0 B10R0.4 CCCCCCCCB(O)O Q66526 [0,0,0,0,0,0|3,0,1]=4 1 B10R0.4 NCCCCCCCC(=O)O P43125 [0,0,0,0,0,0|3,0,0]=3 2 B9R0.2 CCCCCCCB(O)O N24230 [1,0,0,0,0,0|2,0,1]=4 3 B9R0.2 CNCCCCCC(=O)O P42203 [1,0,0,0,0,0|2,0,0]=3 4 B9R0.2 COCCOCCC(=O)O P41094 [1,0,0,0,0,0|3,0,0]=4 5 B9R0.2 O=C(O)CCCCCCBr P38930 [1,0,0,0,0,0|2,0,0]=3 6 B11R0.40 COC(=O)CCCCCCCN P36122 [0,1,0,0,0,0|2,0,0]=3 7 B11R0.42 CCCCCCCC(N)C(=O)O P37523 [0,1,0,0,0,0|2,0,0]=3 8 B11R0.42 CCCCCCC[C@H](N)C(=O)O P41641 [0,1,0,0,0,0|2,0,0]=3 9 B11R1.53 CCC1CNCCC1C(N)=O Q65274 [0,0,0,1,0,0|3,0,0]=4 10 B11R1.57 CCN1CCCC1CC(=O)O Q59220 [0,0,0,1,0,0|3,0,0]=4 11 B11R1.86 CC(C)OC1CCCCC1N P49135 [0,0,0,1,0,0|2,0,1]=4 12 B11R1.86 CC(C)O[C@@H]1CCCC[C@@H]1N P45278 [0,0,0,1,0,0|2,0,1]=4 13 B11R1.86 CC(C)O[C@H]1CCCC[C@H]1N P45209 [0,0,0,1,0,0|2,0,1]=4 14 B11R1.86 CN1CCCCC1CC(=O)O Q60600 [0,0,0,1,0,0|3,0,0]=4 15 B11R1.86 O=C(O)C[C@@H]1CCCC[C@H]1O P45493 [0,0,0,1,0,0|3,0,0]=4 16 B11R1.90 CN1CCCC1CCC(=O)O Q60694 [0,0,0,1,0,0|3,0,0]=4 17 B11R1.91 CC(=O)NCC1CCNCC1 Q53352 [0,0,0,1,0,0|2,0,0]=3 18 B11R1.91 CC(=O)NCC1COCCN1 L20323 [0,0,0,1,0,0|3,0,0]=4 19 B11R1.91 CC(=O)NCC1COCCN1 L20324 [0,0,0,1,0,0|3,0,0]=4 20 B11R1.91 NC(=O)NCC1CCCCN1 Q60027 [0,0,0,1,0,0|3,0,0]=4 21 B11R1.91 NC(=O)NCC1CCNCC1 Q60028 [0,0,0,1,0,0|3,0,0]=4 22 B11R1.91 NC(=O)NCC1CCNCC1 Q60029 [0,0,0,1,0,0|3,0,0]=4 23 B11R1.91 O=C(Cl)OCC1CCOCC1 L19743 [0,0,0,1,0,0|2,0,0]=3 24 B11R1.91 O=C(O)CCC1CCCCN1 S72480 [0,0,0,1,0,0|3,0,0]=4 25 B11R1.91 O=C(O)CCC1CCCOC1 Q57648 [0,0,0,1,0,0|3,0,0]=4 26 B11R1.91 O=C(O)CCC1CCNCC1 P37756 [0,0,0,1,0,0|3,0,0]=4 27 B11R1.91 O=C(O)CCC1CCOCC1 Q52716 [0,0,0,1,0,0|3,0,0]=4 28 B11R1.91 O=C(O)COC1CCCCC1 P36437 [0,0,0,1,0,0|3,0,0]=4 29 B11R1.91 O=C(O)\C=C\C1CCCCC1 O30307 [0,0,0,1,0,0|2,0,1]=4 30 B11R1.172 O=C(O)CCCN1CCCC1 