0 B8R0.6 C#CC(O)CCCCC 11033 [0,0,0,0,0,0|0,0,4]=4 1 B8R0.6 C=CC(=O)OCCCC 21089 [0,0,0,0,0,0|1,0,2]=3 2 B8R0.6 CCCSCC(=O)OC 28955 [0,0,0,0,0,0|2,0,0]=2 3 B8R0.6 COC(=O)CCCCN 31883 [0,0,0,0,0,0|2,0,0]=2 4 B7R0.1 BrCCCCCCBr 3894 [1,0,0,0,0,0|2,0,1]=4 5 B7R0.1 C#CCCCCCC 13059 [1,0,0,0,0,0|0,0,3]=4 6 B7R0.1 CCCCC#CCO 13065 [1,0,0,0,0,0|1,0,2]=4 7 B7R0.1 CCCCCCCBr 3775 [1,0,0,0,0,0|1,0,1]=3 8 B7R0.1 CCCCCCCI 3944 [1,0,0,0,0,0|1,0,1]=3 9 B7R0.1 CCCC\C=C\CO 18918 [1,0,0,0,0,0|1,0,1]=3 10 B7R0.1 CCOCCCCCl 1933 [1,0,0,0,0,0|2,0,0]=3 11 B7R0.1 ICCCCCCI 3846 [1,0,0,0,0,0|2,0,1]=4 12 B7R0.1 NCCCCCCO 13750 [1,0,0,0,0,0|2,0,1]=4 13 B7R0.1 OCCCCCCCl 16921 [1,0,0,0,0,0|2,0,1]=4 14 B7R0.3 CCCCC(Br)CBr 3891 [1,0,0,0,0,0|2,0,1]=4 15 B7R0.3 COC(=O)CCC#N 12831 [1,0,0,0,0,0|2,0,1]=4 16 B7R0.3 COC(=O)CCC=O 29717 [1,0,0,0,0,0|2,0,1]=4 17 B7R0.4 C#CCCCC(=O)O 35033 [1,0,0,0,0,0|1,0,2]=4 18 B7R0.4 CC(=O)CCCCCl 29051 [1,0,0,0,0,0|1,0,0]=2 19 B7R0.4 CC(C)CCCCBr 35107 [1,0,0,0,0,0|2,0,1]=4 20 B7R0.4 CCCCCB(O)O 27260 [1,0,0,0,0,0|2,0,1]=4 21 B7R0.4 CCCCCC(=O)Cl 21359 [1,0,0,0,0,0|1,0,0]=2 22 B7R0.4 CCCCCC(C)O 3094 [1,0,0,0,0,0|0,0,2]=3 23 B7R0.4 CCCCC[C@@H](C)O 6739 [1,0,0,0,0,0|0,0,2]=3 24 B7R0.4 CCCCC[C@H](C)O 6736 [1,0,0,0,0,0|0,0,2]=3 25 B7R0.4 CCC\C=C\C(C)=O 18920 [1,0,0,0,0,0|0,0,2]=3 26 B7R0.4 COCCOC(=O)Cl 12774 [1,0,0,0,0,0|3,0,0]=4 27 B7R0.4 NCCCCC(=O)O 18964 [1,0,0,0,0,0|2,0,0]=3 28 B7R0.4 NCCCCC(=O)O 31880 [1,0,0,0,0,0|2,0,0]=3 29 B7R0.4 O=C(Cl)CCCCBr 36169 [1,0,0,0,0,0|2,0,0]=3 30 B7R0.4 O=C(Cl)CCCCCl 10919 [1,0,0,0,0,0|2,0,0]=3 31 B7R0.4 O=C(O)CCCCBr 3843 [1,0,0,0,0,0|2,0,0]=3 32 B9R0.1 COC(=O)CCCC(=O)Cl 14033 [0,1,0,0,0,0|2,0,1]=4 33 B9R0.5 CCCCCC(=O)OCC 15737 [0,1,0,0,0,0|0,0,0]=1 34 B9R0.5 CCOC(=O)CCCCBr 3955 [0,1,0,0,0,0|1,0,0]=2 