0 B10R1.15 C=CC(=O)N1CCOCC1 219109 [0,0,0,0,0,0|3,0,1]=4 1 B10R1.15 CC(CO)C1CCCCC1 239818 [0,0,0,0,0,0|3,0,1]=4 2 B10R1.15 CCC(=O)C1CCCCC1 242322 [0,0,0,0,0,0|1,0,0]=1 3 B10R1.15 CCC(=O)N1CCNCC1 024333 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.15 CNC(=O)C1CCCNC1 029249 [0,0,0,0,0,0|2,0,0]=2 5 B10R1.15 CNC(=O)C1CCNCC1 009970 [0,0,0,0,0,0|2,0,0]=2 6 B10R1.15 COC(=O)C1CC=CCC1 241824 [0,0,0,0,0,0|0,0,2]=2 7 B10R1.15 COC(=O)C1CCCCC1 024556 [0,0,0,0,0,0|0,0,0]=0 8 B10R1.15 COC(=O)C1CCCCN1 046385 [0,0,0,0,0,0|1,0,0]=1 9 B10R1.15 COC(=O)C1CCCNC1 046386 [0,0,0,0,0,0|1,0,0]=1 10 B10R1.15 COC(=O)C1CCNCC1 024861 [0,0,0,0,0,0|1,0,0]=1 11 B10R1.15 COC(=O)C1CCNCC1 033231 [0,0,0,0,0,0|1,0,0]=1 12 B10R1.15 COC(=O)C1CCOCC1 067015 [0,0,0,0,0,0|1,0,0]=1 13 B10R1.15 COC(=O)C1CNCCN1 011843 [0,0,0,0,0,0|2,0,0]=2 14 B10R1.15 COC(=O)N1CCNCC1 091561 [0,0,0,0,0,0|2,0,0]=2 15 B10R1.15 COC(=O)[C@@H]1CCCCN1 093769 [0,0,0,0,0,0|1,0,0]=1 16 B10R1.15 COC(=O)[C@H]1CCCCN1 075174 [0,0,0,0,0,0|1,0,0]=1 17 B10R1.15 NCC(=O)N1CCCCC1 024984 [0,0,0,0,0,0|3,0,0]=3 18 B10R1.15 NCC(=O)N1CCNCC1 019588 [0,0,0,0,0,0|4,0,0]=4 19 B10R1.15 NCC(=O)N1CCOCC1 024826 [0,0,0,0,0,0|4,0,0]=4 20 B10R1.15 NNC(=O)C1CCCCC1 019319 [0,0,0,0,0,0|2,0,0]=2 21 B10R1.15 N[C@@H](CO)C1CCCCC1 225989 [0,0,0,0,0,0|3,0,1]=4 22 B10R1.15 N[C@H](CO)C1CCCCC1 229936 [0,0,0,0,0,0|3,0,1]=4 23 B10R1.15 O=C(CCl)N1CCCCC1 024977 [0,0,0,0,0,0|3,0,0]=3 24 B10R1.15 O=C(CCl)N1CCNCC1 019601 [0,0,0,0,0,0|4,0,0]=4 25 B10R1.15 O=C(CCl)N1CCOCC1 005874 [0,0,0,0,0,0|4,0,0]=4 26 B9R1.6 CC(=O)C1CCCCC1 045203 [1,0,0,0,0,0|0,0,0]=1 27 B9R1.6 CC(=O)N1CCCCC1 032562 [1,0,0,0,0,0|1,0,0]=2 28 B9R1.6 CC(=O)N1CCNCC1 023244 [1,0,0,0,0,0|2,0,0]=3 29 B9R1.6 CC(=O)N1CCOCC1 219038 [1,0,0,0,0,0|2,0,0]=3 30 B9R1.6 CC(O)C1CCCCC1 239558 [1,0,0,0,0,0|0,0,2]=3 31 B9R1.6 CN(C)C1CCCCC1 243039 [1,0,0,0,0,0|2,0,0]=3 32 B9R1.6 CN(C)C1CCNCC1 021288 [1,0,0,0,0,0|3,0,0]=4 33 B9R1.6 CN(C)C1CCNCC1 043272 [1,0,0,0,0,0|3,0,0]=4 34 B9R1.6 NC(=O)C1CCCCC1 094742 [1,0,0,0,0,0|1,0,0]=2 35 B9R1.6 NC(=O)C1CCCCN1 044306 [1,0,0,0,0,0|2,0,0]=3 36 B9R1.6 NC(=O)C1CCNCC1 037366 [1,0,0,0,0,0|2,0,0]=3 37 B9R1.6 NC(=O)C1CCOCC1 068765 [1,0,0,0,0,0|2,0,0]=3 