P35755 [0,0,0,1,0,0|3,0,0]=4 31 B11R1.271 CC(=O)OC[C@@H]1CC[C@H]1C=O P50727 [0,0,0,1,0,0|1,0,1]=3 32 B11R1.271 CC(=O)OC[C@@H]1CC[C@H]1CO L21662 [0,0,0,1,0,0|1,0,0]=2 33 B11R1.271 CC(=O)OC[C@@H]1CC[C@H]1CO Q56177 [0,0,0,1,0,0|1,0,0]=2 34 B11R1.742 O=C(O)CC1CCCCCC1 P38069 [0,0,0,1,0,0|2,0,0]=3 35 B8R0.7 CNCCCCC(=O)O P35932 [2,0,0,0,0,0|2,0,0]=4 36 B8R0.7 CNCCCNC(C)=O P37409 [2,0,0,0,0,0|2,0,0]=4 37 B10R0.3 CCOC(=O)CCCC(C)=O K13405 [1,1,0,0,0,0|1,0,1]=4 38 B10R0.74 COC(=O)CCCCCCBr P37550 [1,1,0,0,0,0|1,0,0]=3 39 B10R0.74 COC(=O)CCCCCCN P40404 [1,1,0,0,0,0|1,0,0]=3 40 B10R0.75 CCCCCC[C@@H](N)C(=O)O P42769 [1,1,0,0,0,0|1,0,0]=3 41 B10R0.75 CCCCCC[C@H](N)C(=O)O P42483 [1,1,0,0,0,0|1,0,0]=3 42 B12R0.1 CCOC(=O)CCCCCCNC Q65869 [0,2,0,0,0,0|2,0,0]=4 43 B12R0.248 COC(=O)CCCCCCCCBr P36645 [0,2,0,0,0,0|1,0,0]=3 44 B12R0.251 CCCCCCCCC(N)C(=O)O P40474 [0,2,0,0,0,0|2,0,0]=4 45 B12R0.251 CCCCCCCC[C@@H](N)C(=O)O P35862 [0,2,0,0,0,0|2,0,0]=4 46 B12R0.251 CCCCCCCC[C@H](N)C(=O)O P35861 [0,2,0,0,0,0|2,0,0]=4 47 B10R1.10 CCCC1CC(=O)CCO1 Q57712 [1,0,0,1,0,0|1,0,0]=3 48 B10R1.16 COCCN1CCC(=O)C1 Q59377 [1,0,0,1,0,0|2,0,0]=4 49 B10R1.18 CC(=O)CC1CCOCC1 Q57610 [1,0,0,1,0,0|1,0,0]=3 50 B10R1.18 CC(=O)OC1CCNCC1 S72675 [1,0,0,1,0,0|1,0,0]=3 51 B10R1.18 NC(=O)CC1CCCCO1 Q57816 [1,0,0,1,0,0|2,0,0]=4 52 B10R1.18 O=C(Cl)CC1CCOCC1 O31670 [1,0,0,1,0,0|2,0,0]=4 53 B10R1.18 O=C(O)CC1CCCCN1 P40091 [1,0,0,1,0,0|2,0,0]=4 54 B10R1.18 O=C(O)CC1CCCNC1 G-6774 [1,0,0,1,0,0|2,0,0]=4 55 B10R1.18 O=C(O)CC1CCNCC1 G-6012 [1,0,0,1,0,0|2,0,0]=4 56 B10R1.18 O=C(O)CC1CCOCC1 C-3268 [1,0,0,1,0,0|2,0,0]=4 57 B10R1.18 O=C(O)CC1CCSCC1 Q56854 [1,0,0,1,0,0|2,0,0]=4 58 B10R1.18 O=C(O)CN1CCCCC1 10063 [1,0,0,1,0,0|2,0,0]=4 59 B10R1.39 CC(=O)N1CCCC1CN Q59396 [1,0,0,1,0,0|2,0,0]=4 60 B10R1.39 