0 B9R0.2 COCCCCCC(=O)O 4021515 [1,0,0,0,0,0|1,0,0]=2 1 B11R1.53 CCN1CCCCC1C(=O)O 4002075 [0,0,0,1,0,0|1,0,0]=2 2 B11R1.86 CC(=O)CN1CCCCC1C 4028609 [0,0,0,1,0,0|2,0,0]=3 3 B11R1.86 CC1CCCCN1CC(=O)O 4017722 [0,0,0,1,0,0|1,0,0]=2 4 B11R1.86 O=C(O)CN1CCCCC1=O 4010683 [0,0,0,1,0,0|2,0,1]=4 5 B11R1.90 O=C(O)CCC1CCOC1=O 4034163 [0,0,0,1,0,0|2,0,1]=4 6 B11R1.90 O=C(O)CCN1CCCC1=O 4002563 [0,0,0,1,0,0|2,0,1]=4 7 B11R1.91 CC(=O)NCC1CCCNC1 4011177 [0,0,0,1,0,0|3,0,0]=4 8 B11R1.91 CC(=O)NCC1CCNCC1 4011179 [0,0,0,1,0,0|3,0,0]=4 9 B11R1.91 CC(=O)NCC1CCNCC1 4091059 [0,0,0,1,0,0|3,0,0]=4 10 B11R1.91 NC(=O)CCC1CCCNC1 4017498 [0,0,0,1,0,0|2,0,0]=3 11 B11R1.91 NC(=O)CCC1CCNCC1 4017497 [0,0,0,1,0,0|2,0,0]=3 12 B11R1.91 NC(=O)CCN1CCNCC1 4003504 [0,0,0,1,0,0|3,0,0]=4 13 B11R1.91 O=C(O)CCC1CCCCN1 4028109 [0,0,0,1,0,0|1,0,0]=2 14 B11R1.91 O=C(O)CCC1CCCNC1 4026834 [0,0,0,1,0,0|1,0,0]=2 15 B11R1.91 O=C(O)CCC1CCNCC1 4031110 [0,0,0,1,0,0|1,0,0]=2 16 B11R1.91 O=C(O)CCN1CCCCO1 4013266 [0,0,0,1,0,0|2,0,0]=3 17 B11R1.91 O=C(O)CCN1CCCCO1 4089631 [0,0,0,1,0,0|2,0,0]=3 18 B11R1.91 O=C(O)CCN1CCOCC1 4010141 [0,0,0,1,0,0|2,0,0]=3 19 B11R1.91 O=C(O)CNC1=NCCCC1 4039943 [0,0,0,1,0,0|2,0,1]=4 20 B11R1.91 O=C(O)COC1CCNCC1 4041091 [0,0,0,1,0,0|2,0,0]=3 21 B11R1.91 O=C(O)COC1CCNCC1 4090600 [0,0,0,1,0,0|2,0,0]=3 22 B11R1.143 CN1CCCCCC1C(=O)O 4090593 [0,0,0,1,0,0|1,0,0]=2 23 B11R1.143 CN1CCCCCC1C(=O)O 4400179 [0,0,0,1,0,0|1,0,0]=2 24 B11R1.172 O=C(O)CCCN1CCCC1 4018163 [0,0,0,1,0,0|1,0,0]=2 25 B11R1.172 O=C(O)COCC1CCCN1 4040700 [0,0,0,1,0,0|2,0,0]=3 26 B11R1.172 O=C(O)COCC1CCCN1 4090188 [0,0,0,1,0,0|2,0,0]=3 27 B11R1.172 O=C(O)COCC1CCCO1 4011117 [0,0,0,1,0,0|2,0,0]=3 28 B11R1.193 C=CCN1CCC[C@H]1C(=O)O 4045601 [0,0,0,1,0,0|1,0,2]=4 29 B11R1.742 CC(=O)CN1CCCCCC1 4027910 [0,0,0,1,0,0|2,0,0]=3 30 B11R1.742 CC(=O)CN1CCCCCC1 4090136 [0,0,0,1,0,0|2,0,0]=3 31 B11R1.742 O=C(O)CN1CCCCCC1 4013117 [0,0,0,1,0,0|1,0,0]=2 32 B8R0.7 C\C=C\CCCC(=O)O 4074621 [2,0,0,0,0,0|0,0,2]=4 33 B10R0.78 COCCN(C)CCC(=O)O 4017707 [1,1,0,0,0,0|2,0,0]=4 34 B10R1.18 CC(=O)CN1CCCCC1 4028176 [1,0,0,1,0,0|2,0,0]=4 35 B10R1.18 NC(=O)CC1CCCCN1 4014901 [1,0,0,1,0,0|2,0,0]=4 36 B10R1.18 O=C(O)CC1CCCCN1 4088025 [1,0,0,1,0,0|1,0,0]=3 37 B10R1.18 O=C(O)CC1CCCCN1 4142131 [1,0,0,1,0,0|1,0,0]=3 38 B10R1.18 O=C(O)CC1CCCOC1 4004917 [1,0,0,1,0,0|1,0,0]=3 39 B10R1.18 O=C(O)CC1CCNCC1 4091105 [1,0,0,1,0,0|1,0,0]=3 40 B10R1.18 O=C(O)CC1CCNCC1 4142132 [1,0,0,1,0,0|1,0,0]=3 41 B10R1.18 O=C(O)CC1CNCCO1 4029903 [1,0,0,1,0,0|2,0,0]=4 42 B10R1.18 O=C(O)CN1CCCCC1 4088006 [1,0,0,1,0,0|1,0,0]=3 43 B10R1.18 O=C(O)CN1CCCCC1 4401702 [1,0,0,1,0,0|1,0,0]=3 44 B10R1.18 O=C(O)CN1CCOCC1 4089205 [1,0,0,1,0,0|2,0,0]=4 45 B10R1.18 O=C(O)CN1CCOCC1 4401712 [1,0,0,1,0,0|2,0,0]=4 46 B10R1.39 CCN1CCC[C@H]1C(=O)O 4044757 [1,0,0,1,0,0|1,0,0]=3 47 B10R1.61 CN1CCCCC1C(=O)O 4400178 [1,0,0,1,0,0|1,0,0]=3 48 B10R1.61 CN1CCNCC1C(=O)O 4142105 [1,0,0,1,0,0|2,0,0]=4 49 B10R1.61 CN1CCOC[C@@H]1C(=O)O 4037824 [1,0,0,1,0,0|2,0,0]=4 50 B10R1.61 CN1CCOC[C@H]1C(=O)O 4038718 [1,0,0,1,0,0|2,0,0]=4 51 B10R1.64 CN1CCCC1CC(=O)O 4004857 [1,0,0,1,0,0|1,0,0]=3 52 B10R1.66 O=C(O)CCC1CCCO1 4027244 [1,0,0,1,0,0|1,0,0]=3 53 B10R1.66 O=C(O)CCN1CCCC1 4017740 [1,0,0,1,0,0|1,0,0]=3 54 B10R1.66 O=C(O)CCN1CCCO1 4013267 [1,0,0,1,0,0|2,0,0]=4 55 B10R1.144 CCCCC1CC1C(=O)O 6156098 [1,0,0,1,0,0|0,0,0]=2 56 B10R1.348 NC(=O)C1CCCCNC1 4044747 [1,0,0,1,0,0|2,0,0]=4 57 B10R1.4 CCN[C@@H]1CCCC[C@H]1O 4028008 [1,0,0,1,0,0|1,0,1]=4 58 B10R1.4 NCCN1CCCCC1=O 4014128 [1,0,0,1,0,0|2,0,0]=4 59 B10R1.7 N[C@H]1CCCCCC[C@@H]1O 4110432 [1,0,0,1,0,0|1,0,1]=4 60 B10R1.17 CCNCC1CCCCO1 4015227 [1,0,0,1,0,0|1,0,1]=4 61 B10R1.17 CNCCC1CCCCO1 4002170 [1,0,0,1,0,0|1,0,1]=4 62 B10R1.17 OCCCC1CCCCN1 4011271 [1,0,0,1,0,0|1,0,1]=4 63 B10R1.17 OCCCC1CCCNC1 4011272 [1,0,0,1,0,0|1,0,1]=4 