0 B11R1.40 CC(CO)CN1CCCCC1 9070586 [0,0,0,0,0,0|3,0,0]=3 1 B11R1.40 CC(CO)CN1CCOCC1 9071254 [0,0,0,0,0,0|4,0,0]=4 2 B11R1.40 CNC(=O)CC1CCNCC1 4032563 [0,0,0,0,0,0|2,0,1]=3 3 B11R1.40 CNC(=O)CN1CCNCC1 4021296 [0,0,0,0,0,0|3,0,1]=4 4 B11R1.40 NCC(O)CN1CCCCC1 4034286 [0,0,0,0,0,0|4,0,0]=4 5 B11R1.40 NNC(=O)CC1CCCCC1 3015016 [0,0,0,0,0,0|2,0,1]=3 6 B10R1.17 C#CCNC1CCCCC1 4001806 [1,0,0,0,0,0|2,0,1]=4 7 B10R1.17 CCCNC1CCCCC1 4088015 [1,0,0,0,0,0|2,0,0]=3 8 B10R1.17 CCCNC1CCCCC1 6591639 [1,0,0,0,0,0|2,0,0]=3 9 B10R1.17 CCNCC1CCCCC1 4026987 [1,0,0,0,0,0|2,0,0]=3 10 B10R1.17 CCNCC1CCCCO1 4015227 [1,0,0,0,0,0|3,0,0]=4 11 B10R1.17 CCNCC1CCOCC1 4028333 [1,0,0,0,0,0|3,0,0]=4 12 B10R1.17 CCNCC1CCOCC1 4110621 [1,0,0,0,0,0|3,0,0]=4 13 B10R1.17 CCOCC1CCNCC1 4011221 [1,0,0,0,0,0|3,0,0]=4 14 B10R1.17 CCOCC1CCNCC1 4088861 [1,0,0,0,0,0|3,0,0]=4 15 B10R1.17 CNCCC1CCCCO1 4002170 [1,0,0,0,0,0|1,0,0]=2 16 B10R1.17 CNCCC1CCOCC1 4010744 [1,0,0,0,0,0|1,0,0]=2 17 B10R1.17 CNCCN1CCCCC1 4004408 [1,0,0,0,0,0|1,0,0]=2 18 B10R1.17 CNCCN1CCOCC1 4004409 [1,0,0,0,0,0|2,0,0]=3 19 B10R1.17 COCCC1CCCCN1 4002973 [1,0,0,0,0,0|2,0,0]=3 20 B10R1.17 COCCC1CCCCN1 4089763 [1,0,0,0,0,0|2,0,0]=3 21 B10R1.17 COCCC1CCCNC1 4018857 [1,0,0,0,0,0|2,0,0]=3 22 B10R1.17 COCCC1CCNCC1 4019402 [1,0,0,0,0,0|2,0,0]=3 23 B10R1.17 COCCC1CNCCO1 4110807 [1,0,0,0,0,0|3,0,0]=4 24 B10R1.17 CSCCN1CCNCC1 4041175 [1,0,0,0,0,0|3,0,0]=4 25 B10R1.17 NCCSC1CCCCC1 4027109 [1,0,0,0,0,0|3,0,0]=4 26 B10R1.17 OCCCC1CCCCN1 4011271 [1,0,0,0,0,0|3,0,0]=4 27 B10R1.17 OCCCC1CCCNC1 4011272 [1,0,0,0,0,0|3,0,0]=4 28 B10R1.18 CC(=O)CN1CCCCC1 4028176 [1,0,0,0,0,0|2,0,1]=4 29 B10R1.18 CC(C)CC1CNCCO1 4018982 [1,0,0,0,0,0|2,0,0]=3 30 B10R1.18 CC(C)CC1COCCN1 4021667 [1,0,0,0,0,0|2,0,0]=3 31 B10R1.18 CC(C)CC1COCCN1 4087891 [1,0,0,0,0,0|2,0,0]=3 32 B10R1.18 CC(N)CN1CCOCC1 4027661 [1,0,0,0,0,0|2,0,0]=3 33 B10R1.18 CC(O)CN1CCNCC1 4043699 [1,0,0,0,0,0|3,0,0]=4 34 B10R1.18 CN(C)CC1CCCNC1 4103001 [1,0,0,0,0,0|2,0,0]=3 35 B10R1.18 CN(C)CC1CCNCC1 4103002 [1,0,0,0,0,0|2,0,0]=3 