CC(=O)N1CCCC1CN Q59397 [1,0,0,1,0,0|2,0,0]=4 61 B10R1.39 CC[C@H]1CNC[C@H]1C(=O)O Q53013 [1,0,0,1,0,0|2,0,0]=4 62 B10R1.39 CO[C@@H]1CCC[C@@H]1C(=O)O Q63428 [1,0,0,1,0,0|2,0,0]=4 63 B10R1.39 CO[C@@H]1CCC[C@H]1C(=O)O Q63430 [1,0,0,1,0,0|2,0,0]=4 64 B10R1.39 CO[C@H]1CCC[C@@H]1C(=O)O Q63431 [1,0,0,1,0,0|2,0,0]=4 65 B10R1.39 CO[C@H]1CCC[C@H]1C(=O)O Q63429 [1,0,0,1,0,0|2,0,0]=4 66 B10R1.39 O=C(O)C1CCCC1CF Q57285 [1,0,0,1,0,0|2,0,0]=4 67 B10R1.61 CC(=O)C1CCCCC1=O P44674 [1,0,0,1,0,0|1,0,1]=4 68 B10R1.61 CC(=O)C1CCCCC1F Q53666 [1,0,0,1,0,0|1,0,0]=3 69 B10R1.61 CN1CCCC[C@@H]1C(=O)O P51590 [1,0,0,1,0,0|2,0,0]=4 70 B10R1.61 CN1CCCC[C@H]1C(=O)O Q65384 [1,0,0,1,0,0|2,0,0]=4 71 B10R1.61 NC1CCCCC1C(=O)O P44627 [1,0,0,1,0,0|2,0,0]=4 72 B10R1.61 N[C@@H]1CCCC[C@@H]1C(=O)O O34530 [1,0,0,1,0,0|2,0,0]=4 73 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O P44580 [1,0,0,1,0,0|2,0,0]=4 74 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O P51569 [1,0,0,1,0,0|2,0,0]=4 75 B10R1.61 N[C@H]1CCCC[C@@H]1C(=O)O P45461 [1,0,0,1,0,0|2,0,0]=4 76 B10R1.61 N[C@H]1CCCC[C@@H]1C(=O)O Q70134 [1,0,0,1,0,0|2,0,0]=4 77 B10R1.61 N[C@H]1CCCC[C@H]1C(=O)O O34271 [1,0,0,1,0,0|2,0,0]=4 78 B10R1.61 N[C@H]1CCCC[C@H]1C(=O)O O34544 [1,0,0,1,0,0|2,0,0]=4 79 B10R1.61 O=C(O)C1CCCCC1O P45410 [1,0,0,1,0,0|2,0,0]=4 80 B10R1.64 CC(=O)O[C@@H]1CCC[C@H]1O Q62825 [1,0,0,1,0,0|1,0,0]=3 81 B10R1.64 CC1CCCC1CC(=O)O O29673 [1,0,0,1,0,0|1,0,0]=3 82 B10R1.64 CN1CCCC1CC(=O)O Q66259 [1,0,0,1,0,0|2,0,0]=4 83 B10R1.66 CC(=O)CCC1CCCC1 Q59160 [1,0,0,1,0,0|0,0,0]=2 84 B10R1.66 O=C(O)CCC1CCNC1 P35779 [1,0,0,1,0,0|2,0,0]=4 85 B10R1.66 O=C(O)CCN1CCCC1 10113 [1,0,0,1,0,0|2,0,0]=4 86 B10R1.66 O=C(O)CCN1CCCC1 P41136 [1,0,0,1,0,0|2,0,0]=4 87 B10R1.66 O=C(O)CC[C@H]1CCCN1 Q59292 [1,0,0,1,0,0|2,0,0]=4 88 B10R1.66 