38 B9R1.6 NC(=O)N1CCNCC1 024517 [1,0,0,0,0,0|3,0,0]=4 39 B9R1.6 NC(=O)[C@H]1CCCNC1 075482 [1,0,0,0,0,0|2,0,0]=3 40 B9R1.6 NC(=S)N1CCCCC1 018978 [1,0,0,0,0,0|2,1,0]=4 41 B9R1.6 O=C(Cl)C1CCCCC1 099402 [1,0,0,0,0,0|1,0,0]=2 42 B9R1.6 O=C(Cl)N1CCOCC1 448632 [1,0,0,0,0,0|3,0,0]=4 43 B9R1.6 O=C(O)C1=CCNCC1 041827 [1,0,0,0,0,0|1,0,2]=4 44 B9R1.6 O=C(O)C1CC=CCC1 011329 [1,0,0,0,0,0|0,0,2]=3 45 B9R1.6 O=C(O)C1CCCCC1 079483 [1,0,0,0,0,0|0,0,0]=1 46 B9R1.6 O=C(O)C1CCCCN1 024932 [1,0,0,0,0,0|1,0,0]=2 47 B9R1.6 O=C(O)C1CCCCN1 321687 [1,0,0,0,0,0|1,0,0]=2 48 B9R1.6 O=C(O)C1CCCNC1 013177 [1,0,0,0,0,0|1,0,0]=2 49 B9R1.6 O=C(O)C1CCCOC1 091939 [1,0,0,0,0,0|1,0,0]=2 50 B9R1.6 O=C(O)C1CCNCC1 009837 [1,0,0,0,0,0|1,0,0]=2 51 B9R1.6 O=C(O)C1CCOCC1 043853 [1,0,0,0,0,0|1,0,0]=2 52 B9R1.6 O=C(O)C1CNCCN1 019229 [1,0,0,0,0,0|2,0,0]=3 53 B9R1.6 O=C(O)C1CSCCN1 066389 [1,0,0,0,0,0|2,0,0]=3 54 B9R1.6 O=C(O)[C@@H]1CCCCN1 040065 [1,0,0,0,0,0|1,0,0]=2 55 B9R1.6 O=C(O)[C@@H]1CCCNC1 034461 [1,0,0,0,0,0|1,0,0]=2 56 B9R1.6 O=C(O)[C@@H]1CNCCN1 077806 [1,0,0,0,0,0|2,0,0]=3 57 B9R1.6 O=C(O)[C@@H]1CNCCN1 093780 [1,0,0,0,0,0|2,0,0]=3 58 B9R1.6 O=C(O)[C@H]1CCCCN1 034512 [1,0,0,0,0,0|1,0,0]=2 59 B9R1.6 OB(O)C1CCCCC1 011024 [1,0,0,0,0,0|1,0,1]=3 60 B9R1.8 BrCCC1CCCCC1 220157 [1,0,0,0,0,0|2,0,1]=4 61 B9R1.8 C#CCC1CCCCC1 009112 [1,0,0,0,0,0|1,0,2]=4 62 B9R1.8 CCNC1CCCCC1 078851 [1,0,0,0,0,0|2,0,0]=3 63 B9R1.8 CNCC1CCCCC1 359898 [1,0,0,0,0,0|1,0,1]=3 64 B9R1.8 ICCC1CCCCC1 101668 [1,0,0,0,0,0|2,0,1]=4 65 B9R1.8 O=C=NC1CCCCC1 123400 [1,0,0,0,0,0|3,0,0]=4 66 B9R1.8 O=CNC1CCCCC1 099604 [1,0,0,0,0,0|3,0,0]=4 67 B9R1.8 OCCC1CCCCC1 225442 [1,0,0,0,0,0|2,0,1]=4 68 B9R1.8 S=C=NC1CCCCC1 008784 [1,0,0,0,0,0|3,0,0]=4 69 B11R1.12 CCN(CC)C1CCCCC1 105779 [0,1,0,0,0,0|3,0,0]=4 70 B11R1.16 CCOC(=O)C1CCCCN1 046387 [0,1,0,0,0,0|1,0,0]=2 71 B11R1.16 CCOC(=O)C1CCCCN1 243068 [0,1,0,0,0,0|1,0,0]=2 72 B11R1.16 CCOC(=O)C1CCCNC1 009838 [0,1,0,0,0,0|1,0,0]=2 73 B11R1.16 CCOC(=O)C1CCCNC1 033701 [0,1,0,0,0,0|1,0,0]=2 74 B11R1.16 CCOC(=O)C1CCNCC1 009839 [0,1,0,0,0,0|1,0,0]=2 75 B11R1.16 CCOC(=O)C1CCNCC1 033118 [0,1,0,0,0,0|1,0,0]=2 76 B11R1.16 CCOC(=O)N1CCNCC1 021571 [0,1,0,0,0,0|2,0,0]=3 