36 B10R1.18 C[C@@H](O)CN1CCNCC1 4067255 [1,0,0,0,0,0|3,0,0]=4 37 B10R1.18 N=C(N)NC1CCCCC1 4002516 [1,0,0,0,0,0|2,0,1]=4 38 B10R1.18 NC(=O)CC1CCCCN1 4014901 [1,0,0,0,0,0|2,0,1]=4 39 B12R1.43 CC(CN1CCCCC1)C(=O)O 4027837 [0,1,0,0,0,0|3,0,0]=4 40 B12R1.43 CC(CN1CCCCC1)C(=O)O 4089412 [0,1,0,0,0,0|3,0,0]=4 41 B12R1.43 CN(C)C(=O)CC1CCNCC1 4035564 [0,1,0,0,0,0|2,0,1]=4 42 B12R1.118 COC(CN1CCNCC1)OC 4025621 [0,1,0,0,0,0|3,0,0]=4 43 B12R2.24 CN1CC[C@H]2NCCC[C@H]2C1 4070469 [0,0,0,1,0,0|3,0,0]=4 44 B12R2.94 NC1(CN2CCCCC2)CC1 4026347 [0,0,0,1,0,0|3,0,0]=4 45 B12R2.2918 CC1CC2(CCNCC2)CO1 4081991 [0,0,0,1,0,0|2,0,0]=3 46 B12R2.2918 CN1CCC2(CCNCC2)C1 4108332 [0,0,0,1,0,0|3,0,0]=4 47 B12R2.2918 NC1COC2(CCCCC2)C1 4019022 [0,0,0,1,0,0|3,0,0]=4 48 B12R2.2918 O=C1CC2(CCNCC2)CN1 4036520 [0,0,0,1,0,0|2,0,1]=4 49 B10R1.15 CC(CN)N1CCCCC1 4014558 [0,0,0,0,1,0|3,0,0]=4 50 B10R1.15 CC(CN)N1CCCCC1 4110760 [0,0,0,0,1,0|3,0,0]=4 51 B10R1.15 CC(CO)C1CCNCC1 4036094 [0,0,0,0,1,0|3,0,0]=4 52 B10R1.15 CCC(O)C1CCNCC1 4005900 [0,0,0,0,1,0|3,0,0]=4 53 B10R1.15 CNC(=O)C1CCCCN1 4041354 [0,0,0,0,1,0|2,0,1]=4 54 B10R1.15 CNC(=O)C1CCCNC1 4031837 [0,0,0,0,1,0|2,0,1]=4 55 B10R1.15 NNC(=O)C1CCCCC1 3017809 [0,0,0,0,1,0|2,0,1]=4 56 B10R1.15 NNC(=O)C1CCCCC1 4036715 [0,0,0,0,1,0|2,0,1]=4 57 B10R1.27 CC(CO)CN1CCCC1 4028327 [0,0,0,0,1,0|3,0,0]=4 58 B10R1.27 CCC(C)NC1CCCC1 5938899 [0,0,0,0,1,0|2,0,0]=3 59 B12R1.27 CNC(=O)CCC1CCCNC1 4041241 [0,0,0,0,0,1|2,0,1]=4 60 B12R1.1748 CCC(C)NC1CCCCCC1 5938728 [0,0,0,0,0,1|2,0,0]=3 61 B9R1.8 BrCCC1CCCCN1 4027974 [2,0,0,0,0,0|2,0,0]=4 62 B9R1.8 BrCCC1CCCCN1 4090143 [2,0,0,0,0,0|2,0,0]=4 63 B9R1.8 CCCC1COCCN1 4021666 [2,0,0,0,0,0|2,0,0]=4 64 B9R1.8 CCNC1CCOCC1 4087925 [2,0,0,0,0,0|2,0,0]=4 65 B9R1.8 CCOC1CCNCC1 4031332 [2,0,0,0,0,0|2,0,0]=4 66 B9R1.8 CCOC1CCNCC1 4088135 [2,0,0,0,0,0|2,0,0]=4 67 B9R1.8 CNCC1CCCCC1 4028444 [2,0,0,0,0,0|0,0,0]=2 68 B9R1.8 CNCC1CCCCO1 4003543 [2,0,0,0,0,0|1,0,0]=3 69 B9R1.8 CNCC1CCCCO1 4088030 [2,0,0,0,0,0|1,0,0]=3 70 B9R1.8 CNCC1CCOCC1 4002168 [2,0,0,0,0,0|1,0,0]=3 