64 B10R1.20 CCN1CCCCC1CO 4027255 [1,0,0,1,0,0|1,0,1]=4 65 B10R1.21 CCCNCC1CCCO1 4000752 [1,0,0,1,0,0|1,0,1]=4 66 B10R1.21 CNCCCC1CCCC1 4012701 [1,0,0,1,0,0|2,0,0]=4 67 B10R1.21 CNCCCC1CCCO1 4018237 [1,0,0,1,0,0|1,0,1]=4 68 B10R1.21 NCCCCC1CCCO1 4018236 [1,0,0,1,0,0|1,0,1]=4 69 B10R1.21 NCCCCC1CCCO1 4090493 [1,0,0,1,0,0|1,0,1]=4 70 B10R1.21 OCCCCN1CCCC1 4001160 [1,0,0,1,0,0|1,0,1]=4 71 B10R1.85 NCCC1CCCCCC1 4015076 [1,0,0,1,0,0|1,0,1]=4 72 B12R1.107 CC(CC(=O)O)N1CCCCC1 4028216 [0,1,0,1,0,0|1,0,0]=3 73 B12R1.107 CC(CC(=O)O)N1CCOCC1 4028513 [0,1,0,1,0,0|2,0,0]=4 74 B12R1.107 CN(CC(=O)O)C1CCNCC1 4041504 [0,1,0,1,0,0|2,0,0]=4 75 B12R1.226 CC1CCCN(CCC(=O)O)C1 4017724 [0,1,0,1,0,0|1,0,0]=3 76 B12R1.226 CN1CCCC(CCC(=O)O)C1 4017495 [0,1,0,1,0,0|1,0,0]=3 77 B12R1.261 CC(=O)N1CCCCC1C(=O)O 4027863 [0,1,0,1,0,0|1,0,1]=4 78 B12R1.27 CNC(=O)CCC1CCCNC1 4041241 [0,1,0,1,0,0|2,0,0]=4 79 B12R1.27 COC(=O)CCC1CCCCN1 4017493 [0,1,0,1,0,0|1,0,0]=3 80 B12R1.27 COC(=O)CCC1CCCNC1 4017491 [0,1,0,1,0,0|1,0,0]=3 81 B12R1.27 COC(=O)CCC1CCNCC1 4017492 [0,1,0,1,0,0|1,0,0]=3 82 B12R1.27 COC(=O)CCN1CCNCC1 4023721 [0,1,0,1,0,0|2,0,0]=4 83 B12R1.27 O=C(CCl)NCC1CCCCC1 9071028 [0,1,0,1,0,0|2,0,0]=4 84 B12R1.365 COC(=O)C1CNCCCN1C 4042496 [0,1,0,1,0,0|2,0,0]=4 85 B12R1.1748 O=C(CCl)NC1CCCCCC1 5704895 [0,1,0,1,0,0|2,0,0]=4 86 B12R1.43 CC(CN1CCCCC1)C(=O)O 4027837 [0,1,0,1,0,0|1,0,0]=3 87 B12R1.43 CC(CN1CCCCC1)C(=O)O 4089412 [0,1,0,1,0,0|1,0,0]=3 88 B12R1.43 O=C(O)C(=O)NC1CCCCC1 4028729 [0,1,0,1,0,0|1,0,1]=4 89 B12R1.124 CC1CCCCN1C(=O)C(=O)O 4028356 [0,1,0,1,0,0|1,0,1]=4 90 B12R1.124 CC1CCCCN1C(C)C(=O)O 4023698 [0,1,0,1,0,0|1,0,0]=3 91 B12R1.279 O=C(O)C1CCCN(CCO)C1 4033935 [0,1,0,1,0,0|2,0,0]=4 92 B12R1.337 COCCN1CCC(C(=O)O)C1 4016124 [0,1,0,1,0,0|2,0,0]=4 93 B12R1.2197 CC(C(=O)O)N1CCCCCC1 4017708 [0,1,0,1,0,0|1,0,0]=3 94 B12R1.2197 CC(C(=O)O)N1CCCCCC1 4090479 [0,1,0,1,0,0|1,0,0]=3 