000210984_100000210414 [0,0,1,1,0,0|1,0,0]=3 6649 B12R1.1748 CCC(=O)NC1CCCCCC1 527a_100000210984_100000210414 [0,0,1,1,0,0|1,0,0]=3 6650 B12R1.1748 CCC(C)OC1CCCCCC1 34a_100000210887_100011215416 [0,0,1,1,0,0|1,0,1]=4 6651 B12R1.1748 CCC(C)OC1CCCCCC1 7a_100000210887_100000758301 [0,0,1,1,0,0|1,0,1]=4 6652 B12R1.1748 CNC(=O)CC1CCCCCC1 11a_106832991635_100000685095 [0,0,1,1,0,0|2,0,0]=4 6653 B12R1.1748 CNC(=O)CC1CCCCCC1 1626a_100102657272_100000685095 [0,0,1,1,0,0|2,0,0]=4 6654 B12R1.1748 CNC(=O)CC1CCCCCC1 240690a_100102657272_100000685095 [0,0,1,1,0,0|2,0,0]=4 6655 B12R1.1748 CNC(=O)CC1CCCCCC1 527a_100102657272_100000685095 [0,0,1,1,0,0|2,0,0]=4 6656 B12R1.1748 CNC(=O)NC1CCCCCC1 2708a_100000210984_106832991635 [0,0,1,1,0,0|2,0,0]=4 6657 B12R1.1748 CNC(=O)NC1CCCCCC1 2708a_100102657272_100000210984 [0,0,1,1,0,0|2,0,0]=4 6658 B12R1.1748 CNC(=O)NC1CCCCCC1 273464a_100000210984_100102657272 [0,0,1,1,0,0|2,0,0]=4 6659 B12R1.1748 CNC(=O)NC1CCCCCC1 273464a_100102657272_100000210984 [0,0,1,1,0,0|2,0,0]=4 6660 B12R1.1748 CNC(=O)NC1CCCCCC1 512a_106832991638_100000210984 [0,0,1,1,0,0|2,0,0]=4 6661 B12R1.1748 O=C(CF)CC1CCCCCC1 1458a_100000685095_100015361967 [0,0,1,1,0,0|2,0,0]=4 6662 B12R1.1748 O=C(CO)CC1CCCCCC1 1458a_100000210174_200000696569 [0,0,1,1,0,0|2,0,0]=4 6663 B12R1.1748 O=C(CO)NC1CCCCCC1 240690a_100000210984_100000210174 [0,0,1,1,0,0|2,0,0]=4 6664 B12R1.1748 O=C(CO)NC1CCCCCC1 527a_100000210984_100000210174 [0,0,1,1,0,0|2,0,0]=4 6665 B12R1.8 CCCCOCC1CCC=CO1 34a_100011217868_100000210210 [0,0,1,1,0,0|2,0,0]=4 6666 B12R1.30 CC(OCC=O)C1CCCCC1 34a_100011216961_200009817547 [0,0,1,1,0,0|2,0,0]=4 6667 B12R1.30 CC(OCC=O)C1CCCCC1 7a_100011216961_200015260668 [0,0,1,1,0,0|2,0,0]=4 6668 B12R1.30 C[C@@H](NCC=O)C1CCCCC1 2230a_100025707633_200015260668 [0,0,1,1,0,0|2,0,0]=4 6669 B12R1.30 C[C@@H](NCC=O)C1CCCCC1 34a_100025707633_200009817547 [0,0,1,1,0,0|2,0,0]=4 6670 B12R1.329 O=CCNC1CCCCCCC1 2230a_100000211152_200015260668 [0,0,1,1,0,0|2,0,0]=4 6671 B12R1.329 O=CCNC1CCCCCCC1 34a_100000211152_200009817547 [0,0,1,1,0,0|2,0,0]=4 6672 B12R1.329 O=CCOC1CCCCCCC1 34a_100000210054_200009817547 [0,0,1,1,0,0|2,0,0]=4 6673 B12R1.329 O=CCOC1CCCCCCC1 7a_100000210054_200015260668 [0,0,1,1,0,0|2,0,0]=4 6674 B12R1.1785 CC1(CCCCCC1)NCC=O 2230a_100000704638_200015260668 [0,0,1,1,0,0|2,0,0]=4 6675 B12R1.1785 CC1(CCCCCC1)NCC=O 34a_100000704638_200009817547 [0,0,1,1,0,0|2,0,0]=4 6676 B12R1.1785 CC1(CCCCCC1)OCC=O 34a_100000708895_200009817547 [0,0,1,1,0,0|2,0,0]=4 6677 B12R1.1785 CC1(CCCCCC1)OCC=O 7a_100000708895_200015260668 [0,0,1,1,0,0|2,0,0]=4 6678 B12R1.28 CCCCOC1CCCC(=O)C1 34a_100012613340_100000210210 [0,0,1,1,0,0|2,0,0]=4 6679 B12R1.28 CCCOCC1CCCC(=O)N1 34a_200000102386_100000210303 [0,0,1,1,0,0|2,0,0]=4 6680 B12R1.75 CCC1CCCCN1CC(=O)N 2230a_100000210034_100000747473 [0,0,1,1,0,0|2,0,0]=4 6681 B12R1.75 CCC1CCCCN1CC(=O)N 269982a_100000210034_100000187820 [0,0,1,1,0,0|2,0,0]=4 6682 B12R1.75 CCC1CCCCN1CC(=O)N 34a_100000210034_100000187820 [0,0,1,1,0,0|2,0,0]=4 6683 B12R1.75 CCC1CCCCN1CC(=O)[O-] 269982a_100000210034_100020667443 [0,0,1,1,0,0|1,0,1]=4 6684 B12R1.75 CCC1CCCCN1CC(=O)[O-] 34a_100000210034_100020667443 [0,0,1,1,0,0|1,0,1]=4 6685 B12R1.75 CCN1CCCCC1CC(=O)N 2230a_100015184752_100000210202 [0,0,1,1,0,0|2,0,0]=4 6686 B12R1.75 CCN1CCCCC1CC(=O)N 269982a_100015184752_100000204670 [0,0,1,1,0,0|2,0,0]=4 6687 B12R1.75 CCN1CCCCC1CC(=O)N 34a_100015184752_100000210202 [0,0,1,1,0,0|2,0,0]=4 6688 B12R1.81 CCC1CCCN1CCC(=O)C 269982a_100000754278_100000053229 [0,0,1,1,0,0|2,0,0]=4 6689 B12R1.81 CCC1CCCN1CCC(=O)N 2230a_100000754278_100000744528 [0,0,1,1,0,0|2,0,0]=4 6690 B12R1.81 CCC1CCCN1CCC(=O)N 269982a_100000754278_100000744528 [0,0,1,1,0,0|2,0,0]=4 6691 B12R1.81 CCC1CCCN1CCC(=O)N 34a_100000754278_100000731001 [0,0,1,1,0,0|2,0,0]=4 6692 B12R1.125 CC(=O)CCC1CCCCN1C 1458a_100000070787_100000211948 [0,0,1,1,0,0|2,0,0]=4 6693 B12R1.125 CC(=O)CCC1CCCCN1C 1458a_100000718493_200000210301 [0,0,1,1,0,0|2,0,0]=4 6694 B12R1.125 CC(=O)CCN1CCCCC1C 269982a_100000211376_100000053229 [0,0,1,1,0,0|2,0,0]=4 6695 B12R1.125 CC(=O)COC1CCCCC1C 1458a_100011223357_200000210301 [0,0,1,1,0,0|2,0,0]=4 6696 B12R1.125 CC1CCCCC1NCC(=O)N 2230a_100000211402_100000747473 [0,0,1,1,0,0|2,0,0]=4 6697 B12R1.125 CC1CCCCC1NCC(=O)N 34a_100000211402_100000187820 [0,0,1,1,0,0|2,0,0]=4 6698 B12R1.125 CC1CCCCC1NCC(=O)[O-] 34a_100000211402_100020667443 [0,0,1,1,0,0|1,0,1]=4 6699 B12R1.125 CC1CCCCC1OCC(=O)N 34a_100000211207_100000187820 [0,0,1,1,0,0|2,0,0]=4 6700 B12R1.125 CC1CCCCC1OCC(=O)N 7a_100000211207_100000187820 [0,0,1,1,0,0|2,0,0]=4 6701 B12R1.125 CC1CCCCC1OCC(=O)[13CH3] 1458a_100011223357_200025704644 [0,0,1,1,0,0|2,0,0]=4 6702 B12R1.125 CC1CCCCC1OCC(=O)[O-] 34a_100000211207_100020667443 [0,0,1,1,0,0|1,0,1]=4 6703 B12R1.125 CC1CCCCN1CCC(=O)N 2230a_100000211376_100000744528 [0,0,1,1,0,0|2,0,0]=4 6704 B12R1.125 CC1CCCCN1CCC(=O)N 269982a_100000211376_100000744528 [0,0,1,1,0,0|2,0,0]=4 6705 B12R1.125 CC1CCCCN1CCC(=O)N 34a_100000211376_100000731001 [0,0,1,1,0,0|2,0,0]=4 6706 B12R1.125 CN1CCCCC1CCC(=O)O 269956a_100000694054_200000210301 [0,0,1,1,0,0|1,0,0]=3 6707 B12R1.125 CN1CCCCC1CCC(=O)[13CH3] 1458a_100000718493_200025704644 [0,0,1,1,0,0|2,0,0]=4 6708 B12R1.125 O=C(O)CNC1CCCCC1F 269956a_100016091260_100015423560 [0,0,1,1,0,0|2,0,0]=4 6709 B12R1.125 O=C(O)CNC1CCCCC1O 269956a_100016091260_100000038908 [0,0,1,1,0,0|2,0,0]=4 6710 B12R1.125 [13CH3]N1CCCCC1CCC(=O)O 269956a_100000694054_200025704644 [0,0,1,1,0,0|1,0,0]=3 6711 B12R1.130 CC(=O)CCCN1CCC[C@@H]1C 269982a_100020605311_100011215641 [0,0,1,1,0,0|2,0,0]=4 6712 B12R1.130 CC(=O)CCCN1CCC[C@H]1C 269982a_100015189458_100011215641 [0,0,1,1,0,0|2,0,0]=4 6713 B12R1.130 CC(=O)CCCN1CCC[C@H]1C 34a_100015189458_100000685027 [0,0,1,1,0,0|2,0,0]=4 6714 B12R1.130 CC(=O)CCOC1CCCC1C 7a_100011216460_100000053229 [0,0,1,1,0,0|2,0,0]=4 6715 B12R1.130 CC1CCCC1NCCC(=O)N 269862a_100000740010_100000752053 [0,0,1,1,0,0|2,0,0]=4 6716 B12R1.130 CC1CCCC1OCCC(=O)N 34a_100011216460_100000731001 [0,0,1,1,0,0|2,0,0]=4 6717 B12R1.130 CC1CCCC1OCCC(=O)N 7a_100011216460_100000744528 [0,0,1,1,0,0|2,0,0]=4 6718 B12R1.130 C[C@@H]1CCCN1CCCC(=O)N 269982a_100015189458_100102525003 [0,0,1,1,0,0|2,0,0]=4 6719 B12R1.130 C[C@@H]1CCCN1CCCC(=O)N 34a_100015189458_100102525003 [0,0,1,1,0,0|2,0,0]=4 6720 B12R1.130 C[C@H]1CCCN1CCCC(=O)N 269982a_100020605311_100102525003 [0,0,1,1,0,0|2,0,0]=4 6721 B12R1.143 CC(=O)CCCOCC1CC1C 34a_100000744939_100000685027 [0,0,1,1,0,0|2,0,0]=4 6722 B12R1.143 CC(=O)CCCOCC1CC1C 7a_100000744939_100011215641 [0,0,1,1,0,0|2,0,0]=4 6723 B12R1.143 CC1CC1COCCCC(=O)N 34a_100000744939_100102525003 [0,0,1,1,0,0|2,0,0]=4 6724 B12R1.143 CC1CC1COCCCC(=O)N 7a_100000744939_100102525003 [0,0,1,1,0,0|2,0,0]=4 6725 B12R1.252 CC(=O)CCCC1CCCCC1 1458a_100000070787_100011713725 [0,0,1,1,0,0|1,0,0]=3 6726 B12R1.252 CC(=O)CCCC1CCCCC1 1458a_100000211478_200000210301 [0,0,1,1,0,0|1,0,0]=3 6727 B12R1.252 CC(=O)CCCN1CCCCC1 1458a_100000070787_100000690320 [0,0,1,1,0,0|2,0,0]=4 6728 B12R1.252 CC(=O)CCCN1CCCCC1 1458a_100000742516_200000210301 [0,0,1,1,0,0|2,0,0]=4 6729 B12R1.252 CC(=O)CCOC1CCCCC1 1458a_100000070787_100011211530 [0,0,1,1,0,0|2,0,0]=4 6730 B12R1.252 CC(=O)CCOC1CCCCC1 34a_100000759926_100000210327 [0,0,1,1,0,0|2,0,0]=4 6731 B12R1.252 CC(=O)CCOC1CCCCC1 7a_100000210231_100000053229 [0,0,1,1,0,0|2,0,0]=4 6732 B12R1.252 CC(=O)CCOC1CCCCC1 7a_100000759926_100000210327 [0,0,1,1,0,0|2,0,0]=4 6733 B12R1.252 CC(=O)CCSC1CCCCC1 62a_100000053229_100000210327 [0,0,1,1,0,0|2,0,0]=4 6734 B12R1.252 CC(=O)CCSC1CCCCC1 62a_100000210327_100000053229 [0,0,1,1,0,0|2,0,0]=4 6735 B12R1.252 CC(=O)COCC1CCCCC1 34a_100000211253_100000211423 [0,0,1,1,0,0|2,0,0]=4 6736 B12R1.252 CC(=O)NCCC1CCCCC1 11a_100000738074_100015343762 [0,0,1,1,0,0|2,0,0]=4 6737 B12R1.252 CC(=O)NCCC1CCCCC1 1626a_100000738074_100015343762 [0,0,1,1,0,0|2,0,0]=4 6738 B12R1.252 CC(=O)NCCC1CCCCC1 240690a_100000738074_100015343762 [0,0,1,1,0,0|2,0,0]=4 6739 B12R1.252 CC(=O)NCCC1CCCCC1 527a_100000738074_100103153847 [0,0,1,1,0,0|2,0,0]=4 6740 B12R1.252 NC(=O)CCNC1CCCCC1 2230a_100000182618_100000744528 [0,0,1,1,0,0|2,0,0]=4 6741 B12R1.252 NC(=O)CCNC1CCCCC1 34a_100000182618_100000731001 [0,0,1,1,0,0|2,0,0]=4 6742 B12R1.252 NC(=O)CCOC1CCCCC1 34a_100000210231_100000731001 [0,0,1,1,0,0|2,0,0]=4 6743 B12R1.252 NC(=O)CCOC1CCCCC1 34a_100000757172_100000210327 [0,0,1,1,0,0|2,0,0]=4 6744 B12R1.252 NC(=O)CCOC1CCCCC1 7a_100000210231_100000744528 [0,0,1,1,0,0|2,0,0]=4 6745 B12R1.252 NC(=O)CCOC1CCCCC1 7a_100000757172_100000210327 [0,0,1,1,0,0|2,0,0]=4 6746 B12R1.252 NC(=O)CCSC1CCCCC1 62a_100000210327_100000744528 [0,0,1,1,0,0|2,0,0]=4 6747 B12R1.252 NC(=O)CCSC1CCCCC1 62a_100000744528_100000210327 [0,0,1,1,0,0|2,0,0]=4 6748 B12R1.252 NC(=O)CNCC1CCCCC1 2230a_100000210473_100000747473 [0,0,1,1,0,0|2,0,0]=4 6749 B12R1.252 NC(=O)CNCC1CCCCC1 2230a_100000711301_100000211423 [0,0,1,1,0,0|2,0,0]=4 6750 B12R1.252 NC(=O)CNCC1CCCCC1 34a_100000210473_100000187820 [0,0,1,1,0,0|2,0,0]=4 6751 B12R1.252 NC(=O)COCC1CCCCC1 34a_100000212181_100000187820 [0,0,1,1,0,0|2,0,0]=4 6752 B12R1.252 NC(=O)COCC1CCCCC1 7a_100000212181_100000187820 [0,0,1,1,0,0|2,0,0]=4 6753 B12R1.252 NC(=O)CSCC1CCCCC1 62a_100000211423_100000747473 [0,0,1,1,0,0|2,0,0]=4 6754 B12R1.252 NC(=O)CSCC1CCCCC1 62a_100000747473_100000211423 [0,0,1,1,0,0|2,0,0]=4 6755 B12R1.252 O=C(O)CNCC1CCCCC1 269956a_100016091260_100000211423 [0,0,1,1,0,0|1,0,0]=3 6756 B12R1.252 O=C(O)CNCC1CCCCO1 269956a_100016091260_100000211543 [0,0,1,1,0,0|2,0,0]=4 6757 B12R1.252 O=C(O)CNCC1CCCOC1 269956a_100016091260_100000741521 [0,0,1,1,0,0|2,0,0]=4 6758 B12R1.252 O=C(O)CNCC1CCOCC1 269956a_100016091260_100000754603 [0,0,1,1,0,0|2,0,0]=4 6759 B12R1.252 O=C(O)CONC1CCCCC1 269956a_100000106656_100000210327 [0,0,1,1,0,0|2,0,0]=4 6760 B12R1.252 O=C([O-])CNCC1CCCCC1 34a_100000210473_100020667443 [0,0,1,1,0,0|1,0,1]=4 6761 B12R1.252 O=C([O-])COCC1CCCCC1 34a_100000212181_100020667443 [0,0,1,1,0,0|1,0,1]=4 6762 B12R1.252 O=C([O-])CSCC1CCCCC1 62a_100000211423_100020667443 [0,0,1,1,0,0|1,0,1]=4 6763 B12R1.252 O=C([O-])CSCC1CCCCC1 62a_100020667443_100000211423 [0,0,1,1,0,0|1,0,1]=4 6764 B12R1.252 [13CH3]C(=O)CCCC1CCCCC1 1458a_100000211478_200025704644 [0,0,1,1,0,0|1,0,0]=3 6765 B12R1.252 [13CH3]C(=O)CCCN1CCCCC1 1458a_100000742516_200025704644 [0,0,1,1,0,0|2,0,0]=4 6766 B12R1.257 CC(=O)CCCCNC1CCC1 34a_100000749019_100009817362 [0,0,1,1,0,0|2,0,0]=4 6767 B12R1.257 CC(=O)CCCCOC1CCC1 