71 B9R1.8 CNCC1COCCO1 4101742 [2,0,0,0,0,0|2,0,0]=4 72 B9R1.8 COCC1CCCCN1 4002970 [2,0,0,0,0,0|2,0,0]=4 73 B9R1.8 COCC1CCCNC1 4002971 [2,0,0,0,0,0|2,0,0]=4 74 B9R1.8 COCC1CCNCC1 4002972 [2,0,0,0,0,0|2,0,0]=4 75 B9R1.8 CSCC1CCCNC1 4043531 [2,0,0,0,0,0|2,0,0]=4 76 B9R1.8 CSCC1CCNCC1 4043017 [2,0,0,0,0,0|2,0,0]=4 77 B9R1.8 NCCC1CC=CCC1 4004572 [2,0,0,0,0,0|0,0,2]=4 78 B9R1.8 NCCC1CCCCC1 4005014 [2,0,0,0,0,0|0,0,0]=2 79 B9R1.8 NCCC1CCCCC1 4089549 [2,0,0,0,0,0|0,0,0]=2 80 B9R1.8 NCCC1CCCCO1 4002169 [2,0,0,0,0,0|1,0,0]=3 81 B9R1.8 NCCC1CCCCO1 4085477 [2,0,0,0,0,0|1,0,0]=3 82 B9R1.8 NCCC1CCCOC1 4036334 [2,0,0,0,0,0|1,0,0]=3 83 B9R1.8 OCCC1CCCCO1 4016654 [2,0,0,0,0,0|2,0,0]=4 84 B11R1.1 CNCCN1CCC(C)CC1 4013122 [1,1,0,0,0,0|1,0,0]=3 85 B11R1.1 CSCCN1CCC(N)CC1 4041088 [1,1,0,0,0,0|2,0,0]=4 86 B11R1.16 CNCC(C)N1CCOCC1 4015737 [1,1,0,0,0,0|2,0,0]=4 87 B11R1.16 COCC(C)C1CCNCC1 4034852 [1,1,0,0,0,0|2,0,0]=4 88 B11R1.16 COCC(C)C1CCNCC1 4090483 [1,1,0,0,0,0|2,0,0]=4 89 B11R1.17 CCCN[C@@H]1CCCC[C@H]1O 4027681 [1,1,0,0,0,0|2,0,0]=4 90 B11R1.17 CNCCN1CCCCC1=O 4014130 [1,1,0,0,0,0|1,0,1]=4 91 B11R1.17 CNCCN1CCCCC1C 4015189 [1,1,0,0,0,0|1,0,0]=3 92 B11R1.24 CCCNC1CCCC(C)C1 4024919 [1,1,0,0,0,0|2,0,0]=4 93 B11R1.24 CCCNC1CCCC(C)C1 4090836 [1,1,0,0,0,0|2,0,0]=4 94 B11R1.28 CCNCCC1=CCCCC1 4088499 [1,1,0,0,0,0|0,0,2]=4 95 B11R1.28 CCNCCC1=CCCCC1 6599143 [1,1,0,0,0,0|0,0,2]=4 96 B11R1.28 CCNCCN1CCCCC1 4011015 [1,1,0,0,0,0|1,0,0]=3 97 B11R1.28 CCNCCN1CCOCC1 4011018 [1,1,0,0,0,0|2,0,0]=4 98 B11R1.28 CNCCCN1CCOCC1 4004400 [1,1,0,0,0,0|2,0,0]=4 99 B11R1.28 COCCCC1CCCCN1 4011223 [1,1,0,0,0,0|2,0,0]=4 100 B11R1.28 COCCCC1CCCNC1 4011225 [1,1,0,0,0,0|2,0,0]=4 101 B11R1.28 COCCCC1CCNCC1 4011227 [1,1,0,0,0,0|2,0,0]=4 102 B11R1.28 COCCOC1CCNCC1 4002974 [1,1,0,0,0,0|2,0,0]=4 103 B11R1.28 NCCCOC1CCCCC1 4034324 [1,1,0,0,0,0|2,0,0]=4 104 B11R1.28 OCCCCN1CCCCC1 4001152 [1,1,0,0,0,0|2,0,0]=4 105 B11R1.91 CN(C)CCC1CCCCN1 4090501 [1,1,0,0,0,0|1,0,0]=3 106 B11R1.91 CN(C)CCC1CCCCN1 4102791 [1,1,0,0,0,0|1,0,0]=3 107 