77 B11R1.16 CCOC(=O)[C@@H]1CCCNC1 050064 [0,1,0,0,0,0|1,0,0]=2 78 B11R1.16 CNCC(=O)N1CCCCC1 024781 [0,1,0,0,0,0|2,0,0]=3 79 B11R1.16 CNCC(=O)N1CCOCC1 024782 [0,1,0,0,0,0|3,0,0]=4 80 B11R1.16 C\C=C\C(O)C1CCCCC1 103866 [0,1,0,0,0,0|1,0,2]=4 81 B11R1.16 N#CCC(=O)N1CCCCC1 068903 [0,1,0,0,0,0|2,0,1]=4 82 B11R1.16 NCCC(=O)N1CCOCC1 041824 [0,1,0,0,0,0|3,0,0]=4 83 B11R1.22 CC1CCN(C(=O)CCl)CC1 041977 [0,1,0,0,0,0|3,0,0]=4 84 B11R1.22 COC(=O)C1CCN(C)CC1 091973 [0,1,0,0,0,0|1,0,0]=2 85 B11R1.36 CC(C)C(=O)N1CCNCC1 024332 [0,1,0,0,0,0|3,0,0]=4 86 B11R1.36 CC(Cl)C(=O)N1CCOCC1 042422 [0,1,0,0,0,0|3,0,0]=4 87 B11R1.36 CC(N)C(=O)N1CCCCC1 358604 [0,1,0,0,0,0|2,0,0]=3 88 B11R1.36 CN(C)C(=O)C1CCCCC1 322924 [0,1,0,0,0,0|1,0,0]=2 89 B11R1.36 CN(C)C(=O)N1CCNCC1 021299 [0,1,0,0,0,0|3,0,0]=4 90 B11R1.36 O=C(O)C(=O)N1CCCCC1 027669 [0,1,0,0,0,0|3,0,0]=4 91 B11R1.222 COC(=O)C1CNCCC1=O 078912 [0,1,0,0,0,0|1,0,1]=3 92 B11R1.878 COC(=O)C1(Br)CCCCC1 240427 [0,1,0,0,0,0|0,0,0]=1 93 B9R0.8 CCCCC(Br)C(=O)OC BR1274 [0,0,1,0,0,0|1,0,0]=2 94 B9R0.8 CCCCC(N)C(=O)OC 226410 [0,0,1,0,0,0|1,0,0]=2 95 B9R0.8 COC(=O)C(N)CCSC 003824 [0,0,1,0,0,0|2,0,0]=3 96 B9R0.12 CCC(N=C=S)C(=O)OC 009531 [0,0,1,0,0,0|2,0,1]=4 97 B9R0.46 CCCCCCC(=O)NN 045793 [0,0,1,0,0,0|2,0,0]=3 98 B9R0.46 COC(=O)CCCCCBr 240729 [0,0,1,0,0,0|1,0,0]=2 99 B9R0.46 COC(=O)CCCCCN 079812 [0,0,1,0,0,0|1,0,0]=2 100 B11R2.367 C=C1C(=O)C2CCN1CC2 106178 [0,0,0,1,0,0|2,0,1]=4 101 B9R1.11 CNC(=O)C1CCCC1 370963 [0,0,0,0,1,0|1,0,0]=2 102 B9R1.11 COC(=O)C1CC=CC1 078959 [0,0,0,0,1,0|0,0,2]=3 103 B9R1.11 COC(=O)C1CCCC1 067089 [0,0,0,0,1,0|0,0,0]=1 104 B9R1.11 COC(=O)C1CCCO1 241056 [0,0,0,0,1,0|1,0,0]=2 105 B9R1.11 COC(=O)C1NCCS1 019515 [0,0,0,0,1,0|2,0,0]=3 106 B9R1.11 COC(=O)N1CCCC1 061535 [0,0,0,0,1,0|1,0,0]=2 107 B9R1.11 COC(=O)[C@@H]1CCCN1 M02956 [0,0,0,0,1,0|1,0,0]=2 108 B9R1.11 COC(=O)[C@H]1CCCN1 M06057 [0,0,0,0,1,0|1,0,0]=2 109 B9R1.11 COC(=O)[C@H]1CCNC1 091945 [0,0,0,0,1,0|1,0,0]=2 110 B9R1.11 NCC(=O)N1CCCC1 024983 [0,0,0,0,1,0|3,0,0]=4 111 B9R1.11 O=C(CCl)N1CCCC1 024631 [0,0,0,0,1,0|3,0,0]=4 112 B11R1.40 COC(=O)CC1CCCCC1 239559 [0,0,0,0,0,1|0,0,0]=1 113 B11R1.40 COC(=O)CC1CCNCC1 040200 [0,0,0,0,0,1|1,0,0]=2 