34a_100000748187_100009817362 [0,0,1,1,0,0|2,0,0]=4 6768 B12R1.257 CC(=O)CCCCSC1CCC1 62a_100000735457_100000749161 [0,0,1,1,0,0|2,0,0]=4 6769 B12R1.257 CC(=O)CCCNCC1CCC1 34a_100000738700_100000685027 [0,0,1,1,0,0|2,0,0]=4 6770 B12R1.257 CC(=O)CCCOCC1CCC1 34a_100000759063_100000763275 [0,0,1,1,0,0|2,0,0]=4 6771 B12R1.257 CC(=O)CCCOCC1CCC1 34a_100000760304_100000685027 [0,0,1,1,0,0|2,0,0]=4 6772 B12R1.257 CC(=O)CCCOCC1CCC1 7a_100000759063_100000763275 [0,0,1,1,0,0|2,0,0]=4 6773 B12R1.257 CC(=O)CCCSCC1CCC1 62a_100000763275_100011215641 [0,0,1,1,0,0|2,0,0]=4 6774 B12R1.257 CC(=O)CCCSCC1CCC1 62a_100011215641_100000763275 [0,0,1,1,0,0|2,0,0]=4 6775 B12R1.257 NC(=O)CCCCCN1CCC1 269982a_100000754969_100009817443 [0,0,1,1,0,0|2,0,0]=4 6776 B12R1.257 NC(=O)CCCCNC1CCC1 270004a_100000696515_100000241760 [0,0,1,1,0,0|2,0,0]=4 6777 B12R1.257 NC(=O)CCCCNC1CCC1 34a_100000696515_100000749161 [0,0,1,1,0,0|2,0,0]=4 6778 B12R1.257 NC(=O)CCCCOC1CCC1 34a_100012022536_100000749161 [0,0,1,1,0,0|2,0,0]=4 6779 B12R1.257 NC(=O)CCCNCC1CCC1 269862a_100000739312_100000753134 [0,0,1,1,0,0|2,0,0]=4 6780 B12R1.257 NC(=O)CCCNCC1CCC1 34a_100000738700_100102525003 [0,0,1,1,0,0|2,0,0]=4 6781 B12R1.257 NC(=O)CCCNCC1CCC1 34a_100000739312_100000763275 [0,0,1,1,0,0|2,0,0]=4 6782 B12R1.257 NC(=O)CCCOCC1CCC1 34a_100000760304_100102525003 [0,0,1,1,0,0|2,0,0]=4 6783 B12R1.257 NC(=O)CCCSCC1CCC1 62a_100000763275_100102525003 [0,0,1,1,0,0|2,0,0]=4 6784 B12R1.257 NC(=O)CCCSCC1CCC1 62a_100102525003_100000763275 [0,0,1,1,0,0|2,0,0]=4 6785 B12R1.257 O=C(O)COCCNC1CCC1 269956a_100000700818_100000749161 [0,0,1,1,0,0|2,0,0]=4 6786 B12R1.283 CCCC1CCCCN1C(=O)C 11a_100000701414_100015343762 [0,0,1,1,0,0|2,0,0]=4 6787 B12R1.283 CCCC1CCCCN1C(=O)C 1626a_100000701414_100015343762 [0,0,1,1,0,0|2,0,0]=4 6788 B12R1.283 CCCC1CCCCN1C(=O)C 240690a_100000701414_100015343762 [0,0,1,1,0,0|2,0,0]=4 6789 B12R1.283 CCCC1CCCCN1C(=O)C 527a_100000701414_100103153847 [0,0,1,1,0,0|2,0,0]=4 6790 B12R1.283 CCCN1CCCCC1C(=O)C 1458a_100000743559_200000210301 [0,0,1,1,0,0|2,0,0]=4 6791 B12R1.283 CCCN1CCCCC1C(=O)N 2230a_100000181395_100000210303 [0,0,1,1,0,0|2,0,0]=4 6792 B12R1.283 CCCN1CCCCC1C(=O)N 269982a_100000181395_100000210303 [0,0,1,1,0,0|2,0,0]=4 6793 B12R1.283 CCCN1CCCCC1C(=O)N 34a_100000181395_100000210303 [0,0,1,1,0,0|2,0,0]=4 6794 B12R1.283 CCCN1CCCCC1C(=O)[13CH3] 1458a_100000743559_200025704644 [0,0,1,1,0,0|2,0,0]=4 6795 B12R1.283 CCCN1CCCC[C@@H]1C(=O)O 269956a_100000763471_100000210207 [0,0,1,1,0,0|1,0,0]=3 6796 B12R1.283 CCCN1CCOC[C@@H]1C(=O)O 269956a_100016993156_100000210207 [0,0,1,1,0,0|2,0,0]=4 6797 B12R1.283 CCCN1CCSCC1C(=O)O 269956a_100011346106_100000210207 [0,0,1,1,0,0|2,0,0]=4 6798 B12R1.283 CCCN1CSCCC1C(=O)O 269956a_100015185162_100000210207 [0,0,1,1,0,0|2,0,0]=4 6799 B12R1.283 CCN[C@@H]1CCCC[C@H]1C(=O)O 269956a_100009816435_100000210202 [0,0,1,1,0,0|1,0,0]=3 6800 B12R1.283 COCN1CCCC[C@@H]1C(=O)O 269956a_100000763471_100000766300 [0,0,1,1,0,0|2,0,0]=4 6801 B12R1.283 CSCN1CCCC[C@@H]1C(=O)O 269956a_100000763471_100011218213 [0,0,1,1,0,0|2,0,0]=4 6802 B12R1.283 O=C(O)[C@@H]1CCCC[C@H]1NCF 269956a_100009816435_100015361967 [0,0,1,1,0,0|2,0,0]=4 6803 B12R1.283 O=C(O)[C@H]1CCCCN1CCF 269956a_100000763471_100011217306 [0,0,1,1,0,0|2,0,0]=4 6804 B12R1.283 O=C(O)[C@H]1CCCCN1CCO 269956a_100000763471_100000211926 [0,0,1,1,0,0|2,0,0]=4 6805 B12R1.386 CCCCN1CCC[C@H]1C(=O)N 2230a_100000003125_100000210211 [0,0,1,1,0,0|2,0,0]=4 6806 B12R1.386 CCCCN1CCC[C@H]1C(=O)O 269956a_100000743916_100000210211 [0,0,1,1,0,0|1,0,0]=3 6807 B12R1.386 CCCCN1CCSC1C(=O)O 269956a_100000035718_100000210211 [0,0,1,1,0,0|2,0,0]=4 6808 B12R1.386 CCCCN1CSC[C@H]1C(=O)O 269956a_100000743924_100000210211 [0,0,1,1,0,0|2,0,0]=4 6809 B12R1.386 CCOCN1CCC[C@H]1C(=O)O 269956a_100000743916_100000739092 [0,0,1,1,0,0|2,0,0]=4 6810 B12R1.386 COCCN1CCC[C@H]1C(=O)O 269956a_100000743916_100000233755 [0,0,1,1,0,0|2,0,0]=4 6811 B12R1.386 CSCCN1CCC[C@H]1C(=O)O 269956a_100000743916_100000212216 [0,0,1,1,0,0|2,0,0]=4 6812 B12R1.386 O=C(O)[C@@H]1CCCN1CCCF 269956a_100000743916_100011934791 [0,0,1,1,0,0|2,0,0]=4 6813 B12R1.386 O=C(O)[C@@H]1CCCN1CCCO 269956a_100000743916_100011215043 [0,0,1,1,0,0|2,0,0]=4 6814 B12R1.390 CC(=O)CCCCNCC1CC1 34a_100000735609_100009817362 [0,0,1,1,0,0|2,0,0]=4 6815 B12R1.390 CC(=O)CCCCOCC1CC1 34a_100000211283_100009817362 [0,0,1,1,0,0|2,0,0]=4 6816 B12R1.390 CC(=O)CCCCSCC1CC1 62a_100000735457_100000742324 [0,0,1,1,0,0|2,0,0]=4 6817 B12R1.390 CC(=O)CCCCSCC1CC1 62a_100000756562_100000735457 [0,0,1,1,0,0|2,0,0]=4 6818 B12R1.390 CC(=O)CCCNCCC1CC1 34a_100000764129_100000685027 [0,0,1,1,0,0|2,0,0]=4 6819 B12R1.390 CC(=O)CCCOCCC1CC1 34a_100000754188_100000685027 [0,0,1,1,0,0|2,0,0]=4 6820 B12R1.390 CC(=O)CCCOCCC1CC1 34a_100000759063_100000694398 [0,0,1,1,0,0|2,0,0]=4 6821 B12R1.390 CC(=O)CCCOCCC1CC1 7a_100000754188_100011215641 [0,0,1,1,0,0|2,0,0]=4 6822 B12R1.390 CC(=O)CCCOCCC1CC1 7a_100000759063_100000764125 [0,0,1,1,0,0|2,0,0]=4 6823 B12R1.390 CC(=O)CCCSCCC1CC1 62a_100000764125_100011215641 [0,0,1,1,0,0|2,0,0]=4 6824 B12R1.390 CC(=O)CCCSCCC1CC1 62a_100011215641_100000764125 [0,0,1,1,0,0|2,0,0]=4 6825 B12R1.390 NC(=O)CCCCCNC1CC1 34a_100000212008_100009817443 [0,0,1,1,0,0|2,0,0]=4 6826 B12R1.390 NC(=O)CCCCCOC1CC1 34a_100000123541_100000211595 [0,0,1,1,0,0|2,0,0]=4 6827 B12R1.390 NC(=O)CCCCCSC1CC1 62a_100009817443_100000211595 [0,0,1,1,0,0|2,0,0]=4 6828 B12R1.390 NC(=O)CCCCNCC1CC1 269862a_100000696515_100000741477 [0,0,1,1,0,0|2,0,0]=4 6829 B12R1.390 NC(=O)CCCCNCC1CC1 34a_100000696515_100000742324 [0,0,1,1,0,0|2,0,0]=4 6830 B12R1.390 NC(=O)CCCCOCC1CC1 34a_100012022536_100000742324 [0,0,1,1,0,0|2,0,0]=4 6831 B12R1.390 NC(=O)CCCCOCC1CC1 7a_100012022536_100000742324 [0,0,1,1,0,0|2,0,0]=4 6832 B12R1.390 NC(=O)CCCNCCC1CC1 34a_100000739312_100000694398 [0,0,1,1,0,0|2,0,0]=4 6833 B12R1.390 NC(=O)CCCNCCC1CC1 34a_100000764129_100102525003 [0,0,1,1,0,0|2,0,0]=4 6834 B12R1.390 NC(=O)CCCOCCC1CC1 34a_100000754188_100102525003 [0,0,1,1,0,0|2,0,0]=4 6835 B12R1.390 NC(=O)CCCOCCC1CC1 7a_100000754188_100102525003 [0,0,1,1,0,0|2,0,0]=4 6836 B12R1.390 NC(=O)CCCSCCC1CC1 62a_100000764125_100102525003 [0,0,1,1,0,0|2,0,0]=4 6837 B12R1.390 NC(=O)CCCSCCC1CC1 62a_100102525003_100000764125 [0,0,1,1,0,0|2,0,0]=4 6838 B12R1.390 O=C(O)COCCNCC1CC1 269956a_100000700818_100000742324 [0,0,1,1,0,0|2,0,0]=4 6839 B12R1.405 CCN1CCCCCC1C(=O)O 269956a_100000758484_100000210202 [0,0,1,1,0,0|1,0,0]=3 6840 B12R1.405 O=C(O)C1CCCCCN1CF 269956a_100000758484_100015361967 [0,0,1,1,0,0|2,0,0]=4 6841 B12R1.522 CCCCCN1CCC1C(=O)O 269956a_100000021838_100000210326 [0,0,1,1,0,0|1,0,0]=3 6842 B12R1.522 CCOCCN1CCC1C(=O)O 269956a_100000021838_100000210147 [0,0,1,1,0,0|2,0,0]=4 6843 B12R1.522 CCSCCN1CCC1C(=O)O 269956a_100000021838_100000757381 [0,0,1,1,0,0|2,0,0]=4 6844 B12R1.522 COCCCN1CCC1C(=O)O 269956a_100000021838_100000740836 [0,0,1,1,0,0|2,0,0]=4 6845 B12R1.522 O=C(O)C1CCN1CCCCF 269956a_100000021838_100000729493 [0,0,1,1,0,0|2,0,0]=4 6846 B12R1.522 O=C(O)C1CCN1CCCCO 269956a_100000021838_100000210776 [0,0,1,1,0,0|2,0,0]=4 6847 B12R1.1335 CC(=O)N1CCCCCCCC1 11a_100000039187_100015343762 [0,0,1,1,0,0|2,0,0]=4 6848 B12R1.1335 CC(=O)N1CCCCCCCC1 1626a_100000039187_100015343762 [0,0,1,1,0,0|2,0,0]=4 6849 B12R1.1335 CC(=O)N1CCCCCCCC1 240690a_100000039187_100015343762 [0,0,1,1,0,0|2,0,0]=4 6850 B12R1.1335 CC(=O)N1CCCCCCCC1 527a_100000039187_100103153847 [0,0,1,1,0,0|2,0,0]=4 6851 B12R1.1343 CC(=O)CCN1CCCCCC1 1458a_100000070787_100000722644 [0,0,1,1,0,0|2,0,0]=4 6852 B12R1.1343 CC(=O)CCN1CCCCCC1 1458a_100000740320_200000210301 [0,0,1,1,0,0|2,0,0]=4 6853 B12R1.1343 CC(=O)CCN1CCCCCC1 269982a_100000185865_100000053229 [0,0,1,1,0,0|2,0,0]=4 6854 B12R1.1343 CC(=O)COC1CCCCCC1 34a_100000211253_100011217769 [0,0,1,1,0,0|2,0,0]=4 6855 B12R1.1343 CC(=O)NCC1CCCCCC1 11a_100015204231_100015343762 [0,0,1,1,0,0|2,0,0]=4 6856 B12R1.1343 CC(=O)NCC1CCCCCC1 1626a_100015204231_100015343762 [0,0,1,1,0,0|2,0,0]=4 6857 B12R1.1343 CC(=O)NCC1CCCCCC1 240690a_100015204231_100015343762 [0,0,1,1,0,0|2,0,0]=4 6858 B12R1.1343 CC(=O)NCC1CCCCCC1 527a_100015204231_100103153847 [0,0,1,1,0,0|2,0,0]=4 6859 B12R1.1343 NC(=O)CCN1CCCCCC1 2230a_100000185865_100000744528 [0,0,1,1,0,0|2,0,0]=4 6860 B12R1.1343 NC(=O)CCN1CCCCCC1 269982a_100000185865_100000744528 [0,0,1,1,0,0|2,0,0]=4 6861 B12R1.1343 NC(=O)CCN1CCCCCC1 34a_100000185865_100000731001 [0,0,1,1,0,0|2,0,0]=4 6862 B12R1.1343 NC(=O)CNC1CCCCCC1 2230a_100000210984_100000747473 [0,0,1,1,0,0|2,0,0]=4 6863 B12R1.1343 NC(=O)CNC1CCCCCC1 34a_100000210984_100000187820 [0,0,1,1,0,0|2,0,0]=4 6864 B12R1.1343 NC(=O)COC1CCCCCC1 34a_100000210887_100000187820 [0,0,1,1,0,0|2,0,0]=4 6865 B12R1.1343 NC(=O)COC1CCCCCC1 7a_100000210887_100000187820 [0,0,1,1,0,0|2,0,0]=4 6866 B12R1.1343 NC(=O)CSC1CCCCCC1 62a_100000747473_100011217769 [0,0,1,1,0,0|2,0,0]=4 6867 B12R1.1343 NC(=O)CSC1CCCCCC1 62a_100011217769_100000747473 [0,0,1,1,0,0|2,0,0]=4 6868 B12R1.1343 O=C(O)CNC1CCCCCC1 269956a_100016091260_100011217769 [0,0,1,1,0,0|1,0,0]=3 6869 B12R1.1343 O=C([O-])CNC1CCCCCC1 34a_100000210984_100020667443 [0,0,1,1,0,0|1,0,1]=4 6870 B12R1.1343 O=C([O-])COC1CCCCCC1 34a_100000210887_100020667443 [0,0,1,1,0,0|1,0,1]=4 6871 B12R1.1343 O=C([O-])CSC1CCCCCC1 62a_100011217769_100020667443 [0,0,1,1,0,0|1,0,1]=4 6872 B12R1.1343 O=C([O-])CSC1CCCCCC1 62a_100020667443_100011217769 [0,0,1,1,0,0|1,0,1]=4 6873 B12R1.1343 [13CH3]C(=O)CCN1CCCCCC1 1458a_100000740320_200025704644 [0,0,1,1,0,0|2,0,0]=4 6874 B12R1.3 CCC(OCF)C1CCCCC1 34a_100011215090_100015361967 [0,0,1,1,0,0|1,0,1]=4 6875 B12R1.3 CCC(OCF)C1CCCCC1 7a_100011215090_100015361967 [0,0,1,1,0,0|1,0,1]=4 6876 B12R1.3 CCN(CC=O)C1CCCCC1 2230a_100000201195_200015260668 [0,0,1,1,0,0|2,0,0]=4 6877 B12R1.3 CCN(CC=O)C1CCCCC1 269982a_100000201195_200015260668 [0,0,1,1,0,0|2,0,0]=4 6878 B12R1.3 CCN(CC=O)C1CCCCC1 34a_100000201195_200009817547 [0,0,1,1,0,0|2,0,0]=4 6879 B12R1.3 CCOC(CC)C1CCCCC1 34a_100011215090_100000210202 [0,0,1,1,0,0|1,0,1]=4 6880 B12R1.3 CCOC(CC)C1CCCCC1 7a_100011215090_100000210202 [0,0,1,1,0,0|1,0,1]=4 6881 B12R1.116 CCCC1CCC(CC1)OCC 34a_100011218949_100000210202 [0,0,1,1,0,0|1,0,1]=4 6882 B12R1.116 CCCC1CCC(CC1)OCC 7a_100011218949_100000210202 [0,0,1,1,0,0|1,0,1]=4 6883 B12R1.116 CCCC1CCC(CC1)OCF 34a_100011218949_100015361967 [0,0,1,1,0,0|1,0,1]=4 6884 B12R1.116 CCCC1CCC(CC1)OCF 7a_100011218949_100015361967 [0,0,1,1,0,0|1,0,1]=4 6885 B12R1.116 CCCC1CCN(CC1)CC=O 2230a_100015355601_200015260668 [0,0,1,1,0,0|2,0,0]=4 6886 B12R1.116 CCCC1CCN(CC1)CC=O 269982a_100015355601_200015260668 [0,0,1,1,0,0|2,0,0]=4 6887 B12R1.116 CCCC1CCN(CC1)CC=O 34a_100015355601_200009817547 [0,0,1,1,0,0|2,0,0]=4 6888 B12R1.173 O=CCN1CCCCCCCC1 2230a_100000039187_200015260668 [0,0,1,1,0,0|2,0,0]=4 6889 B12R1.173 O=CCN1CCCCCCCC1 269982a_100000039187_200015260668 [0,0,1,1,0,0|2,0,0]=4 6890 B12R1.173 O=CCN1CCCCCCCC1 34a_100000039187_200009817547 [0,0,1,1,0,0|2,0,0]=4 6891 B12R1.1143 CCC1CCCN(CC1)CC=O 2230a_100000757272_200015260668 [0,0,1,1,0,0|2,0,0]=4 6892 B12R1.1143 CCC1CCCN(CC1)CC=O 269982a_100000757272_200015260668 [0,0,1,1,0,0|2,0,0]=4 6893 B12R1.1143 CCC1CCCN(CC1)CC=O 34a_100000757272_200009817547 [0,0,1,1,0,0|2,0,0]=4 6894 B12R2.12 CC1CCN1CC2CCCO2 269982a_100000755817_100000183445 [1,0,0,1,0,0|1,0,1]=4 6895 B12R2.98 C1CCC(C1)OC2CCCO2 34a_100000085407_100000179811 [1,0,0,1,0,0|1,0,1]=4 6896 B12R2.98 C1COC(C1)CN2CCCC2 2230a_100000188435_100000203698 [1,0,0,1,0,0|1,0,1]=4 6897 B12R2.98 C1COC(C1)CN2CCCC2 269982a_100000188435_100000183445 [1,0,0,1,0,0|1,0,1]=4 6898 B12R2.2056 C1CC(C1)COC2CCCO2 34a_100000085407_100000763275 [1,0,0,1,0,0|1,0,1]=4 6899 B12R2.2056 C1CC(C1)NCC2CCCO2 2230a_100000749019_100000203698 [1,0,0,1,0,0|1,0,1]=4 6900 B12R2.2056 C1CC(C1)NC[C@@H]2CCCO2 270004a_100020590478_100000241760 [1,0,0,1,0,0|1,0,1]=4 6901 B12R2.2056 C1CC(C1)NC[C@@H]2CCCO2 34a_100020590478_100000749161 [1,0,0,1,0,0|1,0,1]=4 6902 B12R2.2056 C1CC(C1)OCC2CCCO2 34a_100000210270_100000749161 [1,0,0,1,0,0|1,0,1]=4 6903 B12R2.2056 C1COC(C1)CSC2CCC2 62a_100000203698_100000749161 [1,0,0,1,0,0|1,0,1]=4 6904 B12R2.2336 CCCCN1CC2C=CC1C2 2230a_100000732668_100000210211 [1,0,0,1,0,0|2,0,0]=4 6905 B12R2.2336 CCCCN1CC2C=CC1C2 269982a_100000732668_100000210211 [1,0,0,1,0,0|2,0,0]=4 6906 B12R2.2336 CCCCN1CC2C=CC1C2 34a_100000732668_100000210210 [1,0,0,1,0,0|2,0,0]=4 6907 B12R2.2336 CCCCN1C[C@H]2C[C@@H]1CO2 2230a_100016995552_100000210211 [1,0,0,1,0,0|1,0,1]=4 6908 B12R2.2336 CCCCN1C[C@H]2C[C@@H]1CO2 269982a_100016995552_100000210211 [1,0,0,1,0,0|1,0,1]=4 6909 B12R2.2336 CCCCN1C[C@H]2C[C@@H]1CO2 34a_100016995552_100000210210 [1,0,0,1,0,0|1,0,1]=4 6910 B12R2.2336 CCCOC1CC2C=CC1C2 34a_100000043678_100000210303 [1,0,0,1,0,0|2,0,0]=4 6911 B12R2.2336 CCNCC1CC2C=CC1C2 2230a_100000189500_100000210202 [1,0,0,1,0,0|2,0,0]=4 6912 B12R2.2336 CCNCC1CC2C=CC1C2 2230a_100015525214_200009814271 [1,0,0,1,0,0|2,0,0]=4 6913 B12R2.2336 CCNCC1CC2C=CC1C2 34a_100000189500_100000210202 [1,0,0,1,0,0|2,0,0]=4 6914 B12R2.2336 CCOCC1CC2C=CC1C2 34a_100011215361_100000210202 [1,0,0,1,0,0|2,0,0]=4 6915 B12R2.2336 CCOCC1CC2C=CC1C2 34a_100121572206_200009814271 [1,0,0,1,0,0|2,0,0]=4 6916 B12R2.2336 CCSCC1CC2C=CC1C2 62a_100000139495_100000210202 [1,0,0,1,0,0|2,0,0]=4 6917 B12R2.2336 CCSCC1CC2C=CC1C2 62a_100000210202_100000139495 [1,0,0,1,0,0|2,0,0]=4 6918 B12R2.2383 C1COC(C1)CNCC2CC2 2230a_100000735609_100000203698 [1,0,0,1,0,0|1,0,1]=4 6919 B12R2.2383 C1COC(C1)COCC2CC2 34a_100000210270_100000742324 [1,0,0,1,0,0|1,0,1]=4 6920 B12R2.2383 C1COC(C1)COCC2CC2 7a_100000210270_100000742324 [1,0,0,1,0,0|1,0,1]=4 6921 B12R2.2383 C1COC(C1)CSCC2CC2 62a_100000203698_100000742324 [1,0,0,1,0,0|1,0,1]=4 6922 B12R2.2383 C1COC(C1)CSCC2CC2 62a_100000756562_100000203698 [1,0,0,1,0,0|1,0,1]=4 6923 B12R2.2383 C1COC(C1)OCCC2CC2 34a_100000085407_100000694398 [1,0,0,1,0,0|1,0,1]=4 6924 B12R2.2383 C1CO[C@@H](C1)CNCC2CC2 2230a_100020590478_100000742324 [1,0,0,1,0,0|1,0,1]=4 6925 B12R2.2383 C1CO[C@@H](C1)CNCC2CC2 269862a_100020590478_100000741477 [1,0,0,1,0,0|1,0,1]=4 6926 B12R2.2383 C1CO[C@@H](C1)CNCC2CC2 34a_100020590478_100000742324 [1,0,0,1,0,0|1,0,1]=4 6927 B12R2.75 CC1CCN1C2COC(=O)O2 34a_100000755817_100000032252 [1,0,0,1,0,0|2,0,0]=4 6928 B12R2.2298 O=C1CCC(C1)OCC2CC2 34a_100012614533_100000742324 [1,0,0,1,0,0|2,0,0]=4 6929 B12R2.2298 O=C1CCC(N1)COC2CC2 34a_100000737831_100000211595 [1,0,0,1,0,0|2,0,0]=4 6930 B12R2.2298 O=C1CC[C@@H](N1)CNC2CC2 34a_100015423886_100000211595 [1,0,0,1,0,0|2,0,0]=4 6931 B12R2.2298 O=C1CC[C@H](N1)CSC2CC2 62a_100015189358_100000211595 [1,0,0,1,0,0|2,0,0]=4 6932 B12R2.2298 O=C1NCC(O1)CNC2CC2 34a_100000212008_100000181169 [1,0,0,1,0,0|2,0,0]=4 6933 B12R2.2298 O=C1NCC(O1)COC2CC2 34a_100011315639_100000211595 [1,0,0,1,0,0|2,0,0]=4 6934 B12R2.2298 O=C1NCC(O1)CSC2CC2 62a_100000181169_100000211595 [1,0,0,1,0,0|2,0,0]=4 6935 B12R2.2298 O=C1OCC(O1)CNC2CC2 34a_100000212008_100000073702 [1,0,0,1,0,0|2,0,0]=4 6936 B12R2.2298 O=C1OCC(O1)CSC2CC2 62a_100000073702_100000211595 [1,0,0,1,0,0|2,0,0]=4 6937 B12R2.2298 O=C1OCC(O1)NCC2CC2 34a_100000735609_100000032252 [1,0,0,1,0,0|2,0,0]=4 6938 B12R2.2298 O=C1OCC(O1)OCC2CC2 34a_100000211283_100000032252 [1,0,0,1,0,0|2,0,0]=4 6939 B12R2.2298 O=C1OCC(O1)SCC2CC2 62a_100000756562_100000032252 [1,0,0,1,0,0|2,0,0]=4 6940 B12R2.2301 O=C1CCC(C1)OC2CCC2 34a_100012614533_100000749161 [1,0,0,1,0,0|2,0,0]=4 6941 B12R2.2301 O=C1CC[C@H](N1)CN2CCC2 269982a_100000754969_100015189358 [1,0,0,1,0,0|2,0,0]=4 6942 B12R2.2301 O=C1NCC(O1)CN2CCC2 269982a_100000754969_100000181169 [1,0,0,1,0,0|2,0,0]=4 6943 B12R2.2301 O=C1OCC(O1)CN2CCC2 269982a_100000754969_100000073702 [1,0,0,1,0,0|2,0,0]=4 6944 B12R2.2301 O=C1OCC(O1)NC2CCC2 34a_100000749019_100000032252 [1,0,0,1,0,0|2,0,0]=4 6945 B12R2.2301 O=C1OCC(O1)OC2CCC2 34a_100000748187_100000032252 [1,0,0,1,0,0|2,0,0]=4 6946 B12R2.111 C[C@@H]1CCCN1C2CC(=O)C2 269982a_100015189458_100009894365 [0,0,0,1,1,0|2,0,0]=4 6947 B12R2.111 C[C@H]1CCCN1C2CC(=O)C2 269982a_100020605311_100009894365 [0,0,0,1,1,0|2,0,0]=4 6948 B12R2.118 CC1CCN1CC2CC(=O)C2 269982a_100000755817_100009874392 [0,0,0,1,1,0|2,0,0]=4 6949 B12R2.136 O=C1CC(C1)CN2CCCC2 2230a_100000188435_100009874392 [0,0,0,1,1,0|2,0,0]=4 6950 B12R2.136 O=C1CC(C1)CN2CCCC2 269982a_100000188435_100009874392 [0,0,0,1,1,0|2,0,0]=4 6951 B12R2.136 O=C1CC(C1)SC2CCCC2 62a_100009894365_100000179811 [0,0,0,1,1,0|2,0,0]=4 6952 B12R2.667 O=C1CC(C1)CNCC2CC2 2230a_100000735609_100009874392 [0,0,0,1,1,0|2,0,0]=4 6953 B12R2.667 O=C1CC(C1)COCC2CC2 34a_100000101936_100000742324 [0,0,0,1,1,0|2,0,0]=4 6954 B12R2.667 O=C1CC(C1)CSCC2CC2 62a_100000756562_100009874392 [0,0,0,1,1,0|2,0,0]=4 6955 B12R2.667 O=C1CC(C1)CSCC2CC2 62a_100009874392_100000742324 [0,0,0,1,1,0|2,0,0]=4 6956 B12R2.667 O=C1CC(C1)SCCC2CC2 62a_100009894365_100000764125 [0,0,0,1,1,0|2,0,0]=4 6957 B12R2.1269 O=C1CC(C1)CNC2CCC2 2230a_100000749019_100009874392 [0,0,0,1,1,0|2,0,0]=4 6958 B12R2.1269 O=C1CC(C1)COC2CCC2 34a_100000101936_100000749161 [0,0,0,1,1,0|2,0,0]=4 6959 B12R2.1269 O=C1CC(C1)CSC2CCC2 62a_100009874392_100000749161 [0,0,0,1,1,0|2,0,0]=4 6960 B12R2.1269 O=C1CC(C1)SCC2CCC2 62a_100009894365_100000763275 [0,0,0,1,1,0|2,0,0]=4 6961 B12R2.23 O=C1CCC1N2CCCOC2 269982a_100000131196_100009892977 [0,0,0,1,1,0|2,0,0]=4 6962 B12R2.23 O=C1CCC1N2CCCOC2 34a_100000131196_100009892977 [0,0,0,1,1,0|2,0,0]=4 6963 B12R2.23 O=C1CCC1N2CCOCC2 269982a_100015191051_100009892977 [0,0,0,1,1,0|2,0,0]=4 6964 B12R2.23 O=C1CCC1N2CCOCC2 34a_100015191051_100009892977 [0,0,0,1,1,0|2,0,0]=4 6965 B12R2.23 O=C1CCC1N2CCSCC2 269982a_100000737611_100009892977 [0,0,0,1,1,0|2,0,0]=4 6966 B12R2.110 CC1SCCN1C2CCC2=O 269982a_200011216479_100009892977 [0,0,0,1,1,0|2,0,0]=4 6967 B12R2.110 CC1SCCN1C2CCC2=O 34a_200011216479_100009892977 [0,0,0,1,1,0|2,0,0]=4 6968 B12R2.110 C[C@@H]1CCCN1C2CCC2=O 269982a_100015189458_100009892977 [0,0,0,1,1,0|1,0,0]=3 6969 B12R2.110 C[C@@H]1CCCN1C2CCC2=O 34a_100015189458_100009892977 [0,0,0,1,1,0|1,0,0]=3 6970 B12R2.110 C[C@H]1CCCN1C2CCC2=O 269982a_100020605311_100009892977 [0,0,0,1,1,0|1,0,0]=3 6971 B12R2.244 CC1CC1COC2CCC2=O 34a_100000744939_100009892977 [0,0,0,1,1,0|1,0,0]=3 6972 B12R2.244 CC1CC1COC2CCC2=O 7a_100000744939_100009892977 [0,0,0,1,1,0|1,0,0]=3 6973 B12R2.1298 O=C1CCC1CCSC2CC2 62a_200016118888_100000211595 [0,0,0,1,1,0|1,0,0]=3 6974 B12R2.1298 O=C1CCC1NCCC2CC2 34a_100000764129_100009892977 [0,0,0,1,1,0|1,0,0]=3 6975 B12R2.1298 O=C1CCC1OCCC2CC2 34a_100000754188_100009892977 [0,0,0,1,1,0|1,0,0]=3 6976 B12R2.1298 O=C1CCC1OCCC2CC2 7a_100000754188_100009892977 [0,0,0,1,1,0|1,0,0]=3 6977 B12R2.1298 O=C1CCC1OCC[C@@H]2CO2 34a_100009820653_100009892977 [0,0,0,1,1,0|2,0,0]=4 6978 B12R2.1298 O=C1CCC1SCCC2CC2 62a_100000764125_100009892977 [0,0,0,1,1,0|1,0,0]=3 6979 B12R2.1298 O=C1CCC1SCCC2CC2 62a_100009892977_100000764125 [0,0,0,1,1,0|1,0,0]=3 6980 B12R2.1298 O=C1CCC1SCCC2CO2 62a_100000732470_100009892977 [0,0,0,1,1,0|2,0,0]=4 6981 B12R2.1298 O=C1CCC1SCCC2CO2 62a_100009892977_100000732470 [0,0,0,1,1,0|2,0,0]=4 6982 B12R2.1310 O=C1CCC1CCN2CCC2 269982a_100000754969_200016118888 [0,0,0,1,1,0|1,0,0]=3 6983 B12R2.1310 O=C1CCC1NCC2CCC2 34a_100000738700_100009892977 [0,0,0,1,1,0|1,0,0]=3 6984 B12R2.1310 O=C1CCC1NCC2COC2 34a_100015281925_100009892977 [0,0,0,1,1,0|2,0,0]=4 6985 B12R2.1310 O=C1CCC1NC[C@@H]2CCO2 34a_100020831831_100009892977 [0,0,0,1,1,0|2,0,0]=4 6986 B12R2.1310 O=C1CCC1OCC2CCC2 34a_100000760304_100009892977 [0,0,0,1,1,0|1,0,0]=3 6987 B12R2.1310 O=C1CCC1OCC2CCO2 34a_100000039022_100009892977 [0,0,0,1,1,0|2,0,0]=4 6988 B12R2.1310 O=C1CCC1OCC2CNC2 34a_100016987283_100009892977 [0,0,0,1,1,0|2,0,0]=4 6989 B12R2.1310 O=C1CCC1OCC2COC2 34a_100000060846_100009892977 [0,0,0,1,1,0|2,0,0]=4 6990 B12R2.1310 O=C1CCC1SCC2CCC2 62a_100000763275_100009892977 [0,0,0,1,1,0|1,0,0]=3 6991 B12R2.1310 O=C1CCC1SCC2CCC2 62a_100009892977_100000763275 [0,0,0,1,1,0|1,0,0]=3 6992 B12R2.1310 O=C1CCC1SCC2CCO2 62a_100000103362_100009892977 [0,0,0,1,1,0|2,0,0]=4 6993 B12R2.1310 O=C1CCC1SCC2CCO2 62a_100009892977_100000103362 [0,0,0,1,1,0|2,0,0]=4 6994 B12R2.1310 O=C1CCC1SCC2COC2 62a_100009892977_100010264016 [0,0,0,1,1,0|2,0,0]=4 6995 B12R2.1310 O=C1CCC1SCC2COC2 62a_100010264016_100009892977 [0,0,0,1,1,0|2,0,0]=4 6996 B14R2.21 O=C1CN(CCN1)C2CCCCC2 270004a_100000184651_100000210434 [0,0,0,1,0,1|2,0,0]=4 6997 B14R2.21 O=C1CN(CCO1)C2CCCCC2 270004a_100000131268_100000210434 [0,0,0,1,0,1|2,0,0]=4 6998 B14R2.716 O=C1CC(CCN1)NC2CCCC2 2230a_100016994916_100000179811 [0,0,0,1,0,1|2,0,0]=4 6999 B14R2.716 O=C1CC(CCN1)NC2CCCC2 34a_100016994916_100000179811 [0,0,0,1,0,1|2,0,0]=4 7000 B14R2.716 O=C1CCCC(C1)OC2CCCC2 34a_100012613340_100000179811 [0,0,0,1,0,1|2,0,0]=4 7001 B14R2.716 O=C1CN(CCN1)CC2CCCC2 2230a_100000184651_100000740388 [0,0,0,1,0,1|2,0,0]=4 7002 B14R2.716 O=C1CN(CCO1)CC2CCCC2 2230a_100000131268_100000740388 [0,0,0,1,0,1|2,0,0]=4 7003 B14R2.716 O=C1C[C@@H](CCN1)OC2CCCC2 34a_100015189427_100000179811 [0,0,0,1,0,1|2,0,0]=4 