95 B12R1.2197 O=C(O)C(=O)N1CCCCCC1 4028063 [0,1,0,1,0,0|1,0,1]=4 96 B12R1.1343 O=C(O)CNC1CCCCCC1 4028659 [0,1,0,1,0,0|0,0,0]=2 97 B12R1.21 CN1CCC(CCC(=O)O)CC1 4017496 [0,1,0,1,0,0|1,0,0]=3 98 B12R1.21 CN1CCC(NCC(=O)O)CC1 4006135 [0,1,0,1,0,0|2,0,0]=4 99 B12R1.21 CN1CCC(NCC(=O)O)CC1 4089062 [0,1,0,1,0,0|2,0,0]=4 100 B12R1.21 CN1CCN(CCC(=O)O)CC1 4010145 [0,1,0,1,0,0|2,0,0]=4 101 B12R1.368 CCC(=O)N1CCC[C@H]1C(=O)O 4045596 [0,1,0,1,0,0|1,0,1]=4 102 B12R1.1020 CN1CCCN(CC(=O)O)CC1 4014830 [0,1,0,1,0,0|2,0,0]=4 103 B12R1.125 CN1CCCCC1CCC(=O)O 4017494 [0,1,0,1,0,0|0,0,0]=2 104 B12R1.125 CN1CCCCC1CCC(=O)O 4090826 [0,1,0,1,0,0|0,0,0]=2 105 B12R1.125 O=C(O)CCN1CCCCC1=O 4002564 [0,1,0,1,0,0|1,0,1]=4 106 B12R1.252 CC(=O)NCCC1CCCCN1 4011180 [0,1,0,1,0,0|2,0,0]=4 107 B12R1.252 CC(=O)NCCC1CCNCC1 4011182 [0,1,0,1,0,0|2,0,0]=4 108 B12R1.252 O=C(O)CCCN1CCCCC1 4018160 [0,1,0,1,0,0|0,0,0]=2 109 B12R1.252 O=C(O)CCCN1CCOCC1 4018164 [0,1,0,1,0,0|1,0,0]=3 110 B12R1.252 O=C(O)COCC1CCCCO1 4011114 [0,1,0,1,0,0|1,0,0]=3 111 B12R1.75 CCC1CCCCN1CC(=O)O 4005762 [0,1,0,1,0,0|0,0,0]=2 112 B12R1.130 O=C(O)CCCN1CCCC1=O 4010425 [0,1,0,1,0,0|1,0,1]=4 113 B12R1.255 O=C(O)CSCCN1CCCC1 4022496 [0,1,0,1,0,0|1,0,0]=3 114 B12R1.255 O=C(O)CSCCN1CCCC1 4089565 [0,1,0,1,0,0|1,0,0]=3 115 B12R2.6 O=C1CCC(C2CCCC2)C1 5100805 [0,0,0,2,0,0|1,0,0]=3 116 B12R2.2918 O=C1NCC2(CCCNC2)O1 4037862 [0,0,0,2,0,0|2,0,0]=4 117 B12R2.2918 O=C1NCC2(CCNCC2)O1 4037223 [0,0,0,2,0,0|2,0,0]=4 118 B12R2.2918 O=C1OCC2(CCNCC2)O1 4038096 [0,0,0,2,0,0|2,0,0]=4 119 B12R2.1392 O=C(O)C1CC2CCN1CC2 4037119 [0,0,0,2,0,0|1,0,0]=3 120 B12R2.1362 O=C(O)[C@H]1CC[C@@H]2CCC[C@@H]21 4037916 [0,0,0,2,0,0|0,0,0]=2 121 B12R2.1017 O=C(O)[C@@H]1C[C@H]2O[C@@H]1C[C@@H]2O 4108219 [0,0,0,2,0,0|2,0,0]=4 122 B12R2.250 O=C(O)C1CC12CCCCC2 4002212 [0,0,0,2,0,0|0,0,0]=2 123 B12R2.1019 [C@H]12CCC[C@H](CNC1)C(=O)N2 4044177 [0,0,0,2,0,0|2,0,0]=4