114 B11R1.40 COC(=O)CC1CCNCC1 092734 [0,0,0,0,0,1|1,0,0]=2 115 B11R1.40 COC(=O)CN1CCOCC1 317447 [0,0,0,0,0,1|2,0,0]=3 116 B11R1.40 NNC(=S)NC1CCCCC1 018479 [0,0,0,0,0,1|2,1,0]=4 117 B11R1.40 O=C(CCl)NC1CCCCC1 026029 [0,0,0,0,0,1|2,0,0]=3 118 B8R0.3 CCCC(Br)C(=O)OC 099965 [1,0,1,0,0,0|1,0,0]=3 119 B8R0.3 CCCC(C)C(=O)OC 102877 [1,0,1,0,0,0|0,0,0]=2 120 B8R0.3 COC(=O)C(Br)CCBr 044197 [1,0,1,0,0,0|2,0,0]=4 121 B8R0.6 C=CCCCC(=O)OC 103881 [1,0,1,0,0,0|0,0,2]=4 122 B8R0.6 CCCCCC(=O)NN 045795 [1,0,1,0,0,0|2,0,0]=4 123 B8R0.6 CCCCCC(=O)OC 103044 [1,0,1,0,0,0|0,0,0]=2 124 B8R0.6 CCCSCC(=O)OC 095137 [1,0,1,0,0,0|1,0,0]=3 125 B8R0.6 COC(=O)CCCCBr 210250 [1,0,1,0,0,0|1,0,0]=3 126 B8R0.6 COC(=O)CCCCI 103067 [1,0,1,0,0,0|1,0,0]=3 127 B8R0.8 CCCCC(Br)C(=O)O 004238 [1,0,1,0,0,0|1,0,0]=3 128 B8R0.8 CCCCC(C)C(=O)O 038355 [1,0,1,0,0,0|0,0,0]=2 129 B8R0.8 CCCCC(N)C(=O)O 045400 [1,0,1,0,0,0|1,0,0]=3 130 B8R0.8 CCCCC(O)C(=O)O 013596 [1,0,1,0,0,0|1,0,0]=3 131 B8R0.8 CCCC[C@@H](N)C(=O)O 236958 [1,0,1,0,0,0|1,0,0]=3 132 B8R0.8 CCCC[C@H](N)C(=O)O M03242 [1,0,1,0,0,0|1,0,0]=3 133 B8R0.8 CSCCC(N)C(=O)O 209039 [1,0,1,0,0,0|2,0,0]=4 134 B8R0.8 CSCC[C@H](N)C(=O)O M02939 [1,0,1,0,0,0|2,0,0]=4 135 B8R0.8 CSCC[C@H](N)C(=O)O M02945 [1,0,1,0,0,0|2,0,0]=4 136 B8R0.8 NCCCC(N)C(=O)O 364183 [1,0,1,0,0,0|2,0,0]=4 137 B8R0.20 CCC(=O)N(CC)CC 238969 [1,0,1,0,0,0|2,0,0]=4 138 B8R0.20 COC(=O)C(OC)OC 001312 [1,0,1,0,0,0|2,0,0]=4 139 B8R0.4 CCCCCCCNC 104338 [1,0,1,0,0,0|1,0,1]=4 140 B8R0.7 C#CCCCCC(=O)O 208727 [1,0,1,0,0,0|0,0,2]=4 141 B8R0.7 C=CCCCCC(=O)O 200743 [1,0,1,0,0,0|0,0,2]=4 142 B8R0.7 CC(=O)OCCCCBr 002417 [1,0,1,0,0,0|2,0,0]=4 143 B8R0.7 CCCCCCB(O)O 466928 [1,0,1,0,0,0|1,0,1]=4 144 B8R0.7 CCCCCCC(=O)Cl 102978 [1,0,1,0,0,0|1,0,0]=3 145 B8R0.7 CCCCCCC(=O)O 066627 [1,0,1,0,0,0|0,0,0]=2 146 B8R0.7 CCCCCCC(C)=O 242815 [1,0,1,0,0,0|0,0,0]=2 147 B8R0.7 CCCCCCC(C)N 242674 [1,0,1,0,0,0|1,0,1]=4 148 B8R0.7 CCCCCCN(C)C 046920 [1,0,1,0,0,0|2,0,0]=4 149 B8R0.7 CCCCCOC(=O)Cl 544334 [1,0,1,0,0,0|2,0,0]=4 150 B8R0.7 CCCCSCC(=O)O 351418 [1,0,1,0,0,0|1,0,0]=3 151 B8R0.7 CCCC\C=C\C(C)=O 104079 [1,0,1,0,0,0|0,0,2]=4 152 B8R0.7 COCCOCC(=O)O 329057 [1,0,1,0,0,0|2,0,0]=4 