7004 B14R2.4475 O=C1CC(CCN1)COC2CCC2 34a_100009886756_100000749161 [0,0,0,1,0,1|2,0,0]=4 7005 B14R2.4475 O=C1CC(CCN1)NCC2CCC2 2230a_100016994916_100000763275 [0,0,0,1,0,1|2,0,0]=4 7006 B14R2.4475 O=C1CC(CCN1)NCC2CCC2 269862a_100016994916_100000753134 [0,0,0,1,0,1|2,0,0]=4 7007 B14R2.4475 O=C1CC(CCN1)NCC2CCC2 34a_100016994916_100000763275 [0,0,0,1,0,1|2,0,0]=4 7008 B14R2.4475 O=C1CCCC(C1)OCC2CCC2 34a_100012613340_100000763275 [0,0,0,1,0,1|2,0,0]=4 7009 B14R2.4475 O=C1CCCC(N1)COC2CCC2 34a_200000102386_100000749161 [0,0,0,1,0,1|2,0,0]=4 7010 B14R2.4475 O=C1COCC(N1)COC2CCC2 34a_200000101122_100000749161 [0,0,0,1,0,1|2,0,0]=4 7011 B14R2.4475 O=C1C[C@@H](CCN1)OCC2CCC2 34a_100015189427_100000763275 [0,0,0,1,0,1|2,0,0]=4 7012 B14R2.9061 O=C1CC(CCN1)COCC2CC2 34a_100009886756_100000742324 [0,0,0,1,0,1|2,0,0]=4 7013 B14R2.9061 O=C1CC(CCN1)NCCC2CC2 2230a_100016994916_100000694398 [0,0,0,1,0,1|2,0,0]=4 7014 B14R2.9061 O=C1CC(CCN1)NCCC2CC2 34a_100016994916_100000694398 [0,0,0,1,0,1|2,0,0]=4 7015 B14R2.9061 O=C1CCCC(C1)OCCC2CC2 34a_100012613340_100000694398 [0,0,0,1,0,1|2,0,0]=4 7016 B14R2.9061 O=C1CCCC(N1)COCC2CC2 34a_200000102386_100000742324 [0,0,0,1,0,1|2,0,0]=4 7017 B14R2.9061 O=C1COCC(N1)COCC2CC2 34a_200000101122_100000742324 [0,0,0,1,0,1|2,0,0]=4 7018 B14R2.9061 O=C1C[C@@H](CCN1)OCCC2CC2 34a_100015189427_100000694398 [0,0,0,1,0,1|2,0,0]=4 7019 B14R2.72 O=C1CCC(CC1)OC2CCCC2 34a_100000764474_100000179811 [0,0,0,1,0,1|2,0,0]=4 7020 B14R2.72 O=C1CCC(CC1)OC2CCCC2 7a_100000764474_100000179811 [0,0,0,1,0,1|2,0,0]=4 7021 B14R2.72 O=C1CCC(CN1)NC2CCCC2 2230a_100000748762_100000179811 [0,0,0,1,0,1|2,0,0]=4 7022 B14R2.72 O=C1CCC(CN1)NC2CCCC2 270004a_100000748762_100000210133 [0,0,0,1,0,1|2,0,0]=4 7023 B14R2.72 O=C1CCC(CN1)NC2CCCC2 34a_100000748762_100000179811 [0,0,0,1,0,1|2,0,0]=4 7024 B14R2.72 O=C1CCC(CN1)OC2CCCC2 34a_100000079199_100000179811 [0,0,0,1,0,1|2,0,0]=4 7025 B14R2.951 O=C1CCC(CC1)COCC2CC2 34a_100000062911_100000742324 [0,0,0,1,0,1|2,0,0]=4 7026 B14R2.951 O=C1CCC(CC1)OCCC2CC2 34a_100000764474_100000694398 [0,0,0,1,0,1|2,0,0]=4 7027 B14R2.951 O=C1CCC(CC1)OCCC2CC2 7a_100000764474_100000764125 [0,0,0,1,0,1|2,0,0]=4 7028 B14R2.951 O=C1CCC(CN1)NCCC2CC2 2230a_100000748762_100000694398 [0,0,0,1,0,1|2,0,0]=4 7029 B14R2.951 O=C1CCC(CN1)NCCC2CC2 34a_100000748762_100000694398 [0,0,0,1,0,1|2,0,0]=4 7030 B14R2.951 O=C1CCC(CN1)OCCC2CC2 34a_100000079199_100000694398 [0,0,0,1,0,1|2,0,0]=4 7031 B14R2.10626 O=C1CCC(CC1)COC2CCC2 34a_100000062911_100000749161 [0,0,0,1,0,1|2,0,0]=4 7032 B14R2.10626 O=C1CCC(CC1)OCC2CCC2 34a_100000764474_100000763275 [0,0,0,1,0,1|2,0,0]=4 7033 B14R2.10626 O=C1CCC(CC1)OCC2CCC2 7a_100000764474_100000763275 [0,0,0,1,0,1|2,0,0]=4 7034 B14R2.10626 O=C1CCC(CN1)NCC2CCC2 2230a_100000748762_100000763275 [0,0,0,1,0,1|2,0,0]=4 7035 B14R2.10626 O=C1CCC(CN1)NCC2CCC2 269862a_100000748762_100000753134 [0,0,0,1,0,1|2,0,0]=4 7036 B14R2.10626 O=C1CCC(CN1)NCC2CCC2 34a_100000748762_100000763275 [0,0,0,1,0,1|2,0,0]=4 7037 B14R2.10626 O=C1CCC(CN1)OCC2CCC2 34a_100000079199_100000763275 [0,0,0,1,0,1|2,0,0]=4 7038 B14R2.22 C[C@H]1CCCN(C1)C2COC(=O)O2 34a_100000717927_100000032252 [0,1,0,1,0,0|2,0,0]=4 7039 B14R2.22 O=C1OCC(O1)N2CCCC(C2)F 34a_100000697950_100000032252 [0,1,0,1,0,0|2,0,0]=4 7040 B14R2.255 CN(C1CCCC1)C2COC(=O)O2 34a_100000207505_100000032252 [0,1,0,1,0,0|2,0,0]=4 7041 B14R2.255 O=C1CCC(N1)C(=O)C2CCCC2 1458a_100000210400_100000179811 [0,1,0,1,0,0|1,0,1]=4 7042 B14R2.255 O=C1CC[C@H](O1)C(=O)C2CCCC2 1458a_100009814974_100000179811 [0,1,0,1,0,0|0,0,1]=3 7043 B14R2.255 O=C1CC[C@H](O1)C(=O)C2CCOC2 1458a_100009814974_100000690089 [0,1,0,1,0,0|1,0,1]=4 7044 B14R2.255 O=C1CC[C@H](O1)C(=O)N2CCCC2 240690a_100000188435_100009814974 [0,1,0,1,0,0|1,0,1]=4 7045 B14R2.255 O=C1CC[C@H](O1)C(=O)N2CCCC2 527a_100000188435_100009814974 [0,1,0,1,0,0|1,0,1]=4 7046 B14R2.4359 O=C1OCC(O1)N2CCCCCC2 34a_100000185865_100000032252 [0,1,0,1,0,0|1,0,0]=3 7047 B14R2.4359 O=C1OCC(O1)N2CCCOCC2 34a_100000685342_100000032252 [0,1,0,1,0,0|2,0,0]=4 7048 B14R2.4375 CC1CCN1C(=O)[C@@H]2CCC(=O)O2 11a_100000755817_100009814974 [0,1,0,1,0,0|1,0,1]=4 7049 B14R2.4375 CC1CCN1C(=O)[C@@H]2CCC(=O)O2 240690a_100000755817_100009814974 [0,1,0,1,0,0|1,0,1]=4 7050 B14R2.4375 CC1CCN1C(=O)[C@@H]2CCC(=O)O2 527a_100000755817_100009814974 [0,1,0,1,0,0|1,0,1]=4 7051 B14R2.4396 O=C1CCC(N1)C(=O)CCC2CC2 1458a_100000210400_100000694398 [0,1,0,1,0,0|1,0,1]=4 7052 B14R2.4396 O=C1CC[C@H](O1)C(=O)CCC2CC2 1458a_100009814974_100000694398 [0,1,0,1,0,0|0,0,1]=3 7053 B14R2.4396 O=C1CC[C@H](O1)C(=O)CCC2CO2 1458a_100009814974_100000732470 [0,1,0,1,0,0|1,0,1]=4 7054 B14R2.4396 O=C1CC[C@H](O1)C(=O)NCC2CC2 11a_100000735609_100009814974 [0,1,0,1,0,0|1,0,1]=4 7055 B14R2.4396 O=C1CC[C@H](O1)C(=O)NCC2CC2 1626a_100000735609_100009814974 [0,1,0,1,0,0|1,0,1]=4 7056 B14R2.4396 O=C1CC[C@H](O1)C(=O)NCC2CC2 240690a_100000735609_100009814974 [0,1,0,1,0,0|1,0,1]=4 7057 B14R2.4396 O=C1CC[C@H](O1)C(=O)NCC2CC2 527a_100000735609_100009814974 [0,1,0,1,0,0|1,0,1]=4 7058 B14R2.20661 CN(CC1CCC1)C2COC(=O)O2 34a_200000750244_100000032252 [0,1,0,1,0,0|2,0,0]=4 7059 B14R2.20661 O=C1CCC(N1)C(=O)CC2CCC2 1458a_100000210400_100000763275 [0,1,0,1,0,0|1,0,1]=4 7060 B14R2.20661 O=C1CC[C@H](O1)C(=O)CC2CCC2 1458a_100009814974_100000763275 [0,1,0,1,0,0|0,0,1]=3 7061 B14R2.20661 O=C1CC[C@H](O1)C(=O)CC2CCO2 1458a_100009814974_100000103362 [0,1,0,1,0,0|1,0,1]=4 7062 B14R2.20661 O=C1CC[C@H](O1)C(=O)CC2COC2 1458a_100009814974_100010264016 [0,1,0,1,0,0|1,0,1]=4 7063 B14R2.20661 O=C1CC[C@H](O1)C(=O)NC2CCC2 11a_100000749019_100009814974 [0,1,0,1,0,0|1,0,1]=4 7064 B14R2.20661 O=C1CC[C@H](O1)C(=O)NC2CCC2 1626a_100000749019_100009814974 [0,1,0,1,0,0|1,0,1]=4 7065 B14R2.20661 O=C1CC[C@H](O1)C(=O)NC2CCC2 240690a_100000749019_100009814974 [0,1,0,1,0,0|1,0,1]=4 7066 B14R2.20661 O=C1CC[C@H](O1)C(=O)NC2CCC2 527a_100000749019_100009814974 [0,1,0,1,0,0|1,0,1]=4 7067 B14R2.19 O=C1CC(CN1)OC2CCCCC2 34a_100000690082_100000210327 [0,1,0,1,0,0|2,0,0]=4 7068 B14R2.19 O=C1CCC(C1)OC2CCCCC2 34a_100012614533_100000210327 [0,1,0,1,0,0|1,0,0]=3 7069 B14R2.19 O=C1CCC(C1)OC2CCCOC2 34a_100012614533_100000693364 [0,1,0,1,0,0|2,0,0]=4 7070 B14R2.19 O=C1CCC(C1)OC2CCSCC2 34a_100012614533_100000069128 [0,1,0,1,0,0|2,0,0]=4 7071 B14R2.19 O=C1CC[C@H](N1)CN2CCCOC2 2230a_100000131196_100015189358 [0,1,0,1,0,0|2,0,0]=4 7072 B14R2.19 O=C1CC[C@H](N1)CN2CCCOC2 269982a_100000131196_100015189358 [0,1,0,1,0,0|2,0,0]=4 7073 B14R2.19 O=C1CC[C@H](N1)CN2CCOCC2 2230a_100015191051_100015189358 [0,1,0,1,0,0|2,0,0]=4 7074 B14R2.19 O=C1CC[C@H](N1)CN2CCOCC2 269982a_100015191051_100015189358 [0,1,0,1,0,0|2,0,0]=4 7075 B14R2.19 O=C1CC[C@H](N1)CN2CCSCC2 2230a_100000737611_100015189358 [0,1,0,1,0,0|2,0,0]=4 7076 B14R2.19 O=C1CC[C@H](N1)CN2CCSCC2 269982a_100000737611_100015189358 [0,1,0,1,0,0|2,0,0]=4 7077 B14R2.19 O=C1NCC(O1)CN2CCCOC2 2230a_100000131196_100000181169 [0,1,0,1,0,0|2,0,0]=4 7078 B14R2.19 O=C1NCC(O1)CN2CCCOC2 269982a_100000131196_100000181169 [0,1,0,1,0,0|2,0,0]=4 7079 B14R2.19 O=C1NCC(O1)CN2CCCOC2 34a_100000131196_100000181169 [0,1,0,1,0,0|2,0,0]=4 7080 B14R2.19 O=C1NCC(O1)CN2CCOCC2 2230a_100015191051_100000181169 [0,1,0,1,0,0|2,0,0]=4 7081 B14R2.19 O=C1NCC(O1)CN2CCOCC2 269982a_100015191051_100000181169 [0,1,0,1,0,0|2,0,0]=4 7082 B14R2.19 O=C1NCC(O1)CN2CCOCC2 34a_100015191051_100000181169 [0,1,0,1,0,0|2,0,0]=4 7083 B14R2.19 O=C1NCC(O1)CN2CCSCC2 2230a_100000737611_100000181169 [0,1,0,1,0,0|2,0,0]=4 7084 B14R2.19 O=C1NCC(O1)CN2CCSCC2 269982a_100000737611_100000181169 [0,1,0,1,0,0|2,0,0]=4 7085 B14R2.19 O=C1OCC(O1)CN2CCCOC2 269982a_100000131196_100000073702 [0,1,0,1,0,0|2,0,0]=4 7086 B14R2.19 O=C1OCC(O1)CN2CCCOC2 34a_100000131196_100000073702 [0,1,0,1,0,0|2,0,0]=4 7087 B14R2.19 O=C1OCC(O1)CN2CCOCC2 269982a_100015191051_100000073702 [0,1,0,1,0,0|2,0,0]=4 7088 B14R2.19 O=C1OCC(O1)CN2CCOCC2 34a_100015191051_100000073702 [0,1,0,1,0,0|2,0,0]=4 7089 B14R2.19 O=C1OCC(O1)CN2CCSCC2 269982a_100000737611_100000073702 [0,1,0,1,0,0|2,0,0]=4 7090 B14R2.19 O=C1OCC(O1)NC2CCCCC2 34a_100000182618_100000032252 [0,1,0,1,0,0|1,0,0]=3 7091 B14R2.19 O=C1OCC(O1)NC2CCCOC2 34a_100000719290_100000032252 [0,1,0,1,0,0|2,0,0]=4 7092 B14R2.19 O=C1OCC(O1)NC2CCOCC2 34a_100000741149_100000032252 [0,1,0,1,0,0|2,0,0]=4 7093 B14R2.19 O=C1OCC(O1)NC2CCSCC2 34a_100000748639_100000032252 [0,1,0,1,0,0|2,0,0]=4 7094 B14R2.19 O=C1OCC(O1)OC2CCCCC2 34a_100000210231_100000032252 [0,1,0,1,0,0|1,0,0]=3 7095 B14R2.19 O=C1OCC(O1)OC2CCCCO2 34a_100000033831_100000032252 [0,1,0,1,0,0|2,0,0]=4 7096 B14R2.19 O=C1OCC(O1)OC2CCCOC2 34a_100000754041_100000032252 [0,1,0,1,0,0|2,0,0]=4 7097 B14R2.19 O=C1OCC(O1)OC2CCOCC2 34a_100000744328_100000032252 [0,1,0,1,0,0|2,0,0]=4 7098 B14R2.19 O=C1OCC(O1)OC2CCSCC2 34a_100000731022_100000032252 [0,1,0,1,0,0|2,0,0]=4 7099 B14R2.19 O=C1OCC(O1)SC2CCCCC2 62a_100000210327_100000032252 [0,1,0,1,0,0|1,0,0]=3 7100 B14R2.97 CCC1CCCN1C2COC(=O)O2 34a_100000754278_100000032252 [0,1,0,1,0,0|1,0,0]=3 7101 B14R2.97 O=C1OCC(O1)N2CCC[C@@H]2CO 34a_100000745186_100000032252 [0,1,0,1,0,0|2,0,0]=4 7102 B14R2.107 COCC1CCN1C2COC(=O)O2 34a_100015195929_100000032252 [0,1,0,1,0,0|2,0,0]=4 7103 B14R2.145 CCCCCN1CC2CCC(C1)O2 2230a_100015188616_100000210326 [0,1,0,1,0,0|1,0,1]=4 7104 B14R2.145 CCCCCN1CC2CCC(C1)O2 269982a_100015188616_100000210215 [0,1,0,1,0,0|1,0,1]=4 7105 B14R2.145 CCCCCN1CC2CCC(C1)O2 34a_100015188616_100000718602 [0,1,0,1,0,0|1,0,1]=4 7106 B14R2.145 CCCCNC1CC2CCC(C1)O2 270004a_100000102301_100010474450 [0,1,0,1,0,0|1,0,1]=4 7107 B14R2.251 CC1CCN1CCC2COS(=O)O2 269982a_100000755817_100009840081 [0,1,0,1,0,0|2,0,0]=4 7108 B14R2.252 O=C1CC(CN1)CNC2CCCC2 2230a_100016993742_100000179811 [0,1,0,1,0,0|2,0,0]=4 7109 B14R2.252 O=C1CC(CN1)CNC2CCCC2 34a_100016993742_100000179811 [0,1,0,1,0,0|2,0,0]=4 7110 B14R2.252 O=C1CC(CN1)COC2CCCC2 34a_100016041077_100000179811 [0,1,0,1,0,0|2,0,0]=4 7111 B14R2.252 O=C1CC(CN1)NCC2CCCC2 2230a_100000697751_100000740388 [0,1,0,1,0,0|2,0,0]=4 7112 B14R2.252 O=C1CC(CN1)NCC2CCCC2 269862a_100000697751_100000746403 [0,1,0,1,0,0|2,0,0]=4 7113 B14R2.252 O=C1CC(CN1)OCC2CCCC2 34a_100000690082_100000740388 [0,1,0,1,0,0|2,0,0]=4 7114 B14R2.252 O=C1CCC(C1)OCC2CCCC2 34a_100012614533_100000740388 [0,1,0,1,0,0|1,0,0]=3 7115 B14R2.252 O=C1CCC(C1)OCC2CCOC2 34a_100012614533_100011261433 [0,1,0,1,0,0|2,0,0]=4 7116 B14R2.252 O=C1CCC(N1)COC2CCCC2 34a_100000737831_100000179811 [0,1,0,1,0,0|1,0,0]=3 7117 B14R2.252 O=C1CCC(N1)COC2CCOC2 