B11R1.91 CN(C)CCC1CCCNC1 4102790 [1,1,0,0,0,0|1,0,0]=3 108 B11R1.91 CN(C)CCC1CCNCC1 4111084 [1,1,0,0,0,0|1,0,0]=3 109 B11R1.36 CC(C)C(O)C1CCNCC1 4005901 [1,1,0,0,0,0|1,0,0]=3 110 B11R1.36 CC(C1CCNCC1)N(C)C 4004382 [1,1,0,0,0,0|2,0,0]=4 111 B11R1.36 CC(O)C(C)N1CCCCC1 3001702 [1,1,0,0,0,0|2,0,0]=4 112 B11R1.86 CN(C)C[C@@H]1CCNC[C@H]1O 4042200 [1,1,0,0,0,0|2,0,0]=4 113 B11R1.509 CC(C)(N)CN1CCOCC1 4014540 [1,1,0,0,0,0|2,0,0]=4 114 B11R1.928 CN(C)CC1(O)CCCNC1 4037408 [1,1,0,0,0,0|2,0,0]=4 115 B11R1.928 CN(C)CC1(O)CCNCC1 4030681 [1,1,0,0,0,0|2,0,0]=4 116 B11R1.12 CCC(CN)N1CCCCC1 4027496 [0,1,0,0,1,0|2,0,0]=4 117 B11R1.878 CNC(=O)C1(N)CCCCC1 4043318 [0,1,0,0,1,0|1,0,1]=4 118 B11R1.30 CNCC(C)CN1CCCC1 4002508 [0,1,0,0,1,0|1,0,0]=3 119 B13R1.42 CCCC(C)NCC1CCCCC1 4024867 [0,1,0,0,0,1|1,0,0]=3 120 B13R1.42 CCCC(C)NCC1CCCCC1 4089342 [0,1,0,0,0,1|1,0,0]=3 121 B13R1.1001 CCC(CC)NC1CCCCCC1 5937373 [0,1,0,0,0,1|2,0,0]=4 122 B11R2.13 NCC1CC12CCCCC2 4087758 [1,0,0,1,0,0|2,0,0]=4 123 B11R2.20 C1CN2CCOCC2CN1 4085103 [1,0,0,1,0,0|2,0,0]=4 124 B11R2.238 C1CCC(NC2CC2)CC1 4026926 [1,0,0,1,0,0|2,0,0]=4 125 B11R2.238 C1CCC(NC2CC2)CC1 4090982 [1,0,0,1,0,0|2,0,0]=4 126 B11R2.239 C1CCN(C2CNC2)CC1 4026694 [1,0,0,1,0,0|1,0,0]=3 127 B11R2.239 C1CN(C2CNC2)CCO1 4026697 [1,0,0,1,0,0|2,0,0]=4 128 B11R2.239 C1CN(C2CNC2)CCO1 4087898 [1,0,0,1,0,0|2,0,0]=4 129 B11R2.678 O[C@@H]1C[C@@H]2CCC[C@H](C1)N2 4054117 [1,0,0,1,0,0|2,0,0]=4 130 B11R2.678 O[C@H]1C[C@@H]2CCC[C@H](C1)N2 4083010 [1,0,0,1,0,0|2,0,0]=4 131 B11R2.703 O=C1CC2(CCCCC2)C1 4040200 [1,0,0,1,0,0|1,0,1]=4 132 B11R2.40 NC1(C2CCCCC2)CC1 4028770 [0,0,0,1,1,0|2,0,0]=4 133 B11R2.16 CO[C@@H]1C[C@@H]2CC[C@H](C1)N2 4031884 [0,0,0,1,1,0|2,0,0]=4 134 B11R2.16 [C@H]12CC[C@H](C[C@@H](OC)C1)N2 4048390 [0,0,0,1,1,0|2,0,0]=4 135 B11R2.36 C[C@@H]1CN2CCC[C@@H]2CN1 4082083 [0,0,0,1,1,0|1,0,0]=3 136 B11R2.36 C[C@@H]1CN2CCC[C@H]2CN1 4065495 [0,0,0,1,1,0|1,0,0]=3 137 B13R2.10 O=C1CC(C2CCCCC2)CN1 4079486 [0,0,0,1,0,1|1,0,1]=4 138 B13R2.6482 COC1COC2(CCNCC2)C1 4045451 [0,0,0,1,0,1|2,0,0]=4 