153 B8R0.7 COCCSCC(=O)O 351521 [1,0,1,0,0,0|2,0,0]=4 154 B8R0.7 NC(=O)CCCCCBr 002966 [1,0,1,0,0,0|2,0,0]=4 155 B8R0.7 NCCCCCC(=O)O 103200 [1,0,1,0,0,0|1,0,0]=3 156 B8R0.7 O=C(Cl)CCCCCBr 003076 [1,0,1,0,0,0|2,0,0]=4 157 B8R0.7 O=C(O)CCCCCBr 002967 [1,0,1,0,0,0|1,0,0]=3 158 B8R1.2 BrCC1CCCCC1 044195 [2,0,0,0,0,0|1,0,1]=4 159 B8R1.2 C#CC1CCCCC1 237953 [2,0,0,0,0,0|0,0,2]=4 160 B8R1.2 CC=C1CCCCC1 105541 [2,0,0,0,0,0|0,0,1]=3 161 B8R1.2 CCC1CCCCN1 238822 [2,0,0,0,0,0|1,0,1]=4 162 B8R1.2 CCN1CCCCC1 180030 [2,0,0,0,0,0|1,0,1]=4 163 B8R1.2 CNC1CCCCC1 221640 [2,0,0,0,0,0|1,0,0]=3 164 B8R1.2 CNC1CCOCC1 016046 [2,0,0,0,0,0|2,0,0]=4 165 B8R1.2 COC1=NCCCC1 008049 [2,0,0,0,0,0|1,0,1]=4 166 B8R1.2 COC1CCNCC1 029227 [2,0,0,0,0,0|1,0,0]=3 167 B8R1.2 COC1CCNCC1 046103 [2,0,0,0,0,0|1,0,0]=3 168 B8R1.2 N#CC1CCCCC1 243054 [2,0,0,0,0,0|1,0,1]=4 169 B8R1.2 NCC1CCCCC1 065546 [2,0,0,0,0,0|1,0,1]=4 170 B8R1.2 NNC1CCCCC1 044302 [2,0,0,0,0,0|2,0,0]=4 171 B8R1.2 NOC1CCCCO1 076716 [2,0,0,0,0,0|2,0,0]=4 172 B8R1.2 O=CC1=CCCCC1 235736 [2,0,0,0,0,0|0,0,2]=4 173 B8R1.2 O=CC1CCCCC1 050618 [2,0,0,0,0,0|0,0,0]=2 174 B8R1.2 O=CC1CCOCC1 065305 [2,0,0,0,0,0|1,0,0]=3 175 B8R1.2 O=CN1CCCCC1 208647 [2,0,0,0,0,0|1,0,0]=3 176 B8R1.2 O=CN1CCNCC1 223849 [2,0,0,0,0,0|2,0,0]=4 177 B8R1.2 O=CN1CCOCC1 078917 [2,0,0,0,0,0|2,0,0]=4 178 B8R1.2 OCC1CCCCC1 024256 [2,0,0,0,0,0|0,0,1]=3 179 B8R1.2 OCC1CCCCN1 078983 [2,0,0,0,0,0|1,0,1]=4 180 B8R1.2 OCC1CCCCO1 067745 [2,0,0,0,0,0|1,0,1]=4 181 B8R1.2 OCC1CCCNC1 036329 [2,0,0,0,0,0|1,0,1]=4 182 B8R1.2 OCC1CCNCC1 067749 [2,0,0,0,0,0|1,0,1]=4 183 B8R1.2 OCC1CCOCC1 047969 [2,0,0,0,0,0|1,0,1]=4 184 B8R1.2 OC[C@@H]1CCCCN1 230468 [2,0,0,0,0,0|1,0,1]=4 185 B8R1.2 OC[C@H]1CCCCN1 230469 [2,0,0,0,0,0|1,0,1]=4 186 B8R1.2 ON=C1CCCCC1 371936 [2,0,0,0,0,0|1,0,1]=4 187 B8R1.2 [C-]#[N+]C1CCCCC1 021021 [2,0,0,0,0,0|1,0,1]=4 188 B10R0.19 CCCCC(=O)C(=O)OCC 075970 [0,1,1,0,0,0|1,0,1]=4 189 B10R0.19 CCCCC(Br)C(=O)OCC 463320 [0,1,1,0,0,0|1,0,0]=3 190 B10R0.19 CCCCC(O)C(=O)OCC 103606 [0,1,1,0,0,0|1,0,0]=3 191 B10R0.19 CCOC(=O)C(N)CCSC 003823 [0,1,1,0,0,0|2,0,0]=4 192 B10R0.85 CCCCC(CC)C(=O)OC 103196 [0,1,1,0,0,0|0,0,0]=2 193 B10R0.1 CCCCCCC(=O)CCC 