34a_100000737831_100000690089 [0,1,0,1,0,0|2,0,0]=4 7118 B14R2.252 O=C1CC[C@@H](N1)CNC2CCCC2 2230a_100015423886_100000179811 [0,1,0,1,0,0|1,0,0]=3 7119 B14R2.252 O=C1CC[C@@H](N1)CNC2CCCC2 270004a_100015423886_100000210133 [0,1,0,1,0,0|1,0,0]=3 7120 B14R2.252 O=C1CC[C@@H](N1)CNC2CCCC2 34a_100015423886_100000179811 [0,1,0,1,0,0|1,0,0]=3 7121 B14R2.252 O=C1CC[C@@H](N1)CNC2CCOC2 2230a_100015423886_100000731011 [0,1,0,1,0,0|2,0,0]=4 7122 B14R2.252 O=C1CC[C@@H](N1)CNC2CCOC2 270004a_100015423886_100000752484 [0,1,0,1,0,0|2,0,0]=4 7123 B14R2.252 O=C1CC[C@@H](N1)CNC2CCOC2 34a_100015423886_100000690089 [0,1,0,1,0,0|2,0,0]=4 7124 B14R2.252 O=C1CC[C@@H](N1)CNC2CCSC2 270004a_100015423886_100000212027 [0,1,0,1,0,0|2,0,0]=4 7125 B14R2.252 O=C1CC[C@H](N1)CNC2CCCC2 2230a_100000211070_100015189358 [0,1,0,1,0,0|1,0,0]=3 7126 B14R2.252 O=C1CC[C@H](N1)CN[C@@H]2CCOC2 2230a_200015188469_100015189358 [0,1,0,1,0,0|2,0,0]=4 7127 B14R2.252 O=C1CC[C@H](N1)CN[C@H]2CCOC2 2230a_100015188467_100015189358 [0,1,0,1,0,0|2,0,0]=4 7128 B14R2.252 O=C1CC[C@H](N1)COC2CCCC2 7a_100000210269_100015189358 [0,1,0,1,0,0|1,0,0]=3 7129 B14R2.252 O=C1CC[C@H](N1)COC2CCSC2 7a_100011232664_100015189358 [0,1,0,1,0,0|2,0,0]=4 7130 B14R2.252 O=C1CC[C@H](N1)CSC2CCCC2 62a_100011217020_100015189358 [0,1,0,1,0,0|1,0,0]=3 7131 B14R2.252 O=C1CC[C@H](N1)CSC2CCCC2 62a_100015189358_100000179811 [0,1,0,1,0,0|1,0,0]=3 7132 B14R2.252 O=C1CC[C@H](N1)CSC2CCOC2 62a_100015189358_100000690089 [0,1,0,1,0,0|2,0,0]=4 7133 B14R2.252 O=C1NCC(O1)CNC2CCCC2 2230a_100000211070_100000181169 [0,1,0,1,0,0|1,0,0]=3 7134 B14R2.252 O=C1NCC(O1)CNC2CCCC2 34a_100000211070_100000181169 [0,1,0,1,0,0|1,0,0]=3 7135 B14R2.252 O=C1NCC(O1)CN[C@@H]2CCOC2 2230a_200015188469_100000181169 [0,1,0,1,0,0|2,0,0]=4 7136 B14R2.252 O=C1NCC(O1)CN[C@H]2CCOC2 2230a_100015188467_100000181169 [0,1,0,1,0,0|2,0,0]=4 7137 B14R2.252 O=C1NCC(O1)CN[C@H]2CCOC2 34a_100015188467_100000181169 [0,1,0,1,0,0|2,0,0]=4 7138 B14R2.252 O=C1NCC(O1)COC2CCCC2 34a_100000210269_100000181169 [0,1,0,1,0,0|1,0,0]=3 7139 B14R2.252 O=C1NCC(O1)COC2CCCC2 34a_100011315639_100000179811 [0,1,0,1,0,0|1,0,0]=3 7140 B14R2.252 O=C1NCC(O1)COC2CCCC2 7a_100000210269_100000181169 [0,1,0,1,0,0|1,0,0]=3 7141 B14R2.252 O=C1NCC(O1)COC2CCCO2 34a_100000085407_100000181169 [0,1,0,1,0,0|2,0,0]=4 7142 B14R2.252 O=C1NCC(O1)COC2CCOC2 34a_100011315639_100000690089 [0,1,0,1,0,0|2,0,0]=4 7143 B14R2.252 O=C1NCC(O1)COC2CCSC2 7a_100011232664_100000181169 [0,1,0,1,0,0|2,0,0]=4 7144 B14R2.252 O=C1NCC(O1)CO[C@H]2CCOC2 34a_100000717292_100000181169 [0,1,0,1,0,0|2,0,0]=4 7145 B14R2.252 O=C1NCC(O1)CSC2CCCC2 62a_100000181169_100000179811 [0,1,0,1,0,0|1,0,0]=3 7146 B14R2.252 O=C1NCC(O1)CSC2CCCC2 62a_100011217020_100000181169 [0,1,0,1,0,0|1,0,0]=3 7147 B14R2.252 O=C1NCC(O1)CSC2CCOC2 62a_100000181169_100000690089 [0,1,0,1,0,0|2,0,0]=4 7148 B14R2.252 O=C1N[C@H](CO1)CNC2CCCC2 2230a_100000211070_100015307671 [0,1,0,1,0,0|2,0,0]=4 7149 B14R2.252 O=C1N[C@H](CO1)CNC2CCCC2 34a_100000211070_100015307671 [0,1,0,1,0,0|2,0,0]=4 7150 B14R2.252 O=C1N[C@H](CO1)COC2CCCC2 34a_100000210269_100015307671 [0,1,0,1,0,0|2,0,0]=4 7151 B14R2.252 O=C1N[C@H](CO1)COC2CCCC2 7a_100000210269_100015307671 [0,1,0,1,0,0|2,0,0]=4 7152 B14R2.252 O=C1N[C@H](CO1)CSC2CCCC2 62a_100011217020_100015307671 [0,1,0,1,0,0|2,0,0]=4 7153 B14R2.252 O=C1N[C@H](CO1)CSC2CCCC2 62a_100015307671_100000179811 [0,1,0,1,0,0|2,0,0]=4 7154 B14R2.252 O=C1OCC(O1)CNC2CCCC2 34a_100000211070_100000073702 [0,1,0,1,0,0|1,0,0]=3 7155 B14R2.252 O=C1OCC(O1)CN[C@H]2CCOC2 34a_100015188467_100000073702 [0,1,0,1,0,0|2,0,0]=4 7156 B14R2.252 O=C1OCC(O1)COC2CCCC2 34a_100000210269_100000073702 [0,1,0,1,0,0|1,0,0]=3 7157 B14R2.252 O=C1OCC(O1)COC2CCCO2 34a_100000085407_100000073702 [0,1,0,1,0,0|2,0,0]=4 7158 B14R2.252 O=C1OCC(O1)CO[C@H]2CCOC2 34a_100000717292_100000073702 [0,1,0,1,0,0|2,0,0]=4 7159 B14R2.252 O=C1OCC(O1)CSC2CCCC2 62a_100000073702_100000179811 [0,1,0,1,0,0|1,0,0]=3 7160 B14R2.252 O=C1OCC(O1)CSC2CCCC2 62a_100011217020_100000073702 [0,1,0,1,0,0|1,0,0]=3 7161 B14R2.252 O=C1OCC(O1)CSC2CCOC2 62a_100000073702_100000690089 [0,1,0,1,0,0|2,0,0]=4 7162 B14R2.252 O=C1OCC(O1)NCC2CCCC2 34a_100000737975_100000032252 [0,1,0,1,0,0|1,0,0]=3 7163 B14R2.252 O=C1OCC(O1)NCC2CCOC2 34a_100000737293_100000032252 [0,1,0,1,0,0|2,0,0]=4 7164 B14R2.252 O=C1OCC(O1)NC[C@@H]2CCCO2 34a_100020590478_100000032252 [0,1,0,1,0,0|2,0,0]=4 7165 B14R2.252 O=C1OCC(O1)OCC2CCCC2 34a_100000742336_100000032252 [0,1,0,1,0,0|1,0,0]=3 7166 B14R2.252 O=C1OCC(O1)OCC2CCCO2 34a_100000210270_100000032252 [0,1,0,1,0,0|2,0,0]=4 7167 B14R2.252 O=C1OCC(O1)OCC2CCNC2 34a_100000748654_100000032252 [0,1,0,1,0,0|2,0,0]=4 7168 B14R2.252 O=C1OCC(O1)OCC2CCOC2 34a_100000740260_100000032252 [0,1,0,1,0,0|2,0,0]=4 7169 B14R2.252 O=C1OCC(O1)OC[C@H]2CCCN2 34a_100000745186_100000032252 [0,1,0,1,0,0|2,0,0]=4 7170 B14R2.252 O=C1OCC(O1)SCC2CCCC2 62a_100000740388_100000032252 [0,1,0,1,0,0|1,0,0]=3 7171 B14R2.252 O=C1OCC(O1)SCC2CCCO2 62a_100000203698_100000032252 [0,1,0,1,0,0|2,0,0]=4 7172 B14R2.252 O=C1OCC(O1)SCC2CCOC2 62a_100000702531_100000032252 [0,1,0,1,0,0|2,0,0]=4 7173 B14R2.252 O=S1OCC(O1)CCN2CCCC2 269982a_100000188435_100009840081 [0,1,0,1,0,0|2,0,0]=4 7174 B14R2.256 CC1CCCCN1C2COC(=O)O2 34a_100000211376_100000032252 [0,1,0,1,0,0|1,0,0]=3 7175 B14R2.256 C[C@H]1COCCN1C2COC(=O)O2 34a_100009815349_100000032252 [0,1,0,1,0,0|2,0,0]=4 7176 B14R2.257 CC1CC1COCC2CNC(=O)O2 34a_100000744939_100000181169 [0,1,0,1,0,0|1,0,0]=3 7177 B14R2.257 CC1CC1COCC2CNC(=O)O2 7a_100000744939_100000181169 [0,1,0,1,0,0|1,0,0]=3 7178 B14R2.257 CC1CC1COCC2COC(=O)O2 34a_100000744939_100000073702 [0,1,0,1,0,0|1,0,0]=3 7179 B14R2.257 CC1CC1COC[C@@H]2CCC(=O)N2 7a_100000744939_100015189358 [0,1,0,1,0,0|1,0,0]=3 7180 B14R2.257 CC1CC1COC[C@H]2COC(=O)N2 34a_100000744939_100015307671 [0,1,0,1,0,0|2,0,0]=4 7181 B14R2.257 CC1CC1COC[C@H]2COC(=O)N2 7a_100000744939_100015307671 [0,1,0,1,0,0|2,0,0]=4 7182 B14R2.259 CC1CCCC1NC2CNC(=O)C2 269862a_100000697751_100000752053 [0,1,0,1,0,0|2,0,0]=4 7183 B14R2.259 CC1CCCC1OC2COC(=O)O2 34a_100011216460_100000032252 [0,1,0,1,0,0|1,0,0]=3 7184 B14R2.259 CC1SCCN1CC2CNC(=O)O2 2230a_200011216479_100000181169 [0,1,0,1,0,0|2,0,0]=4 7185 B14R2.259 CC1SCCN1CC2CNC(=O)O2 269982a_200011216479_100000181169 [0,1,0,1,0,0|2,0,0]=4 7186 B14R2.259 CC1SCCN1CC2CNC(=O)O2 34a_200011216479_100000181169 [0,1,0,1,0,0|2,0,0]=4 7187 B14R2.259 CC1SCCN1CC2COC(=O)O2 269982a_200011216479_100000073702 [0,1,0,1,0,0|2,0,0]=4 7188 B14R2.259 CC1SCCN1CC2COC(=O)O2 34a_200011216479_100000073702 [0,1,0,1,0,0|2,0,0]=4 7189 B14R2.259 CC1SCCN1C[C@@H]2CCC(=O)N2 2230a_200011216479_100015189358 [0,1,0,1,0,0|2,0,0]=4 7190 B14R2.259 CC1SCCN1C[C@@H]2CCC(=O)N2 269982a_200011216479_100015189358 [0,1,0,1,0,0|2,0,0]=4 7191 B14R2.259 C[C@@H]1CCCN1CC2CNC(=O)O2 2230a_100015189458_100000181169 [0,1,0,1,0,0|1,0,0]=3 7192 B14R2.259 C[C@@H]1CCCN1CC2CNC(=O)O2 269982a_100015189458_100000181169 [0,1,0,1,0,0|1,0,0]=3 7193 B14R2.259 C[C@@H]1CCCN1CC2CNC(=O)O2 34a_100015189458_100000181169 [0,1,0,1,0,0|1,0,0]=3 7194 B14R2.259 C[C@@H]1CCCN1CC2COC(=O)O2 269982a_100015189458_100000073702 [0,1,0,1,0,0|1,0,0]=3 7195 B14R2.259 C[C@@H]1CCCN1CC2COC(=O)O2 34a_100015189458_100000073702 [0,1,0,1,0,0|1,0,0]=3 7196 B14R2.259 C[C@@H]1CCCN1C[C@@H]2CCC(=O)N2 2230a_100015189458_100015189358 [0,1,0,1,0,0|1,0,0]=3 7197 B14R2.259 C[C@@H]1CCCN1C[C@@H]2CCC(=O)N2 269982a_100015189458_100015189358 [0,1,0,1,0,0|1,0,0]=3 7198 B14R2.259 C[C@@H]1CCCN1C[C@H]2COC(=O)N2 2230a_100015189458_100015307671 [0,1,0,1,0,0|2,0,0]=4 7199 B14R2.259 C[C@@H]1CCCN1C[C@H]2COC(=O)N2 269982a_100015189458_100015307671 [0,1,0,1,0,0|2,0,0]=4 7200 B14R2.259 C[C@@H]1CCCN1C[C@H]2COC(=O)N2 34a_100015189458_100015307671 [0,1,0,1,0,0|2,0,0]=4 7201 B14R2.259 C[C@@H]1CNC[C@@H]1OC2COC(=O)O2 34a_200015306588_100000032252 [0,1,0,1,0,0|2,0,0]=4 7202 B14R2.259 C[C@H]1CCCN1CC2CNC(=O)O2 2230a_100020605311_100000181169 [0,1,0,1,0,0|1,0,0]=3 7203 B14R2.259 C[C@H]1CCCN1CC2CNC(=O)O2 269982a_100020605311_100000181169 [0,1,0,1,0,0|1,0,0]=3 7204 B14R2.259 C[C@H]1CCCN1CC2COC(=O)O2 269982a_100020605311_100000073702 [0,1,0,1,0,0|1,0,0]=3 7205 B14R2.259 C[C@H]1CCCN1C[C@@H]2CCC(=O)N2 2230a_100020605311_100015189358 [0,1,0,1,0,0|1,0,0]=3 7206 B14R2.259 C[C@H]1CCCN1C[C@@H]2CCC(=O)N2 269982a_100020605311_100015189358 [0,1,0,1,0,0|1,0,0]=3 7207 B14R2.259 C[C@H]1CCCN1C[C@H]2COC(=O)N2 2230a_100020605311_100015307671 [0,1,0,1,0,0|2,0,0]=4 7208 B14R2.259 C[C@H]1CCCN1C[C@H]2COC(=O)N2 269982a_100020605311_100015307671 [0,1,0,1,0,0|2,0,0]=4 7209 B14R2.259 N[C@H]1CCC[C@@H]1OC2COC(=O)O2 34a_100000748460_100000032252 [0,1,0,1,0,0|2,0,0]=4 7210 B14R2.259 O=C1OCC(O1)O[C@@H]2CCC[C@H]2Cl 34a_200016002552_100000032252 [0,1,0,1,0,0|2,0,0]=4 7211 B14R2.259 O=C1OCC(O1)S[C@@H]2CCC[C@H]2O 62a_200016002552_100000032252 [0,1,0,1,0,0|2,0,0]=4 7212 B14R2.4374 O=C1CC(CN1)CNCCC2CC2 2230a_100016993742_100000694398 [0,1,0,1,0,0|2,0,0]=4 7213 B14R2.4374 O=C1CC(CN1)CNCCC2CC2 34a_100016993742_100000694398 [0,1,0,1,0,0|2,0,0]=4 7214 B14R2.4374 O=C1CC(CN1)COCCC2CC2 34a_100016041077_100000694398 [0,1,0,1,0,0|2,0,0]=4 7215 B14R2.4374 O=C1CCC(C1)OCCCC2CO2 34a_100012614533_100000733510 [0,1,0,1,0,0|2,0,0]=4 7216 B14R2.4374 O=C1CCC(N1)COCCC2CC2 34a_100000737831_100000694398 [0,1,0,1,0,0|1,0,0]=3 7217 B14R2.4374 O=C1CCC(N1)COCCC2CO2 34a_100000737831_100000732470 [0,1,0,1,0,0|2,0,0]=4 7218 B14R2.4374 O=C1CC[C@@H](N1)CNCCC2CC2 2230a_100015423886_100000694398 [0,1,0,1,0,0|1,0,0]=3 7219 B14R2.4374 O=C1CC[C@@H](N1)CNCCC2CC2 34a_100015423886_100000694398 [0,1,0,1,0,0|1,0,0]=3 7220 B14R2.4374 O=C1CC[C@@H](N1)CNCCC2CO2 2230a_100015423886_100000732470 [0,1,0,1,0,0|2,0,0]=4 7221 B14R2.4374 O=C1CC[C@@H](N1)CNCCC2CO2 34a_100015423886_100000732470 [0,1,0,1,0,0|2,0,0]=4 7222 B14R2.4374 O=C1CC[C@H](N1)COCCC2CC2 7a_100000754188_100015189358 [0,1,0,1,0,0|1,0,0]=3 7223 B14R2.4374 O=C1CC[C@H](N1)CSCCC2CC2 62a_100000764125_100015189358 [0,1,0,1,0,0|1,0,0]=3 7224 B14R2.4374 O=C1CC[C@H](N1)CSCCC2CC2 62a_100015189358_100000764125 [0,1,0,1,0,0|1,0,0]=3 7225 B14R2.4374 O=C1CC[C@H](N1)CSCCC2CO2 62a_100000732470_100015189358 [0,1,0,1,0,0|2,0,0]=4 7226 B14R2.4374 O=C1CC[C@H](N1)CSCCC2CO2 62a_100015189358_100000732470 [0,1,0,1,0,0|2,0,0]=4 7227 B14R2.4374 O=C1NCC(O1)CNCCC2CC2 34a_100000764129_100000181169 [0,1,0,1,0,0|1,0,0]=3 7228 B14R2.4374 O=C1NCC(O1)COCCC2CC2 34a_100000754188_100000181169 [0,1,0,1,0,0|1,0,0]=3 7229 B14R2.4374 O=C1NCC(O1)COCCC2CC2 34a_100011315639_100000694398 [0,1,0,1,0,0|1,0,0]=3 7230 B14R2.4374 O=C1NCC(O1)COCCC2CC2 7a_100000754188_100000181169 [0,1,0,1,0,0|1,0,0]=3 7231 B14R2.4374 O=C1NCC(O1)COCCC2CO2 34a_100011315639_100000732470 [0,1,0,1,0,0|2,0,0]=4 7232 B14R2.4374 O=C1NCC(O1)COCC[C@@H]2CO2 34a_100009820653_100000181169 [0,1,0,1,0,0|2,0,0]=4 7233 B14R2.4374 O=C1NCC(O1)CSCCC2CC2 62a_100000181169_100000764125 [0,1,0,1,0,0|1,0,0]=3 7234 B14R2.4374 O=C1NCC(O1)CSCCC2CC2 62a_100000764125_100000181169 [0,1,0,1,0,0|1,0,0]=3 7235 B14R2.4374 O=C1NCC(O1)CSCCC2CO2 62a_100000181169_100000732470 [0,1,0,1,0,0|2,0,0]=4 7236 B14R2.4374 O=C1NCC(O1)CSCCC2CO2 62a_100000732470_100000181169 [0,1,0,1,0,0|2,0,0]=4 7237 B14R2.4374 O=C1N[C@H](CO1)CNCCC2CC2 34a_100000764129_100015307671 [0,1,0,1,0,0|2,0,0]=4 7238 B14R2.4374 O=C1N[C@H](CO1)COCCC2CC2 34a_100000754188_100015307671 [0,1,0,1,0,0|2,0,0]=4 7239 B14R2.4374 O=C1N[C@H](CO1)COCCC2CC2 7a_100000754188_100015307671 [0,1,0,1,0,0|2,0,0]=4 7240 B14R2.4374 O=C1N[C@H](CO1)CSCCC2CC2 62a_100000764125_100015307671 [0,1,0,1,0,0|2,0,0]=4 7241 B14R2.4374 O=C1N[C@H](CO1)CSCCC2CC2 62a_100015307671_100000764125 [0,1,0,1,0,0|2,0,0]=4 7242 B14R2.4374 O=C1OCC(O1)CNCCC2CC2 34a_100000764129_100000073702 [0,1,0,1,0,0|1,0,0]=3 7243 B14R2.4374 O=C1OCC(O1)COCCC2CC2 34a_100000754188_100000073702 [0,1,0,1,0,0|1,0,0]=3 7244 B14R2.4374 O=C1OCC(O1)COCC[C@@H]2CO2 34a_100009820653_100000073702 [0,1,0,1,0,0|2,0,0]=4 7245 B14R2.4374 O=C1OCC(O1)CSCCC2CC2 62a_100000073702_100000764125 [0,1,0,1,0,0|1,0,0]=3 7246 B14R2.4374 O=C1OCC(O1)CSCCC2CC2 62a_100000764125_100000073702 [0,1,0,1,0,0|1,0,0]=3 7247 B14R2.4374 O=C1OCC(O1)CSCCC2CO2 62a_100000073702_100000732470 [0,1,0,1,0,0|2,0,0]=4 7248 B14R2.4374 O=C1OCC(O1)CSCCC2CO2 62a_100000732470_100000073702 [0,1,0,1,0,0|2,0,0]=4 7249 B14R2.4374 O=C1OCC(O1)OCCNC2CC2 34a_100000738766_100000032252 [0,1,0,1,0,0|2,0,0]=4 7250 B14R2.4374 O=C1OCC(O1)SCCCC2CO2 62a_100000733510_100000032252 [0,1,0,1,0,0|2,0,0]=4 7251 B14R2.4374 O=S1OCC(O1)CCSCC2CC2 62a_100000756562_100009840081 [0,1,0,1,0,0|2,0,0]=4 7252 B14R2.4390 O=C1CC(CN1)CNCC2CCC2 2230a_100016993742_100000763275 [0,1,0,1,0,0|2,0,0]=4 7253 B14R2.4390 O=C1CC(CN1)CNCC2CCC2 269862a_100016993742_100000753134 [0,1,0,1,0,0|2,0,0]=4 7254 B14R2.4390 O=C1CC(CN1)CNCC2CCC2 34a_100016993742_100000763275 [0,1,0,1,0,0|2,0,0]=4 7255 B14R2.4390 O=C1CC(CN1)COCC2CCC2 34a_100016041077_100000763275 [0,1,0,1,0,0|2,0,0]=4 7256 B14R2.4390 O=C1CCC(N1)COCC2CCC2 34a_100000737831_100000763275 [0,1,0,1,0,0|1,0,0]=3 7257 B14R2.4390 O=C1CCC(N1)COCC2CCO2 34a_100000737831_100000103362 [0,1,0,1,0,0|2,0,0]=4 7258 B14R2.4390 O=C1CCC(N1)COCC2COC2 34a_100000737831_100010264016 [0,1,0,1,0,0|2,0,0]=4 7259 B14R2.4390 O=C1CC[C@@H](N1)CNCC2CCC2 2230a_100015423886_100000763275 [0,1,0,1,0,0|1,0,0]=3 7260 B14R2.4390 O=C1CC[C@@H](N1)CNCC2CCC2 269862a_100015423886_100000753134 [0,1,0,1,0,0|1,0,0]=3 7261 B14R2.4390 O=C1CC[C@@H](N1)CNCC2CCC2 34a_100015423886_100000763275 [0,1,0,1,0,0|1,0,0]=3 7262 B14R2.4390 O=C1CC[C@@H](N1)CNCC2CCO2 2230a_100015423886_100000103362 [0,1,0,1,0,0|2,0,0]=4 7263 B14R2.4390 O=C1CC[C@@H](N1)CNCC2CCO2 34a_100015423886_100000103362 [0,1,0,1,0,0|2,0,0]=4 7264 B14R2.4390 O=C1CC[C@@H](N1)CNCC2COC2 2230a_100015423886_100010264016 [0,1,0,1,0,0|2,0,0]=4 7265 B14R2.4390 O=C1CC[C@@H](N1)CNCC2COC2 34a_100015423886_100010264016 [0,1,0,1,0,0|2,0,0]=4 7266 B14R2.4390 O=C1CC[C@H](N1)CNCC2CCC2 2230a_100000738700_100015189358 [0,1,0,1,0,0|1,0,0]=3 7267 B14R2.4390 O=C1CC[C@H](N1)CNCC2COC2 2230a_100015281925_100015189358 [0,1,0,1,0,0|2,0,0]=4 7268 B14R2.4390 O=C1CC[C@H](N1)CNC[C@@H]2CCO2 2230a_100020831831_100015189358 [0,1,0,1,0,0|2,0,0]=4 7269 B14R2.4390 O=C1CC[C@H](N1)CSCC2CCC2 62a_100000763275_100015189358 [0,1,0,1,0,0|1,0,0]=3 7270 B14R2.4390 O=C1CC[C@H](N1)CSCC2CCC2 62a_100015189358_100000763275 [0,1,0,1,0,0|1,0,0]=3 7271 B14R2.4390 O=C1CC[C@H](N1)CSCC2CCO2 62a_100000103362_100015189358 [0,1,0,1,0,0|2,0,0]=4 7272 B14R2.4390 O=C1CC[C@H](N1)CSCC2CCO2 62a_100015189358_100000103362 [0,1,0,1,0,0|2,0,0]=4 7273 B14R2.4390 O=C1CC[C@H](N1)CSCC2COC2 62a_100010264016_100015189358 [0,1,0,1,0,0|2,0,0]=4 7274 B14R2.4390 O=C1CC[C@H](N1)CSCC2COC2 62a_100015189358_100010264016 [0,1,0,1,0,0|2,0,0]=4 7275 B14R2.4390 O=C1NCC(O1)CNCC2CCC2 2230a_100000738700_100000181169 [0,1,0,1,0,0|1,0,0]=3 7276 B14R2.4390 O=C1NCC(O1)CNCC2CCC2 34a_100000738700_100000181169 [0,1,0,1,0,0|1,0,0]=3 7277 B14R2.4390 O=C1NCC(O1)CNCC2COC2 2230a_100015281925_100000181169 [0,1,0,1,0,0|2,0,0]=4 7278 B14R2.4390 O=C1NCC(O1)CNCC2COC2 34a_100015281925_100000181169 [0,1,0,1,0,0|2,0,0]=4 7279 B14R2.4390 O=C1NCC(O1)CNC[C@@H]2CCO2 2230a_100020831831_100000181169 [0,1,0,1,0,0|2,0,0]=4 7280 B14R2.4390 O=C1NCC(O1)CNC[C@@H]2CCO2 34a_100020831831_100000181169 [0,1,0,1,0,0|2,0,0]=4 7281 B14R2.4390 O=C1NCC(O1)COCC2CCC2 34a_100000760304_100000181169 [0,1,0,1,0,0|1,0,0]=3 7282 B14R2.4390 O=C1NCC(O1)COCC2CCC2 34a_100011315639_100000763275 [0,1,0,1,0,0|1,0,0]=3 7283 B14R2.4390 O=C1NCC(O1)COCC2CCO2 34a_100000039022_100000181169 [0,1,0,1,0,0|2,0,0]=4 7284 B14R2.4390 O=C1NCC(O1)COCC2CCO2 34a_100011315639_100000103362 [0,1,0,1,0,0|2,0,0]=4 7285 B14R2.4390 O=C1NCC(O1)COCC2CNC2 34a_100016987283_100000181169 [0,1,0,1,0,0|2,0,0]=4 7286 B14R2.4390 O=C1NCC(O1)COCC2COC2 34a_100000060846_100000181169 [0,1,0,1,0,0|2,0,0]=4 7287 B14R2.4390 O=C1NCC(O1)COCC2COC2 34a_100011315639_100010264016 [0,1,0,1,0,0|2,0,0]=4 7288 B14R2.4390 O=C1NCC(O1)CSCC2CCC2 62a_100000181169_100000763275 [0,1,0,1,0,0|1,0,0]=3 7289 B14R2.4390 O=C1NCC(O1)CSCC2CCC2 62a_100000763275_100000181169 [0,1,0,1,0,0|1,0,0]=3 7290 B14R2.4390 O=C1NCC(O1)CSCC2CCO2 62a_100000103362_100000181169 [0,1,0,1,0,0|2,0,0]=4 7291 B14R2.4390 O=C1NCC(O1)CSCC2CCO2 62a_100000181169_100000103362 [0,1,0,1,0,0|2,0,0]=4 7292 B14R2.4390 O=C1NCC(O1)CSCC2COC2 62a_100000181169_100010264016 [0,1,0,1,0,0|2,0,0]=4 7293 B14R2.4390 O=C1NCC(O1)CSCC2COC2 62a_100010264016_100000181169 [0,1,0,1,0,0|2,0,0]=4 7294 B14R2.4390 O=C1N[C@H](CO1)CNCC2CCC2 2230a_100000738700_100015307671 [0,1,0,1,0,0|2,0,0]=4 7295 B14R2.4390 O=C1N[C@H](CO1)CNCC2CCC2 34a_100000738700_100015307671 [0,1,0,1,0,0|2,0,0]=4 7296 B14R2.4390 O=C1N[C@H](CO1)COCC2CCC2 34a_100000760304_100015307671 [0,1,0,1,0,0|2,0,0]=4 7297 B14R2.4390 O=C1N[C@H](CO1)CSCC2CCC2 62a_100000763275_100015307671 [0,1,0,1,0,0|2,0,0]=4 7298 B14R2.4390 O=C1N[C@H](CO1)CSCC2CCC2 62a_100015307671_100000763275 [0,1,0,1,0,0|2,0,0]=4 7299 B14R2.4390 O=C1OCC(O1)CNCC2CCC2 34a_100000738700_100000073702 [0,1,0,1,0,0|1,0,0]=3 7300 B14R2.4390 O=C1OCC(O1)CNCC2COC2 34a_100015281925_100000073702 [0,1,0,1,0,0|2,0,0]=4 7301 B14R2.4390 O=C1OCC(O1)CNC[C@@H]2CCO2 34a_100020831831_100000073702 [0,1,0,1,0,0|2,0,0]=4 7302 B14R2.4390 O=C1OCC(O1)COCC2CCC2 34a_100000760304_100000073702 [0,1,0,1,0,0|1,0,0]=3 7303 B14R2.4390 O=C1OCC(O1)COCC2CCO2 34a_100000039022_100000073702 [0,1,0,1,0,0|2,0,0]=4 7304 B14R2.4390 O=C1OCC(O1)COCC2CNC2 34a_100016987283_100000073702 [0,1,0,1,0,0|2,0,0]=4 7305 B14R2.4390 O=C1OCC(O1)COCC2COC2 34a_100000060846_100000073702 [0,1,0,1,0,0|2,0,0]=4 7306 B14R2.4390 O=C1OCC(O1)CSCC2CCC2 62a_100000073702_100000763275 [0,1,0,1,0,0|1,0,0]=3 7307 B14R2.4390 O=C1OCC(O1)CSCC2CCC2 62a_100000763275_100000073702 [0,1,0,1,0,0|1,0,0]=3 7308 B14R2.4390 O=C1OCC(O1)CSCC2CCO2 62a_100000073702_100000103362 [0,1,0,1,0,0|2,0,0]=4 7309 B14R2.4390 O=C1OCC(O1)CSCC2CCO2 62a_100000103362_100000073702 [0,1,0,1,0,0|2,0,0]=4 7310 B14R2.4390 O=C1OCC(O1)CSCC2COC2 62a_100000073702_100010264016 [0,1,0,1,0,0|2,0,0]=4 7311 B14R2.4390 O=C1OCC(O1)CSCC2COC2 62a_100010264016_100000073702 [0,1,0,1,0,0|2,0,0]=4 7312 B14R2.4390 O=C1OCC(O1)OCCC2COC2 34a_100009855314_100000032252 [0,1,0,1,0,0|2,0,0]=4 7313 B14R2.4367 O=C1CC[C@H](N1)CNC2CC(C2)F 2230a_100016993743_100015189358 [0,1,0,1,0,0|2,0,0]=4 7314 B14R2.4367 O=C1CC[C@H](N1)CN[C@H]2C[C@@H](C2)O 2230a_100020629032_100015189358 [0,1,0,1,0,0|2,0,0]=4 7315 B14R2.4367 O=C1NCC(O1)CNC2CC(C2)F 2230a_100016993743_100000181169 [0,1,0,1,0,0|2,0,0]=4 7316 B14R2.4367 O=C1NCC(O1)CN[C@H]2C[C@@H](C2)O 2230a_100020629032_100000181169 [0,1,0,1,0,0|2,0,0]=4 7317 B14R2.4367 O=C1OCC(O1)OCC2CC(C2)Cl 34a_100009874164_100000032252 [0,1,0,1,0,0|2,0,0]=4 7318 B14R2.4373 CC(NCC1CNC(=O)O1)C2CC2 2230a_100000700016_100000181169 [0,1,0,1,0,0|2,0,0]=4 7319 B14R2.4373 CC(NCC1CNC(=O)O1)C2CC2 34a_100000700016_100000181169 [0,1,0,1,0,0|2,0,0]=4 7320 B14R2.4373 CC(NCC1COC(=O)O1)C2CC2 34a_100000700016_100000073702 [0,1,0,1,0,0|2,0,0]=4 7321 B14R2.4373 CC(NC[C@@H]1CCC(=O)N1)C2CC2 2230a_100000700016_100015189358 [0,1,0,1,0,0|2,0,0]=4 7322 B14R2.4373 CC(NC[C@H]1CCC(=O)N1)C2CC2 269862a_100015423886_100000210639 [0,1,0,1,0,0|2,0,0]=4 7323 B14R2.4373 CC(OCC1CNC(=O)O1)C2CC2 34a_100000744524_100000181169 [0,1,0,1,0,0|2,0,0]=4 7324 B14R2.4373 CC(OCC1CNC(=O)O1)C2CC2 7a_100000744524_100000181169 [0,1,0,1,0,0|2,0,0]=4 7325 B14R2.4373 CC(OCC1COC(=O)O1)C2CC2 34a_100000744524_100000073702 [0,1,0,1,0,0|2,0,0]=4 7326 B14R2.4373 CC(OC[C@@H]1CCC(=O)N1)C2CC2 7a_100000744524_100015189358 [0,1,0,1,0,0|2,0,0]=4 7327 B14R2.4373 N[C@@H](COC1COC(=O)O1)C2CC2 34a_100020623730_100000032252 [0,1,0,1,0,0|2,0,0]=4 7328 B14R2.4373 O=C1OCC(O1)NCC(O)C2CC2 34a_100000751198_100000032252 [0,1,0,1,0,0|2,0,0]=4 7329 B14R2.9967 CCCC(=O)[C@@H]1C[C@@H]2CC1C(=O)O2 1458a_200045396503_100000210303 [0,1,0,1,0,0|0,0,1]=3 7330 B14R2.9967 CCCC(=O)[C@@H]1C[C@@H]2C[C@H]1C(=O)O2 1458a_200121570381_100000210303 [0,1,0,1,0,0|0,0,1]=3 7331 B14R2.9967 CCNC(=O)[C@@H]1C[C@@H]2CC1C(=O)O2 11a_100015525214_200045396503 [0,1,0,1,0,0|1,0,1]=4 7332 B14R2.9967 CCNC(=O)[C@@H]1C[C@@H]2CC1C(=O)O2 240690a_100015525214_200045396503 [0,1,0,1,0,0|1,0,1]=4 7333 B14R2.9967 CCNC(=O)[C@@H]1C[C@@H]2CC1C(=O)O2 527a_100015525214_200045396503 [0,1,0,1,0,0|1,0,1]=4 7334 B14R2.9967 CCNC(=O)[C@@H]1C[C@@H]2C[C@H]1C(=O)O2 240690a_100015525214_200121570381 [0,1,0,1,0,0|1,0,1]=4 7335 B14R2.9967 O=C(CCF)[C@@H]1C[C@@H]2C[C@H]1C(=O)O2 1458a_200121570381_100011217306 [0,1,0,1,0,0|1,0,1]=4 7336 B14R2.9967 O=C(CCO)[C@@H]1C[C@@H]2C[C@H]1C(=O)O2 1458a_200121570381_100000211926 [0,1,0,1,0,0|1,0,1]=4 7337 B14R2.9967 O=C1O[C@H]2CC1[C@@H](C2)C(=O)CCF 1458a_200045396503_100011217306 [0,1,0,1,0,0|1,0,1]=4 7338 B14R2.9967 O=C1O[C@H]2CC1[C@@H](C2)C(=O)CCO 1458a_200045396503_100000211926 [0,1,0,1,0,0|1,0,1]=4 7339 B14R2.20659 CC1(CCC1)COC2CCC(=O)C2 34a_100012614533_100000726658 [0,1,0,1,0,0|2,0,0]=4 7340 B14R2.20659 CC1(CCC1)CSC2COC(=O)O2 62a_100000726658_100000032252 [0,1,0,1,0,0|2,0,0]=4 7341 B14R2.20659 