O=C(O)COC1CCCC1 P34810 [1,0,0,1,0,0|2,0,0]=4 89 B10R1.86 CCCN1CCC1C(=O)O P48974 [1,0,0,1,0,0|2,0,0]=4 90 B10R1.86 CCCN1CC[C@H]1C(=O)O L14234 [1,0,0,1,0,0|2,0,0]=4 91 B10R1.127 O=C(O)CCCC1CCC1 P45608 [1,0,0,1,0,0|1,0,0]=3 92 B10R1.348 O=C(O)C1CCCNCC1 C-2768 [1,0,0,1,0,0|2,0,0]=4 93 B10R1.348 O=C(O)[C@@H]1CCCCCN1 Q62626 [1,0,0,1,0,0|2,0,0]=4 94 B10R1.348 O=C(O)[C@H]1CCCCCN1 Q62627 [1,0,0,1,0,0|2,0,0]=4 95 B10R1.4 CCOC1CCCCC1N Q59678 [1,0,0,1,0,0|1,0,1]=4 96 B10R1.17 BrCCCC1CCOCC1 Q61433 [1,0,0,1,0,0|1,0,1]=4 97 B10R1.17 CCCCC1CCNCC1 M23876 [1,0,0,1,0,0|1,0,1]=4 98 B10R1.17 CCCNC1CCOCC1 P40159 [1,0,0,1,0,0|1,0,1]=4 99 B10R1.17 CCOCC1CCCNC1 Q60046 [1,0,0,1,0,0|1,0,1]=4 100 B10R1.17 CCOCC1CCCNC1 S72607 [1,0,0,1,0,0|1,0,1]=4 101 B10R1.17 CNCCC1CCCCC1 P34718 [1,0,0,1,0,0|2,0,0]=4 102 B10R1.17 CNCCC1CCCCC1 P35769 [1,0,0,1,0,0|2,0,0]=4 103 B10R1.17 CONCC1CCCCC1 Q59667 [1,0,0,1,0,0|2,0,0]=4 104 B10R1.17 NCCCC1CCOCC1 Q57757 [1,0,0,1,0,0|1,0,1]=4 105 B10R1.17 NCCCC1CCOCC1 Q57758 [1,0,0,1,0,0|1,0,1]=4 106 B10R1.17 O=CCCC1CCNCC1 Q53388 [1,0,0,1,0,0|2,0,0]=4 107 B10R1.17 O=CCCC1CCOCC1 Q57776 [1,0,0,1,0,0|2,0,0]=4 108 B10R1.17 OCCCC1CCOCC1 Q57775 [1,0,0,1,0,0|1,0,1]=4 109 B10R1.21 CNCCCC1CCCC1 P40842 [1,0,0,1,0,0|2,0,0]=4 110 B10R1.21 CNCCCC1CCCC1 P42969 [1,0,0,1,0,0|2,0,0]=4 111 B12R1.107 CC(=O)NC(C)C1CCNCC1 Q57509 [0,1,0,1,0,0|2,0,0]=4 112 B12R1.107 NC(=O)CC(N)C1CCCCC1 Q59808 [0,1,0,1,0,0|2,0,0]=4 113 B12R1.107 NC(=O)CC(N)C1CCCCC1 Q59809 [0,1,0,1,0,0|2,0,0]=4 114 B12R1.107 NC(CC(=O)O)C1CCCCC1 P41804 [0,1,0,1,0,0|2,0,0]=4 115 B12R1.107 N[C@@H](CC(=O)O)C1CCCCC1 P35154 [0,1,0,1,0,0|2,0,0]=4 116 B12R1.107 N[C@H](CC(=O)O)C1CCCCC1 P35153 [0,1,0,1,0,0|2,0,0]=4 117 B12R1.391 CC(=O)OC1CNCCC1(F)F M23423 [0,1,0,1,0,0|2,0,0]=4 118 B12R1.27 COC(=O)CCC1CCCCO1 Q57793 [0,1,0,1,0,0|2,0,0]=4 119 B12R1.371 COC(=O)CC1CCCCC1O P45293 [0,1,0,1,0,0|2,0,0]=4 120 B12R1.371 COC(=O)CC1CNCCC1C L13831 [0,1,0,1,0,0|2,0,0]=4 121 B12R1.43 CC(=O)N(C)CC1CCNCC1 Q65253 [0,1,0,1,0,0|2,0,0]=4 122 B12R1.43 NC(=O)C(N)CC1CCCCC1 P46427 [0,1,0,1,0,0|2,0,0]=4 123 B12R1.43 NC(CC1CCCCC1)C(=O)O P38056 [0,1,0,1,0,0|2,0,0]=4 124 B12R1.43 NC(CC1CCCCC1)C(=O)O P44690 [0,1,0,1,0,0|2,0,0]=4 125 B12R1.43 O=C(O)C(O)CC1CCCCC1 P39330 [0,1,0,1,0,0|2,0,0]=4 126 B12R1.43 O=C(O)[C@@H](O)CC1CCCCC1 P37004 [0,1,0,1,0,0|2,0,0]=4 127 B12R1.43 O=C(O)[C@H](O)CC1CCCCC1 P40940 [0,1,0,1,0,0|2,0,0]=4 128 B12R1.2197 N[C@@H](C(=O)O)C1CCCCCC1 L14328 [0,1,0,1,0,0|2,0,0]=4 129 B12R1.2197 N[C@H](C(=O)O)C1CCCCCC1 L14324 [0,1,0,1,0,0|2,0,0]=4 130 B12R1.54 CC(=O)CCC(=O)C1CCCC1 Q59164 [0,1,0,1,0,0|1,0,1]=4 131 B12R1.3110 CC(=O)NCC1(F)CCNCC1 Q53024 [0,1,0,1,0,0|2,0,0]=4 132 B12R1.3110 CC(=O)NCC1(N)CCCCC1 L19704 [0,1,0,1,0,0|1,0,0]=3 133 B12R1.257 CC(=O)NCCCNC1CSC1 Q58970 [0,1,0,1,0,0|2,0,0]=4 134 B12R1.125 C=C(C)CNC1CCCCC1C Q59666 [0,1,0,1,0,0|2,0,0]=4 135 B12R1.252 CC(=O)NCCC1CCCNC1 Q57546 [0,1,0,1,0,0|1,0,0]=3 136 B12R1.252 CC(C)OCCC1CCCCN1 Q57494 [0,1,0,1,0,0|1,0,1]=4 137 B12R1.130 CN1CCCC1COCC(=O)O Q60895 [0,1,0,1,0,0|2,0,0]=4 138 B12R1.130 CN1CCC[C@H]1COCC(=O)O Q60802 [0,1,0,1,0,0|2,0,0]=4 139 B12R1.283 CCCC1OCCCC1C(=O)O Q57665 [0,1,0,1,0,0|2,0,0]=4 140 B12R1.891 CS(=O)(=O)OCC1CCCCO1 S72478 [0,1,0,1,0,0|2,0,0]=4 141 B12R1.891 CS(=O)(=O)OCC1CCOCC1 P41687 [0,1,0,1,0,0|2,0,0]=4 142 B12R2.24 O=C1CCC2NCCCC2N1 Q61229 [0,0,0,2,0,0|2,0,0]=4 143 B12R2.24 O=C1CN2CCCCC2CN1 Q59920 [0,0,0,2,0,0|2,0,0]=4 144 B12R2.24 O=C1CNC2CCCCC2N1 Q58043 [0,0,0,2,0,0|2,0,0]=4 145 B12R2.594 O=C1CC2CCCC(CN1)N2 P49370 [0,0,0,2,0,0|2,0,0]=4 146 B12R2.1081 O=C1CCCN2CCCCC12 Q59929 [0,0,0,2,0,0|2,0,0]=4 147 B12R2.1081 O=C1CNCC2CCCCN12 F-4462 [0,0,0,2,0,0|2,0,0]=4 148 B12R2.1081 O=C1OCCC2CNCCN12 Q58056 [0,0,0,2,0,0|2,0,0]=4 149 B12R2.1081 O=C1OCCN2CCNCC12 Q56898 [0,0,0,2,0,0|2,0,0]=4 150 B12R2.5121 O=C1CC2(CCNC2)CCN1 Q65239 [0,0,0,2,0,0|2,0,0]=4 151 B12R2.5121 O=C1CCNC2(CCCC2)C1 Q59157 [0,0,0,2,0,0|2,0,0]=4 152 B12R2.5121 O=C1CCOC2(CCCC2)C1 L18200 [0,0,0,2,0,0|2,0,0]=4 153 B12R2.5121 O=C1NC2(CCNC2)CCO1 Q56493 [0,0,0,2,0,0|2,0,0]=4 154 B12R2.5121 O=C1NC2(CCNC2)CCO1 Q56494 [0,0,0,2,0,0|2,0,0]=4 155 B12R2.202 C[C@H]1CNC[C@H]2NC(=O)O[C@H]12 Q61109 [0,0,0,2,0,0|2,0,0]=4 156 B12R2.2918 O=C1CC2(CCCNC2)CN1 P44330 [0,0,0,2,0,0|2,0,0]=4 157 B12R2.2918 O=C1CC2(CCNCC2)CN1 C-3479 [0,0,0,2,0,0|2,0,0]=4 158 B12R2.2918 O=C1CC2(CCNCC2)CN1 L22504 [0,0,0,2,0,0|2,0,0]=4 159 B12R2.2918 O=C1CC2(CCOCC2)CN1 G-5754 [0,0,0,2,0,0|2,0,0]=4 160 B12R2.2918 O=C1NC2(CCNCC2)CO1 S72704 [0,0,0,2,0,0|2,0,0]=4 161 B12R2.2918 O=C1NC2(CCNCC2)CO1 S72705 [0,0,0,2,0,0|2,0,0]=4 162 B12R2.2918 O=C1NCC2(CCCCC2)O1 Q59561 [0,0,0,2,0,0|2,0,0]=4 163 B12R2.1392 NC(=O)C1CC2CCC1CC2 P46803 [0,0,0,2,0,0|2,0,0]=4 164 B12R2.1392 O=C(O)C1CC2CCC1CC2 P44644 [0,0,0,2,0,0|2,0,0]=4 165 B12R2.1392 O=C(O)[C@@H]1CC2CCC1CC2 P45686 [0,0,0,2,0,0|2,0,0]=4 166 B12R2.1392 O=C(O)[C@H]1CC2CCC1CC2 P45147 [0,0,0,2,0,0|2,0,0]=4 167 B12R2.1661 NC(=O)CC1CC2CCC1C2 P45203 [0,0,0,2,0,0|2,0,0]=4 168 B12R2.1661 O=C(Cl)CC1CC2CCC1C2 P45496 [0,0,0,2,0,0|2,0,0]=4 169 B12R2.1661 O=C(O)CC1C[C@@H]2CC[C@H]1C2 P44985 [0,0,0,2,0,0|2,0,0]=4 170 B12R2.1154 [C@H]12CCC[C@H](CC(=O)C1)N2C L13639 [0,0,0,2,0,0|2,0,0]=4 171 B12R2.3190 [C@@H]12CNCC[C@@H]1CN2C(C)=O Q56390 [0,0,0,2,0,0|2,0,0]=4 172 B12R2.252 CC(=O)N1C[C@@H]2CNC[C@@H]2C1 Q58180 [0,0,0,2,0,0|2,0,0]=4 173 B12R2.229 O=C1CCNCC2CCCN12 F-4412 [0,0,0,2,0,0|2,0,0]=4