240668 [0,1,1,0,0,0|1,0,0]=3 194 B10R0.1 CCOC(=O)CCCCCBr 239007 [0,1,1,0,0,0|1,0,0]=3 195 B10R0.18 CCCCC(=O)CC(=O)OC 046871 [0,1,1,0,0,0|0,0,1]=3 196 B10R0.55 COC(=O)CCCCC(=O)O 078720 [0,1,1,0,0,0|1,0,1]=4 197 B10R0.59 COC(=O)CCCC(=O)OC 341738 [0,1,1,0,0,0|1,0,1]=4 198 B10R0.74 CCCCCC#CC(=O)OC 240942 [0,1,1,0,0,0|0,0,1]=3 199 B10R0.74 CCCCCCCC(=O)OC 242814 [0,1,1,0,0,0|0,0,0]=2 200 B10R0.74 CC\C=C/CCOC(=O)OC 106717 [0,1,1,0,0,0|0,0,2]=4 201 B10R0.74 COC(=O)CCCCCCBr 077282 [0,1,1,0,0,0|0,0,0]=2 202 B10R1.13 CC(=O)C1CC=C(C)CC1 223842 [1,1,0,0,0,0|0,0,2]=4 203 B10R1.13 CC(=O)N1CCC(=O)CC1 221688 [1,1,0,0,0,0|1,0,1]=4 204 B10R1.13 CC(=O)N1CCC(N)CC1 036650 [1,1,0,0,0,0|1,0,0]=3 205 B10R1.13 CC(=O)N1CCC(O)CC1 075518 [1,1,0,0,0,0|1,0,0]=3 206 B10R1.13 CC(C)C1CCC(O)CC1 237941 [1,1,0,0,0,0|1,0,1]=4 207 B10R1.13 CC1CCC(C(=O)O)CC1 402569 [1,1,0,0,0,0|0,0,0]=2 208 B10R1.13 CN1CCC(C(=O)O)CC1 009864 [1,1,0,0,0,0|1,0,0]=3 209 B10R1.13 CN1CCC(C(=O)O)CC1 066347 [1,1,0,0,0,0|1,0,0]=3 210 B10R1.13 C[C@H]1CC[C@H](C(=O)O)CC1 218968 [1,1,0,0,0,0|0,0,0]=2 211 B10R1.13 NC1CCC(C(=O)O)CC1 013927 [1,1,0,0,0,0|0,0,0]=2 212 B10R1.13 N[C@H]1CC[C@@H](C(=O)O)CC1 047831 [1,1,0,0,0,0|0,0,0]=2 213 B10R1.13 N[C@H]1CC[C@H](C(=O)O)CC1 036671 [1,1,0,0,0,0|0,0,0]=2 214 B10R1.13 O=C(O)C1CCC(O)CC1 066493 [1,1,0,0,0,0|0,0,0]=2 215 B10R1.13 O=C(O)[C@H]1CC[C@@H](O)CC1 053323 [1,1,0,0,0,0|0,0,0]=2 216 B10R1.13 O=C(O)[C@H]1CC[C@H](O)CC1 242212 [1,1,0,0,0,0|0,0,0]=2 217 B10R1.28 O=S(=O)(Cl)C1CCCCC1 043709 [1,1,0,0,0,0|1,0,1]=4 218 B10R1.61 CC(=O)C1CCCCC1=O 068997 [1,1,0,0,0,0|0,0,1]=3 219 B10R1.61 CN1CCCCC1C(=O)O 024854 [1,1,0,0,0,0|1,0,0]=3 220 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O 103725 [1,1,0,0,0,0|0,0,0]=2 221 B10R1.113 CC(=O)N1CCCC(C)C1 180132 [1,1,0,0,0,0|1,0,0]=3 222 B10R1.113 CC1CCCC(C(=O)O)N1 391500 [1,1,0,0,0,0|1,0,0]=3 223 B10R1.113 CN1CCCC(C(=O)O)C1 009810 [1,1,0,0,0,0|1,0,0]=3 224 B10R1.113 NC1CCCC(C(=O)O)C1 103600 [1,1,0,0,0,0|0,0,0]=2 225 B10R1.113 N[C@H]1CCC[C@@H](C(=O)O)C1 233814 [1,1,0,0,0,0|0,0,0]=2 226 B10R1.113 O=C1CCC[C@H](C(=O)O)N1 040124 [1,1,0,0,0,0|1,0,1]=4 227 B10R1.363 CC1(C(=O)O)CCCCC1 066484 [1,1,0,0,0,0|0,0,0]=2 228 