CC1(CCC1)NCC2CNC(=O)O2 2230a_100000692455_100000181169 [0,1,0,1,0,0|2,0,0]=4 7342 B14R2.20659 CC1(CCC1)NCC2CNC(=O)O2 34a_100000692455_100000181169 [0,1,0,1,0,0|2,0,0]=4 7343 B14R2.20659 CC1(CCC1)NCC2COC(=O)O2 34a_100000692455_100000073702 [0,1,0,1,0,0|2,0,0]=4 7344 B14R2.20659 CC1(CCC1)NC[C@@H]2CCC(=O)N2 2230a_100000692455_100015189358 [0,1,0,1,0,0|2,0,0]=4 7345 B14R2.20659 CC1(CCC1)OCC2CNC(=O)O2 34a_100000759064_100000181169 [0,1,0,1,0,0|2,0,0]=4 7346 B14R2.20659 CC1(CCC1)OCC2CNC(=O)O2 7a_100000759064_100000181169 [0,1,0,1,0,0|2,0,0]=4 7347 B14R2.20659 CC1(CCC1)OCC2COC(=O)O2 34a_100000759064_100000073702 [0,1,0,1,0,0|2,0,0]=4 7348 B14R2.20659 CC1(CCC1)OC[C@@H]2CCC(=O)N2 7a_100000759064_100015189358 [0,1,0,1,0,0|2,0,0]=4 7349 B14R2.250 CC1CCC(C1)OC2COC(=O)O2 34a_100000698185_100000032252 [0,1,0,1,0,0|2,0,0]=4 7350 B14R2.250 C[C@@H]1CCN(C1)CC2CNC(=O)O2 2230a_100016987628_100000181169 [0,1,0,1,0,0|2,0,0]=4 7351 B14R2.250 C[C@@H]1CCN(C1)CC2CNC(=O)O2 269982a_100016987628_100000181169 [0,1,0,1,0,0|2,0,0]=4 7352 B14R2.250 C[C@@H]1CCN(C1)CC2CNC(=O)O2 34a_100016987628_100000181169 [0,1,0,1,0,0|2,0,0]=4 7353 B14R2.250 C[C@@H]1CCN(C1)CC2COC(=O)O2 269982a_100016987628_100000073702 [0,1,0,1,0,0|2,0,0]=4 7354 B14R2.250 C[C@@H]1CCN(C1)CC2COC(=O)O2 34a_100016987628_100000073702 [0,1,0,1,0,0|2,0,0]=4 7355 B14R2.250 C[C@@H]1CCN(C1)C[C@@H]2CCC(=O)N2 2230a_100016987628_100015189358 [0,1,0,1,0,0|2,0,0]=4 7356 B14R2.250 C[C@@H]1CCN(C1)C[C@@H]2CCC(=O)N2 269982a_100016987628_100015189358 [0,1,0,1,0,0|2,0,0]=4 7357 B14R2.250 O=C1CC[C@H](N1)CN2CCC(C2)O 2230a_100011215560_100015189358 [0,1,0,1,0,0|2,0,0]=4 7358 B14R2.250 O=C1CC[C@H](N1)CN2CCC(C2)O 269982a_100011215560_100015189358 [0,1,0,1,0,0|2,0,0]=4 7359 B14R2.250 O=C1CC[C@H](N1)CN2CC[C@@H](C2)F 2230a_100015203821_100015189358 [0,1,0,1,0,0|2,0,0]=4 7360 B14R2.250 O=C1CC[C@H](N1)CN2CC[C@@H](C2)F 269982a_100015203821_100015189358 [0,1,0,1,0,0|2,0,0]=4 7361 B14R2.250 O=C1NCC(O1)CN2CCC(C2)O 2230a_100011215560_100000181169 [0,1,0,1,0,0|2,0,0]=4 7362 B14R2.250 O=C1NCC(O1)CN2CCC(C2)O 269982a_100011215560_100000181169 [0,1,0,1,0,0|2,0,0]=4 7363 B14R2.250 O=C1NCC(O1)CN2CC[C@@H](C2)F 2230a_100015203821_100000181169 [0,1,0,1,0,0|2,0,0]=4 7364 B14R2.250 O=C1NCC(O1)CN2CC[C@@H](C2)F 269982a_100015203821_100000181169 [0,1,0,1,0,0|2,0,0]=4 7365 B14R2.250 O=C1NCC(O1)CN2CC[C@@H](C2)F 34a_100015203821_100000181169 [0,1,0,1,0,0|2,0,0]=4 7366 B14R2.250 O=C1OCC(O1)CN2CCC(C2)O 269982a_100011215560_100000073702 [0,1,0,1,0,0|2,0,0]=4 7367 B14R2.250 O=C1OCC(O1)CN2CC[C@@H](C2)F 269982a_100015203821_100000073702 [0,1,0,1,0,0|2,0,0]=4 7368 B14R2.250 O=C1OCC(O1)CN2CC[C@@H](C2)F 34a_100015203821_100000073702 [0,1,0,1,0,0|2,0,0]=4 7369 B14R2.1183 CCC1CN(C1)CC2CNC(=O)O2 2230a_100015205115_100000181169 [0,1,0,1,0,0|2,0,0]=4 7370 B14R2.1183 CCC1CN(C1)CC2CNC(=O)O2 269982a_100015205115_100000181169 [0,1,0,1,0,0|2,0,0]=4 7371 B14R2.1183 CCC1CN(C1)CC2COC(=O)O2 269982a_100015205115_100000073702 [0,1,0,1,0,0|2,0,0]=4 7372 B14R2.1183 CCC1CN(C1)C[C@@H]2CCC(=O)N2 2230a_100015205115_100015189358 [0,1,0,1,0,0|2,0,0]=4 7373 B14R2.1183 CCC1CN(C1)C[C@@H]2CCC(=O)N2 269982a_100015205115_100015189358 [0,1,0,1,0,0|2,0,0]=4 7374 B14R2.4365 CC1CC1C(=O)CC2CNC(=O)O2 1458a_100000211227_100000181169 [0,1,0,1,0,0|1,0,1]=4 7375 B14R2.4365 CC1CC1C(=O)CC2COC(=O)O2 1458a_100000211227_100000073702 [0,1,0,1,0,0|1,0,1]=4 7376 B14R2.4365 CC1CC1C(=O)C[C@@H]2CCC(=O)N2 1458a_100000211227_100015189358 [0,1,0,1,0,0|1,0,1]=4 7377 B14R2.4383 CC1(CCCC1)OC2COC(=O)O2 34a_100000751722_100000032252 [0,1,0,1,0,0|2,0,0]=4 7378 B14R2.4389 CN(CC1CC1)CC2CNC(=O)O2 2230a_100000741881_100000181169 [0,1,0,1,0,0|2,0,0]=4 7379 B14R2.4389 CN(CC1CC1)CC2CNC(=O)O2 269982a_100000741881_100000181169 [0,1,0,1,0,0|2,0,0]=4 7380 B14R2.4389 CN(CC1CC1)CC2COC(=O)O2 269982a_100000741881_100000073702 [0,1,0,1,0,0|2,0,0]=4 7381 B14R2.4389 CN(CC1CC1)C[C@@H]2CCC(=O)N2 2230a_100000741881_100015189358 [0,1,0,1,0,0|2,0,0]=4 7382 B14R2.4389 CN(CC1CC1)C[C@@H]2CCC(=O)N2 269982a_100000741881_100015189358 [0,1,0,1,0,0|2,0,0]=4 7383 B14R2.4389 O=C(CC1CC1)CC2CCC(=O)N2 1458a_100000026770_100000742324 [0,1,0,1,0,0|1,0,1]=4 7384 B14R2.4389 O=C(CC1CC1)CC2CNC(=O)O2 1458a_100000738066_100000181169 [0,1,0,1,0,0|1,0,1]=4 7385 B14R2.4389 O=C(CC1CC1)CC2COC(=O)O2 1458a_100000738066_100000073702 [0,1,0,1,0,0|1,0,1]=4 7386 B14R2.4389 O=C(CC1CC1)C[C@@H]2CCC(=O)N2 1458a_100000738066_100015189358 [0,1,0,1,0,0|1,0,1]=4 7387 B14R2.4392 CC1CCC(N1C2COC(=O)O2)C 34a_100000687148_100000032252 [0,1,0,1,0,0|2,0,0]=4 7388 B14R2.20658 CC(NC1COC(=O)O1)C2CCC2 34a_100016994624_100000032252 [0,1,0,1,0,0|2,0,0]=4 7389 B14R2.20658 CC(OC1COC(=O)O1)C2CCC2 34a_100000766398_100000032252 [0,1,0,1,0,0|2,0,0]=4 7390 B14R2.20658 CN(CC1CNC(=O)O1)C2CCC2 2230a_100000758072_100000181169 [0,1,0,1,0,0|2,0,0]=4 7391 B14R2.20658 CN(CC1CNC(=O)O1)C2CCC2 269982a_100000758072_100000181169 [0,1,0,1,0,0|2,0,0]=4 7392 B14R2.20658 CN(CC1CNC(=O)O1)C2CCC2 34a_100000758072_100000181169 [0,1,0,1,0,0|2,0,0]=4 7393 B14R2.20658 CN(CC1COC(=O)O1)C2CCC2 269982a_100000758072_100000073702 [0,1,0,1,0,0|2,0,0]=4 7394 B14R2.20658 CN(CC1COC(=O)O1)C2CCC2 34a_100000758072_100000073702 [0,1,0,1,0,0|2,0,0]=4 7395 B14R2.20658 CN(C[C@@H]1CCC(=O)N1)C2CCC2 2230a_100000758072_100015189358 [0,1,0,1,0,0|2,0,0]=4 7396 B14R2.20658 CN(C[C@@H]1CCC(=O)N1)C2CCC2 269982a_100000758072_100015189358 [0,1,0,1,0,0|2,0,0]=4 7397 B14R2.20658 O=C1CCC(N1)CC(=O)C2CCC2 1458a_100000026770_100000749161 [0,1,0,1,0,0|1,0,1]=4 7398 B14R2.20658 O=C1CC[C@H](N1)CC(=O)C2CCC2 1458a_100000209988_100015189358 [0,1,0,1,0,0|1,0,1]=4 7399 B14R2.20658 O=C1NCC(O1)CC(=O)C2CCC2 1458a_100000209988_100000181169 [0,1,0,1,0,0|1,0,1]=4 7400 B14R2.20658 O=C1OCC(O1)CC(=O)C2CCC2 1458a_100000209988_100000073702 [0,1,0,1,0,0|1,0,1]=4 7401 B14R2.253 CC1(CCCN1C2COC(=O)O2)C 34a_100000761399_100000032252 [0,1,0,1,0,0|2,0,0]=4 7402 B14R2.4366 CC1(CC1COC2COC(=O)O2)C 34a_100000728257_100000032252 [0,1,0,1,0,0|2,0,0]=4 7403 B14R2.20 CC1CCN(CC1)C2COC(=O)O2 34a_100000188429_100000032252 [0,1,0,1,0,0|2,0,0]=4 7404 B14R2.20 O=C1OCC(O1)N2CCC(CC2)F 34a_100015193889_100000032252 [0,1,0,1,0,0|2,0,0]=4 7405 B14R2.4368 CC1(CC1)CNCC2CNC(=O)O2 2230a_100000766693_100000181169 [0,1,0,1,0,0|2,0,0]=4 7406 B14R2.4368 CC1(CC1)CNC[C@@H]2CCC(=O)N2 2230a_100000766693_100015189358 [0,1,0,1,0,0|2,0,0]=4 7407 B14R2.4368 CC1(CC1)COCC2CNC(=O)O2 7a_100000698024_100000181169 [0,1,0,1,0,0|2,0,0]=4 7408 B14R2.4368 CC1(CC1)COC[C@@H]2CCC(=O)N2 7a_100000698024_100015189358 [0,1,0,1,0,0|2,0,0]=4 7409 B14R2.4368 O=C1CC[C@H](N1)CNCC2(CC2)O 2230a_100011936951_100015189358 [0,1,0,1,0,0|2,0,0]=4 7410 B14R2.4368 O=C1CC[C@H](N1)COCC2(CC2)F 7a_200000703853_100015189358 [0,1,0,1,0,0|2,0,0]=4 7411 B14R2.4368 O=C1NCC(O1)CNCC2(CC2)O 2230a_100011936951_100000181169 [0,1,0,1,0,0|2,0,0]=4 7412 B14R2.4368 O=C1NCC(O1)COCC2(CC2)F 34a_200000703853_100000181169 [0,1,0,1,0,0|2,0,0]=4 7413 B14R2.4368 O=C1NCC(O1)COCC2(CC2)F 7a_200000703853_100000181169 [0,1,0,1,0,0|2,0,0]=4 7414 B14R2.4368 O=C1OCC(O1)COCC2(CC2)F 34a_200000703853_100000073702 [0,1,0,1,0,0|2,0,0]=4 7415 B14R2.4371 C[C@H]1[C@H](CN1CC2CNC(=O)O2)O 2230a_206633788156_100000181169 [0,1,0,1,0,0|2,0,0]=4 7416 B14R2.4371 C[C@H]1[C@H](CN1CC2CNC(=O)O2)O 269982a_206633788156_100000181169 [0,1,0,1,0,0|2,0,0]=4 7417 B14R2.4371 C[C@H]1[C@H](CN1CC2COC(=O)O2)O 269982a_206633788156_100000073702 [0,1,0,1,0,0|2,0,0]=4 7418 B14R2.4371 C[C@H]1[C@H](CN1C[C@@H]2CCC(=O)N2)O 2230a_206633788156_100015189358 [0,1,0,1,0,0|2,0,0]=4 7419 B14R2.4371 C[C@H]1[C@H](CN1C[C@@H]2CCC(=O)N2)O 269982a_206633788156_100015189358 [0,1,0,1,0,0|2,0,0]=4 7420 B14R3.3793 O=C1OCC(O1)N2CC3CC3C2 34a_100000741873_100000032252 [0,0,0,2,0,0|2,0,0]=4 7421 B10R0.75 C=C(C)C(C)NCCCCC 269862a_100000209983_100011216138 [0,0,1,0,1,0|2,0,0]=4 7422 B10R0.75 CC(=O)C(C)COCCCF 34a_100000032740_100011934791 [0,0,1,0,1,0|2,0,0]=4 7423 B10R0.75 CC(=O)C(C)COCCCF 7a_100000032740_100011934791 [0,0,1,0,1,0|2,0,0]=4 7424 B10R0.75 CC(=O)C(C)COCCCO 34a_100000032740_100000230001 [0,0,1,0,1,0|2,0,0]=4 7425 B10R0.75 CC(=O)C(C)COCCCO 7a_100000032740_100011215043 [0,0,1,0,1,0|2,0,0]=4 7426 B10R0.75 CC(=O)C(C)NCCCCO 2230a_100000750430_100009814033 [0,0,1,0,1,0|2,0,0]=4 7427 B10R0.75 CC(=O)C(C)OCCCCCl 7a_100000210776_100000179758 [0,0,1,0,1,0|2,0,0]=4 7428 B10R0.75 CC(=O)C(C)OCCCCF 34a_100000212229_100000729493 [0,0,1,0,1,0|2,0,0]=4 7429 B10R0.75 CC(=O)C(C)OCCCCF 7a_100011995726_100000179758 [0,0,1,0,1,0|2,0,0]=4 7430 B10R0.75 CC(=O)C(C)OCCCCO 34a_100000212229_100011216708 [0,0,1,0,1,0|2,0,0]=4 7431 B10R0.75 CC(=O)C(C)SCCCCF 62a_100000729493_100009814033 [0,0,1,0,1,0|2,0,0]=4 7432 B10R0.75 CC(=O)C(C)SCCCCF 62a_100009814033_100000729493 [0,0,1,0,1,0|2,0,0]=4 7433 B10R0.75 CC(=O)C(C)SCCCCO 62a_100000210776_100009814033 [0,0,1,0,1,0|2,0,0]=4 7434 B10R0.75 CC(=O)C(C)SCCCCO 62a_100009814033_100000210776 [0,0,1,0,1,0|2,0,0]=4 7435 B10R0.75 CC(=O)N(C)CCCCCO 240690a_100000722520_100015343762 [0,0,1,0,1,0|2,0,0]=4 7436 B10R0.75 CCCCCCC(C)C(=O)C 1458a_100000070787_100011215978 [0,0,1,0,1,0|0,0,0]=2 7437 B10R0.75 CCCCCCC(C)N(C)C 2230a_100102631434_100011215978 [0,0,1,0,1,0|2,0,0]=4 7438 B10R0.75 CCCCCCC(C)N(C)C 269982a_100102631434_100011215978 [0,0,1,0,1,0|2,0,0]=4 7439 B10R0.75 CCCCCCC(C)N(C)C 270004a_100102631434_100000210826 [0,0,1,0,1,0|2,0,0]=4 7440 B10R0.75 CCCCCCC(O)C(=O)C 1458a_100011215828_200000210301 [0,0,1,0,1,0|1,0,0]=3 7441 B10R0.75 CCCCCCC(O)C(=O)[13CH3] 1458a_100011215828_200025704644 [0,0,1,0,1,0|1,0,0]=3 7442 B10R0.75 CCCCCCN(C)C(=O)C 11a_106256046315_100015343762 [0,0,1,0,1,0|1,0,0]=3 7443 B10R0.75 CCCCCCN(C)C(=O)C 1626a_106256046315_100015343762 [0,0,1,0,1,0|1,0,0]=3 7444 B10R0.75 CCCCCCN(C)C(=O)C 240690a_106256046315_100015343762 [0,0,1,0,1,0|1,0,0]=3 7445 B10R0.75 CCCCCCN(C)C(=O)C 527a_106256046315_100103153847 [0,0,1,0,1,0|1,0,0]=3 7446 B10R0.75 CCCCCNC(C)C(=O)C 2230a_100000209983_100009814033 [0,0,1,0,1,0|1,0,0]=3 7447 B10R0.75 CCCCCNC(C)C(=O)N 2230a_100000209983_100000702099 [0,0,1,0,1,0|2,0,0]=4 7448 B10R0.75 CCCCCN[C@@H](C)C(=O)O 269956a_100000743915_100000210326 [0,0,1,0,1,0|2,0,0]=4 7449 B10R0.75 CCCCCN[C@H](C)C(=O)N 2230a_100000119354_100000210326 [0,0,1,0,1,0|2,0,0]=4 7450 B10R0.75 CCCCCN[C@H](C)C(=O)N 34a_100000119354_100000718602 [0,0,1,0,1,0|2,0,0]=4 7451 B10R0.75 CCCCCOC(C)C(=O)C 34a_100000212229_100000718602 [0,0,1,0,1,0|1,0,0]=3 7452 B10R0.75 CCCCCOC(C)C(=O)C 7a_100000210253_100000179758 [0,0,1,0,1,0|1,0,0]=3 7453 