139 B13R2.13132 O=C1CC2(CCCCCC2)CN1 4026752 [0,0,0,1,0,1|1,0,1]=4 140 B13R2.13132 O=C1CC2(CCCNCC2)CN1 4110785 [0,0,0,1,0,1|1,0,1]=4 141 B13R2.15 O[C@H]1CNC[C@@H]1N2CCCCC2 4032267 [0,1,0,1,0,0|2,0,0]=4 142 B13R2.64 C1CCC(NC2CCCC2)CC1 4090051 [0,1,0,1,0,0|2,0,0]=4 143 B13R2.64 C1CCC(NC2CCCC2)CC1 5945699 [0,1,0,1,0,0|2,0,0]=4 144 B13R2.5120 NC1CCC2(CC1)CNC(=O)C2 4079888 [0,1,0,1,0,0|1,0,1]=4 145 B13R2.5120 NC1CCC2(CC1)CNC(=O)C2 4110777 [0,1,0,1,0,0|1,0,1]=4 146 B13R3.1921 C1NC2CC3CC1CC(C3)C2 4003084 [0,0,0,2,0,0|0,0,0]=2 147 B13R3.1921 C1NC2CC3CC1CC(C3)C2 4088352 [0,0,0,2,0,0|0,0,0]=2 148 B9R1.12 CCCNC1CCCC1 4024874 [1,0,0,0,1,0|2,0,0]=4 149 B9R1.12 CNCCN1CCCC1 4004410 [1,0,0,0,1,0|1,0,0]=3 150 B9R1.12 NCCCC1CCCC1 4012706 [1,0,0,0,1,0|2,0,0]=4 151 B9R1.12 O=CCCC1CCCC1 4012707 [1,0,0,0,1,0|2,0,0]=4 152 B9R1.6 CC(C)C1CCCNC1 4016074 [1,0,0,0,1,0|1,0,0]=3 153 B9R1.6 CC(C)C1CCNCC1 4016223 [1,0,0,0,1,0|1,0,0]=3 154 B9R1.6 CC(C)C1CNCCO1 4053190 [1,0,0,0,1,0|2,0,0]=4 155 B9R1.6 CC(N)C1=CCCCC1 4019757 [1,0,0,0,1,0|0,0,2]=4 156 B9R1.6 CC(N)C1CCCCC1 4019758 [1,0,0,0,1,0|0,0,0]=2 157 B9R1.6 CC(N)C1CCCCC1 4087887 [1,0,0,0,1,0|0,0,0]=2 158 B9R1.6 CC(O)C1CCNCC1 4027058 [1,0,0,0,1,0|2,0,0]=4 159 B9R1.6 CN(C)C1CCCNC1 4018212 [1,0,0,0,1,0|2,0,0]=4 160 B9R1.6 CN(C)C1CCNCC1 4018153 [1,0,0,0,1,0|2,0,0]=4 161 B9R1.13 CC(C)CC1CCNC1 4018759 [1,0,0,0,1,0|1,0,0]=3 162 B9R1.13 CC(N)CN1CCCC1 4011425 [1,0,0,0,1,0|1,0,0]=3 163 B9R1.13 CN(C)CC1CCNC1 4013846 [1,0,0,0,1,0|2,0,0]=4 164 B11R1.203 CCCNC1CCCCCC1 4024903 [1,0,0,0,0,1|2,0,0]=4 165 B11R1.203 CCCNC1CCCCCC1 4090816 [1,0,0,0,0,1|2,0,0]=4 166 B11R1.203 CNCCN1CCCCCC1 4010632 [1,0,0,0,0,1|1,0,0]=3 167 B11R1.203 CNCCN1CCCCCC1 4089714 [1,0,0,0,0,1|1,0,0]=3 168 B11R1.742 CC(C)CN1CCCNCC1 4015231 [1,0,0,0,0,1|1,0,0]=3 169 B11R1.742 CC(C)CN1CCCNCC1 4089474 [1,0,0,0,0,1|1,0,0]=3 170 B11R1.742 CC(C)NC1CCCCCC1 4088756 [1,0,0,0,0,1|1,0,0]=3 171 B11R1.742 CC(C)NC1CCCCCC1 5937172 [1,0,0,0,0,1|1,0,0]=3 172 B11R1.742 CN(C)CC1CNCCOC1 4038977 [1,0,0,0,0,1|2,0,0]=4