B10R1.363 NC1(C(=O)O)CCCCC1 208919 [1,1,0,0,0,0|0,0,0]=2 229 B10R1.363 NC1(C(=O)O)CCOCC1 328909 [1,1,0,0,0,0|1,0,0]=3 230 B10R1.363 O=C(O)C1(Br)CCCCC1 075499 [1,1,0,0,0,0|0,0,0]=2 231 B10R1.4 CCCC1CCCCC1O 104626 [1,1,0,0,0,0|1,0,1]=4 232 B10R1.17 OCCCC1CCCCC1 240944 [1,1,0,0,0,0|1,0,1]=4 233 B10R1.17 OCCNC1CCCCC1 094557 [1,1,0,0,0,0|2,0,0]=4 234 B10R1.18 CC(=O)CC1CCCCC1 403679 [1,1,0,0,0,0|1,0,1]=4 235 B10R1.18 CC(C)NC1CCCCC1 238547 [1,1,0,0,0,0|2,0,0]=4 236 B10R1.377 CC#CC1(O)CCCCC1 168600 [1,1,0,0,0,0|1,0,1]=4 237 B10R1.11 CCOC(=O)C1CCCC1 099780 [0,1,0,0,1,0|0,0,0]=2 238 B10R1.11 CCOC(=O)[C@@H]1CCCN1 242998 [0,1,0,0,1,0|1,0,0]=3 239 B10R1.11 CNCC(=O)N1CCCC1 024779 [0,1,0,0,1,0|2,0,0]=4 240 B10R1.11 NCCC(=O)N1CCCC1 024987 [0,1,0,0,1,0|2,0,0]=4 241 B10R1.14 COC(=O)C1CCC(=O)C1 093546 [0,1,0,0,1,0|0,0,1]=3 242 B10R1.14 COC(=O)[C@@H]1CCC(=O)N1 076841 [0,1,0,0,1,0|1,0,1]=4 243 B10R1.14 COC(=O)[C@@H]1C[C@@H](O)CN1 066958 [0,1,0,0,1,0|1,0,0]=3 244 B10R1.149 COC(=O)C1CCCC1=O 092887 [0,1,0,0,1,0|0,0,1]=3 245 B12R1.32 CCOC(=O)CC1CCCNC1 018134 [0,1,0,0,0,1|1,0,0]=3 246 B12R1.32 CCOC(=O)CC1CCNCC1 018135 [0,1,0,0,0,1|1,0,0]=3 247 B12R1.32 CCOC(=O)CN1CCNCC1 020100 [0,1,0,0,0,1|2,0,0]=4 248 B12R1.34 COC(=O)C(N)C1CCOCC1 424852 [0,1,0,0,0,1|1,0,0]=3 249 B12R1.34 COC(=O)C(N)C1CCSCC1 387279 [0,1,0,0,0,1|1,0,0]=3 250 B12R1.43 C=C(C)C(=O)OC1CCCCC1 106351 [0,1,0,0,0,1|1,0,0]=3 251 B12R1.16 CCOC(=O)C1CCC(=O)CC1 032733 [0,2,0,0,0,0|0,0,1]=3 252 B12R1.16 CCOC(=O)C1CCC(O)CC1 092690 [0,2,0,0,0,0|0,0,0]=2 253 B12R1.16 CCOC(=O)N1CCC(=O)CC1 022135 [0,2,0,0,0,0|1,0,1]=4 254 B12R1.17 CCOC(=O)C1CCCC(=O)C1 067079 [0,2,0,0,0,0|0,0,1]=3 255 B12R1.17 CCOC(=O)C1CCCN(C)C1 092132 [0,2,0,0,0,0|1,0,0]=3 256 B12R1.30 O=C(NCCO)C1CCCNC1 009966 [0,2,0,0,0,0|2,0,0]=4 257 B12R1.30 O=C(NCCO)C1CCNCC1 009967 [0,2,0,0,0,0|2,0,0]=4 258 B12R1.107 CC(C)NC(=O)C1CCCCC1 104371 [0,2,0,0,0,0|1,0,0]=3 259 B12R1.308 CCOC(=O)C1CCCCC1=O 078515 [0,2,0,0,0,0|0,0,1]=3 260 B12R1.308 CCOC(=O)C1CCCCN1C 091878 [0,2,0,0,0,0|1,0,0]=3 261 B12R1.308 CCOC(=O)C1CCCNC1=O 079764 [0,2,0,0,0,0|1,0,1]=4 262 B12R1.308 CCOC(=O)[C@@H]1CCCC[C@@H]1O 050038 [0,2,0,0,0,0|0,0,0]=2 263 B12R1.308 