B10R0.75 CCCCCOC(C)C(=O)N 34a_100000210253_100000702099 [0,0,1,0,1,0|2,0,0]=4 7454 B10R0.75 CCCCCOC(C)C(=O)N 7a_100000210253_100000702099 [0,0,1,0,1,0|2,0,0]=4 7455 B10R0.75 CCCCCO[C@@H](C)C(=O)[O-] 7a_217856618621_100000210326 [0,0,1,0,1,0|2,0,0]=4 7456 B10R0.75 CCCCCO[C@H](C)C(=O)N 34a_100000731257_100000718602 [0,0,1,0,1,0|2,0,0]=4 7457 B10R0.75 CCCCCO[C@H](C)C(=O)N 7a_100000731257_100000210326 [0,0,1,0,1,0|2,0,0]=4 7458 B10R0.75 CCCCCSC(C)C(=O)C 62a_100000210326_100009814033 [0,0,1,0,1,0|1,0,0]=3 7459 B10R0.75 CCCCCSC(C)C(=O)C 62a_100009814033_100000210326 [0,0,1,0,1,0|1,0,0]=3 7460 B10R0.75 CCCCCSC(C)C(=O)N 62a_100000210326_100000702099 [0,0,1,0,1,0|2,0,0]=4 7461 B10R0.75 CCCCCSC(C)C(=O)N 62a_100000702099_100000210326 [0,0,1,0,1,0|2,0,0]=4 7462 B10R0.75 CCCCNCC(C)C(=O)O 269956a_100000749485_100000210211 [0,0,1,0,1,0|2,0,0]=4 7463 B10R0.75 CCCCOCC(C)C(=O)C 34a_100000032740_100000210210 [0,0,1,0,1,0|1,0,0]=3 7464 B10R0.75 CCCCOCC(C)C(=O)C 7a_100000032740_100000210211 [0,0,1,0,1,0|1,0,0]=3 7465 B10R0.75 CCOCCNC(C)C(=O)C 2230a_102516460346_100009814033 [0,0,1,0,1,0|2,0,0]=4 7466 B10R0.75 CCOCCOC(C)C(=O)C 1458a_100000743585_200000210301 [0,0,1,0,1,0|2,0,0]=4 7467 B10R0.75 CCOCCOC(C)C(=O)C 34a_100000212229_100000210147 [0,0,1,0,1,0|2,0,0]=4 7468 B10R0.75 CCOCCOC(C)C(=O)C 7a_100000210136_100000179758 [0,0,1,0,1,0|2,0,0]=4 7469 B10R0.75 CCOCCOC(C)C(=O)[13CH3] 1458a_100000743585_200025704644 [0,0,1,0,1,0|2,0,0]=4 7470 B10R0.75 CCOCCSC(C)C(=O)C 62a_100000210147_100009814033 [0,0,1,0,1,0|2,0,0]=4 7471 B10R0.75 CCOCCSC(C)C(=O)C 62a_100009814033_100011215890 [0,0,1,0,1,0|2,0,0]=4 7472 B10R0.75 CCSCCNC(C)C(=O)C 2230a_100000106463_100009814033 [0,0,1,0,1,0|2,0,0]=4 7473 B10R0.75 CCSCCOC(C)C(=O)C 34a_100000212229_100000757381 [0,0,1,0,1,0|2,0,0]=4 7474 B10R0.75 CCSCCOC(C)C(=O)C 7a_100000212035_100000179758 [0,0,1,0,1,0|2,0,0]=4 7475 B10R0.75 CCSCCSC(C)C(=O)C 62a_100000757381_100009814033 [0,0,1,0,1,0|2,0,0]=4 7476 B10R0.75 CCSCCSC(C)C(=O)C 62a_100009814033_100000757381 [0,0,1,0,1,0|2,0,0]=4 7477 B10R0.75 COCCCOC(C)C(=O)C 34a_100000212229_100000740836 [0,0,1,0,1,0|2,0,0]=4 7478 B10R0.75 COCCCSC(C)C(=O)C 62a_100000709357_100009814033 [0,0,1,0,1,0|2,0,0]=4 7479 B10R0.75 COCCCSC(C)C(=O)C 62a_100009814033_100000709357 [0,0,1,0,1,0|2,0,0]=4 7480 B10R0.75 COCCOCC(C)C(=O)C 34a_100000032740_100011201679 [0,0,1,0,1,0|2,0,0]=4 7481 B10R0.75 COCCOCC(C)C(=O)C 7a_100000032740_100000233755 [0,0,1,0,1,0|2,0,0]=4 7482 B10R0.75 CSCCCNC(C)C(=O)C 2230a_100000749238_100009814033 [0,0,1,0,1,0|2,0,0]=4 7483 B10R0.75 CSCCCOC(C)C(=O)C 7a_100000690336_100000179758 [0,0,1,0,1,0|2,0,0]=4 7484 B10R0.75 CSCCOCC(C)C(=O)C 34a_100000032740_100000212216 [0,0,1,0,1,0|2,0,0]=4 7485 B10R0.75 CSCCOCC(C)C(=O)C 7a_100000032740_100000212216 [0,0,1,0,1,0|2,0,0]=4 7486 B10R1.57 BrCCCOCC1CCO1 34a_100011217188_100000103362 [1,0,0,0,1,0|2,0,0]=4 7487 B10R1.57 CCCCCCN1CCC1 269982a_100000754969_100000210757 [1,0,0,0,1,0|1,0,1]=4 7488 B10R1.57 CCCCCNC1CCC1 2230a_100000749019_100000210326 [1,0,0,0,1,0|1,0,1]=4 7489 B10R1.57 CCCCCNC1CCC1 270004a_100000209983_100000241760 [1,0,0,0,1,0|1,0,1]=4 7490 B10R1.57 CCCCCNC1CCC1 34a_100000749019_100000718602 [1,0,0,0,1,0|1,0,1]=4 7491 B10R1.57 CCCCCOC1CCC1 34a_100000210253_100000749161 [1,0,0,0,1,0|1,0,1]=4 7492 B10R1.57 CCCCCOC1CCC1 34a_100000748187_100000718602 [1,0,0,0,1,0|1,0,1]=4 7493 B10R1.57 CCCCCSC1CCC1 62a_100000210326_100000749161 [1,0,0,0,1,0|1,0,1]=4 7494 B10R1.57 CCCCNCC1CCC1 2230a_100000102301_100000763275 [1,0,0,0,1,0|1,0,1]=4 7495 B10R1.57 CCCCNCC1CCC1 2230a_100000738700_100000210211 [1,0,0,0,1,0|1,0,1]=4 7496 B10R1.57 CCCCNCC1CCC1 269862a_100000102301_100000753134 [1,0,0,0,1,0|1,0,1]=4 7497 B10R1.57 CCCCNCC1CCC1 34a_100000738700_100000210210 [1,0,0,0,1,0|1,0,1]=4 7498 B10R1.57 CCCCNCC1CCC1 7a_106832991798_100000763275 [1,0,0,0,1,0|1,0,1]=4 7499 B10R1.57 CCCCNCC1CCO1 2230a_100000102301_100000103362 [1,0,0,0,1,0|1,0,0]=3 7500 B10R1.57 CCCCNCC1CCO1 7a_106832991798_100000103362 [1,0,0,0,1,0|1,0,0]=3 7501 B10R1.57 CCCCNC[C@@H]1CCO1 2230a_100020831831_100000210211 [1,0,0,0,1,0|1,0,0]=3 7502 B10R1.57 CCCCNC[C@@H]1CCO1 34a_100020831831_100000210210 [1,0,0,0,1,0|1,0,0]=3 7503 B10R1.57 CCCCOCC1CCC1 34a_100000210227_100000763275 [1,0,0,0,1,0|1,0,1]=4 7504 B10R1.57 CCCCOCC1CCC1 34a_100000760304_100000210210 [1,0,0,0,1,0|1,0,1]=4 7505 B10R1.57 CCCCOCC1CCC1 7a_100000210227_100000763275 [1,0,0,0,1,0|1,0,1]=4 7506 B10R1.57 CCCCOCC1CCO1 34a_100000039022_100000210210 [1,0,0,0,1,0|1,0,0]=3 7507 B10R1.57 CCCCOCC1CCO1 34a_100000210227_100000103362 [1,0,0,0,1,0|1,0,0]=3 7508 B10R1.57 CCCCOCC1CCO1 7a_100000210227_100000103362 [1,0,0,0,1,0|1,0,0]=3 7509 B10R1.57 CCCCSCC1CCC1 62a_100000210211_100000763275 [1,0,0,0,1,0|1,0,1]=4 7510 B10R1.57 CCCCSCC1CCC1 62a_100000763275_100000210210 [1,0,0,0,1,0|1,0,1]=4 7511 B10R1.57 CCCCSCC1CCO1 62a_100000103362_100000210210 [1,0,0,0,1,0|1,0,0]=3 7512 B10R1.57 CCCCSCC1CCO1 62a_100000210211_100000103362 [1,0,0,0,1,0|1,0,0]=3 7513 B10R1.57 CCOCSCC1CCO1 62a_100000103362_100000739092 [1,0,0,0,1,0|2,0,0]=4 7514 B10R1.57 CCOCSCC1CCO1 62a_100000739092_100000103362 [1,0,0,0,1,0|2,0,0]=4 7515 B10R1.57 COCCNCC1CCO1 2230a_100000209980_100000103362 [1,0,0,0,1,0|2,0,0]=4 7516 B10R1.57 COCCNC[C@@H]1CCO1 2230a_100020831831_100011201679 [1,0,0,0,1,0|2,0,0]=4 7517 B10R1.57 COCCNC[C@@H]1CCO1 34a_100020831831_100011201679 [1,0,0,0,1,0|2,0,0]=4 7518 B10R1.57 COCCOCC1CCO1 34a_100000039022_100011201679 [1,0,0,0,1,0|2,0,0]=4 7519 B10R1.57 COCCOCC1CCO1 34a_100000210237_100000103362 [1,0,0,0,1,0|2,0,0]=4 7520 B10R1.57 COCCSCC1CCO1 62a_100000103362_100000233755 [1,0,0,0,1,0|2,0,0]=4 7521 B10R1.57 COCCSCC1CCO1 62a_100000233755_100000103362 [1,0,0,0,1,0|2,0,0]=4 7522 B10R1.57 CSCCNCC1CCO1 2230a_100020590264_100000103362 [1,0,0,0,1,0|2,0,0]=4 7523 B10R1.57 CSCCNC[C@@H]1CCO1 2230a_100020831831_100000751147 [1,0,0,0,1,0|2,0,0]=4 7524 B10R1.57 CSCCNC[C@@H]1CCO1 34a_100020831831_100000212216 [1,0,0,0,1,0|2,0,0]=4 7525 B10R1.57 CSCCOCC1CCO1 34a_100000039022_100000212216 [1,0,0,0,1,0|2,0,0]=4 7526 B10R1.57 CSCCOCC1CCO1 34a_100000230434_100000103362 [1,0,0,0,1,0|2,0,0]=4 7527 B10R1.57 CSCCOCC1CCO1 7a_100000230434_100000103362 [1,0,0,0,1,0|2,0,0]=4 7528 B10R1.57 CSCCSCC1CCO1 62a_100000103362_100000751147 [1,0,0,0,1,0|2,0,0]=4 7529 B10R1.57 CSCCSCC1CCO1 62a_100000212216_100000103362 [1,0,0,0,1,0|2,0,0]=4 7530 B10R1.57 ClCCCOCC1CCO1 34a_100000230001_100000103362 [1,0,0,0,1,0|2,0,0]=4 7531 B10R1.57 FCCCNCC1CCO1 2230a_100015189416_100000103362 [1,0,0,0,1,0|2,0,0]=4 7532 B10R1.57 FCCCNCC1CCO1 34a_100015189416_100000103362 [1,0,0,0,1,0|2,0,0]=4 7533 B10R1.57 FCCCNC[C@@H]1CCO1 2230a_100020831831_100011934791 [1,0,0,0,1,0|2,0,0]=4 7534 B10R1.57 FCCCNC[C@@H]1CCO1 34a_100020831831_100011934791 [1,0,0,0,1,0|2,0,0]=4 7535 B10R1.57 FCCCOCC1CCO1 34a_100000039022_100011934791 [1,0,0,0,1,0|2,0,0]=4 7536 B10R1.57 FCCCOCC1CCO1 34a_100000759539_100000103362 [1,0,0,0,1,0|2,0,0]=4 7537 B10R1.57 FCCCSCC1CCO1 62a_100000103362_100011934791 [1,0,0,0,1,0|2,0,0]=4 7538 B10R1.57 FCCCSCC1CCO1 62a_100011934791_100000103362 [1,0,0,0,1,0|2,0,0]=4 7539 B10R1.57 NCCCOCC1CCO1 34a_100000182051_100000103362 [1,0,0,0,1,0|2,0,0]=4 7540 B10R1.57 OCCCNC[C@@H]1CCO1 2230a_100020831831_100000230001 [1,0,0,0,1,0|2,0,0]=4 7541 B10R1.57 OCCCNC[C@@H]1CCO1 34a_100020831831_100000230001 [1,0,0,0,1,0|2,0,0]=4 7542 B10R1.57 OCCCOCC1CCO1 34a_100000039022_100000230001 [1,0,0,0,1,0|2,0,0]=4 7543 B10R1.57 OCCCSCC1CCO1 62a_100000103362_100011215043 [1,0,0,0,1,0|2,0,0]=4 7544 B10R1.57 OCCCSCC1CCO1 62a_100011215043_100000103362 [1,0,0,0,1,0|2,0,0]=4 7545 B10R1.24 CCCCSC1CC(=O)C1 62a_100009894365_100000210210 [1,0,0,0,1,0|2,0,0]=4 7546 B10R1.24 CCCOCC1CC(=O)C1 34a_100000101936_100000210303 [1,0,0,0,1,0|2,0,0]=4 7547 B10R1.24 CCCSCC1CC(=O)C1 62a_100000210303_100009874392 [1,0,0,0,1,0|2,0,0]=4 7548 B10R1.24 CCCSCC1CC(=O)C1 62a_100009874392_100000210303 [1,0,0,0,1,0|2,0,0]=4 7549 B10R1.37 CCCCNC1CCC1=O 7a_106832991798_100009892977 [1,0,0,0,1,0|1,0,0]=3 7550 B10R1.37 CCCCOC1CCC1=O 34a_100000210227_100009892977 [1,0,0,0,1,0|1,0,0]=3 7551 B10R1.37 CCCCOC1CCC1=O 7a_100000210227_100009892977 [1,0,0,0,1,0|1,0,0]=3 7552 B10R1.37 CCCCSC1CCC1=O 62a_100000210211_100009892977 [1,0,0,0,1,0|1,0,0]=3 7553 B10R1.37 CCCCSC1CCC1=O 62a_100009892977_100000210210 [1,0,0,0,1,0|1,0,0]=3 7554 B10R1.37 CCNCCC1CCC1=O 2230a_100015525214_200016118888 [1,0,0,0,1,0|1,0,0]=3 7555 B10R1.37 CCOCSC1CCC1=O 62a_100000739092_100009892977 [1,0,0,0,1,0|2,0,0]=4 7556 B10R1.37 CCOCSC1CCC1=O 62a_100009892977_100000739092 [1,0,0,0,1,0|2,0,0]=4 7557 B10R1.37 CCSCCC1CCC1=O 62a_100000210202_200016118888 [1,0,0,0,1,0|1,0,0]=3 7558 B10R1.37 CCSCCC1CCC1=O 62a_200016118888_100000210202 [1,0,0,0,1,0|1,0,0]=3 7559 B10R1.37 COCCOC1CCC1=O 34a_100000210237_100009892977 [1,0,0,0,1,0|2,0,0]=4 7560 B10R1.37 COCCSC1CCC1=O 62a_100000233755_100009892977 [1,0,0,0,1,0|2,0,0]=4 7561 B10R1.37 COCCSC1CCC1=O 62a_100009892977_100000233755 [1,0,0,0,1,0|2,0,0]=4 7562 B10R1.37 CSCCOC1CCC1=O 34a_100000230434_100009892977 [1,0,0,0,1,0|2,0,0]=4 7563 B10R1.37 CSCCOC1CCC1=O 7a_100000230434_100009892977 [1,0,0,0,1,0|2,0,0]=4 7564 B10R1.37 CSCCSC1CCC1=O 62a_100000212216_100009892977 [1,0,0,0,1,0|2,0,0]=4 7565 B10R1.37 CSCCSC1CCC1=O 62a_100009892977_100000751147 [1,0,0,0,1,0|2,0,0]=4 7566 B10R1.37 NCCCOC1CCC1=O 34a_100000182051_100009892977 [1,0,0,0,1,0|2,0,0]=4 7567 B10R1.37 O=C1CCC1CCSCF 62a_100015361967_200016118888 [1,0,0,0,1,0|2,0,0]=4 7568 B10R1.37 O=C1CCC1CCSCF 62a_200016118888_100015361967 [1,0,0,0,1,0|2,0,0]=4 7569 B10R1.37 O=C1CCC1NCCCF 34a_100015189416_100009892977 [1,0,0,0,1,0|2,0,0]=4 7570 B10R1.37 O=C1CCC1OCCCBr 34a_100011217188_100009892977 [1,0,0,0,1,0|2,0,0]=4 7571 B10R1.37 O=C1CCC1OCCCCl 34a_100000230001_100009892977 [1,0,0,0,1,0|2,0,0]=4 7572 B10R1.37 O=C1CCC1OCCCF 34a_100000759539_100009892977 [1,0,0,0,1,0|2,0,0]=4 7573 B10R1.37 O=C1CCC1SCCCF 62a_100009892977_100011934791 [1,0,0,0,1,0|2,0,0]=4 7574 B10R1.37 O=C1CCC1SCCCF 62a_100011934791_100009892977 [1,0,0,0,1,0|2,0,0]=4 7575 B10R1.37 O=C1CCC1SCCCO 62a_100009892977_100011215043 [1,0,0,0,1,0|2,0,0]=4 7576 B10R1.37 O=C1CCC1SCCCO 62a_100011215043_100009892977 [1,0,0,0,1,0|2,0,0]=4 7577 B14R1.1252 CCCCCCN1CCCNC(=O)C1 2230a_100015190381_100000210314 [0,0,0,0,0,2|2,0,0]=4 7578 B14R1.1253 CCCCCCN1CCNC(=O)CC1 2230a_100000698595_100000210314 [0,0,0,0,0,2|2,0,0]=4 7579 B14R1.1253 CCCCCCN1CCNC(=O)CC1 269982a_100000698595_100000210757 [0,0,0,0,0,2|2,0,0]=4