CCOC(=O)[C@@H]1CCCC[C@H]1N 103932 [0,2,0,0,0,0|0,0,0]=2 264 B12R1.5 COC(=O)[C@H]1CC[C@H](C=O)CC1 216936 [0,2,0,0,0,0|0,0,0]=2 265 B12R1.564 O=C(C1CCCCC1)C(F)(F)F 022064 [0,2,0,0,0,0|2,0,0]=4 266 B10R1.78 O=C1CCCCCCCN1 098992 [0,0,1,1,0,0|1,0,0]=3 267 B10R2.62 O=C1CC2CCC1CC2 362052 [1,0,0,1,0,0|0,0,0]=2 268 B10R2.62 O=C1CN2CCC1CC2 069044 [1,0,0,1,0,0|1,0,0]=3 269 B10R2.320 O=C1NC2CCCCC12 325670 [1,0,0,1,0,0|1,0,0]=3 270 B12R2.24 O=C1CCC2CCCCC2C1 099192 [0,0,0,1,0,1|1,0,0]=3 271 B12R2.2918 O=C1CC2(CCCCC2)CN1 070856 [0,0,0,1,0,1|1,0,0]=3 272 B12R2.1081 O=C1CCC[C@@H]2CCCC[C@@H]12 245835 [0,1,0,1,0,0|1,0,0]=3 273 B12R2.2028 O=C1OC(=O)C2CCCCC12 104113 [0,1,0,1,0,0|0,0,1]=3 274 B12R2.2028 [C@H]12CCCC[C@H]1C(=O)OC2=O 242681 [0,1,0,1,0,0|0,0,1]=3 275 B8R1.7 NC(=O)C1CCCC1 440626 [1,0,0,0,1,0|1,0,0]=3 276 B8R1.7 NC(=O)[C@@H]1CCCN1 011847 [1,0,0,0,1,0|2,0,0]=4 277 B8R1.7 NC(=O)[C@@H]1CCCN1 240702 [1,0,0,0,1,0|2,0,0]=4 278 B8R1.7 NC(=O)[C@H]1CCCN1 011848 [1,0,0,0,1,0|2,0,0]=4 279 B8R1.7 NC(=O)[C@H]1CCCN1 M02958 [1,0,0,0,1,0|2,0,0]=4 280 B8R1.7 O=C(Cl)C1CCCC1 050562 [1,0,0,0,1,0|1,0,0]=3 281 B8R1.7 O=C(O)C1CC=CC1 011660 [1,0,0,0,1,0|0,0,2]=4 282 B8R1.7 O=C(O)C1CCCC1 094575 [1,0,0,0,1,0|0,0,0]=2 283 B8R1.7 O=C(O)C1CCCN1 M02942 [1,0,0,0,1,0|1,0,0]=3 284 B8R1.7 O=C(O)C1CCCO1 225736 [1,0,0,0,1,0|1,0,0]=3 285 B8R1.7 O=C(O)C1CCNC1 093908 [1,0,0,0,1,0|1,0,0]=3 286 B8R1.7 O=C(O)C1CCOC1 034484 [1,0,0,0,1,0|1,0,0]=3 287 B8R1.7 O=C(O)C1NCCS1 005324 [1,0,0,0,1,0|2,0,0]=4 288 B8R1.7 O=C(O)[C@@H]1CCCN1 M02947 [1,0,0,0,1,0|1,0,0]=3 289 B8R1.7 O=C(O)[C@@H]1CCCO1 093764 [1,0,0,0,1,0|1,0,0]=3 290 B8R1.7 O=C(O)[C@@H]1CCNC1 093911 [1,0,0,0,1,0|1,0,0]=3 291 B8R1.7 O=C(O)[C@@H]1CSCN1 036413 [1,0,0,0,1,0|2,0,0]=4 292 B8R1.7 O=C(O)[C@H]1CCCN1 011849 [1,0,0,0,1,0|1,0,0]=3 293 B8R1.7 O=C(O)[C@H]1CSCN1 226021 [1,0,0,0,1,0|2,0,0]=4 294 B8R1.7 OB(O)C1CCCC1 011025 [1,0,0,0,1,0|1,0,1]=4 295 B8R1.38 COC(=O)C1CCC1 094004 [0,0,0,0,2,0|0,0,0]=2 296 B10R1.348 CC(=O)N1CCCNCC1 219284 [1,0,0,0,0,1|1,0,0]=3 297 B10R1.348 O=C(O)C1CCCCCC1 066487 [1,0,0,0,0,1|0,0,0]=2 298 B12R1.27 CNC(=O)CCC1CCCCC1 102612 [0,0,0,0,0,2|1,0,0]=3 299 B12R1.27 COC(=O)CCN1CCOCC1 018847 [0,0,0,0,0,2|2,0,0]=4