35 B9R0.5 CCOC(=O)CCCCN 31885 [0,1,0,0,0,0|1,0,0]=2 36 B9R0.5 CCOC(=O)CCN=C=O 30451 [0,1,0,0,0,0|2,0,1]=4 37 B9R0.5 CCO\C=C\C(=O)OCC 12909 [0,1,0,0,0,0|1,0,2]=4 38 B9R0.5 CCO\C=C\C(=O)OCC 27595 [0,1,0,0,0,0|1,0,2]=4 39 B9R0.8 COC(=O)[C@@H](N)CCCN 18996 [0,1,0,0,0,0|2,0,0]=3 40 B9R0.8 COC(=O)[C@@H](N)CCSC 14925 [0,1,0,0,0,0|2,0,0]=3 41 B9R0.24 CC[C@@H](O)CC[C@H](O)CC 30308 [0,1,0,0,0,0|0,0,2]=3 42 B9R0.34 COCC(=O)CC(=O)OC 10473 [0,1,0,0,0,0|2,0,1]=4 43 B9R0.46 CCC(C)CCCCCBr 18977 [0,1,0,0,0,0|1,0,1]=3 44 B9R0.46 CCCCCCC(C)CBr 18952 [0,1,0,0,0,0|2,0,1]=4 45 B9R0.46 CCCCCCC(O)CO 36051 [0,1,0,0,0,0|1,0,2]=4 46 B9R0.46 COC(=O)CCCCCBr 16910 [0,1,0,0,0,0|1,0,0]=2 47 B9R0.47 C=C(C)C(=O)NCCCN 23321 [0,1,0,0,0,0|2,0,1]=4 48 B9R0.47 C=C(F)C(=O)OCCCC 32379 [0,1,0,0,0,0|1,0,2]=4 49 B9R0.47 C=CCCCC(=O)N(C)C 36182 [0,1,0,0,0,0|1,0,2]=4 50 B9R0.47 CN(C)C(=O)CCCCBr 36181 [0,1,0,0,0,0|2,0,0]=3 51 B9R1.1 CCN1CCC(=O)CC1 6784 [0,0,0,1,0,0|1,0,0]=2 52 B9R1.1 CCN1CCC(N)CC1 8027 [0,0,0,1,0,0|2,0,1]=4 53 B9R1.1 CCN1CCC(O)CC1 7715 [0,0,0,1,0,0|1,0,2]=4 54 B9R1.1 CN1CCC(CN)CC1 16879 [0,0,0,1,0,0|3,0,0]=4 55 B9R1.1 CN1CCC(CO)CC1 8875 [0,0,0,1,0,0|3,0,0]=4 56 B9R1.1 CO[C@H]1CC[C@@H](N)CC1 23334 [0,0,0,1,0,0|2,0,1]=4 57 B9R1.1 CO[C@H]1CC[C@H](N)CC1 23335 [0,0,0,1,0,0|2,0,1]=4 58 B9R1.1 O=C1CCC(CO)CC1 20341 [0,0,0,1,0,0|1,0,0]=2 59 B9R1.1 O=CC1CCC(=O)CC1 2083 [0,0,0,1,0,0|1,0,1]=3 60 B9R1.2 CCN1CCCC(Cl)C1 6737 [0,0,0,1,0,0|3,0,0]=4 61 B9R1.2 CCN1CCCC(O)C1 7716 [0,0,0,1,0,0|3,0,0]=4 62 B9R1.3 CC1C(=O)CCCC1=O 15384 [0,0,0,1,0,0|1,0,1]=3 63 B9R1.5 CN1CCCCCC1=O 36383 [0,0,0,1,0,0|1,0,0]=2 64 B9R1.5 NC1CCCCNC1=O 20137 [0,0,0,1,0,0|2,0,0]=3 65 B9R1.5 N[C@@H]1CCCCNC1=O 30434 [0,0,0,1,0,0|2,0,0]=3 66 B9R1.5 N[C@H]1CCCCNC1=O 14097 [0,0,0,1,0,0|2,0,0]=3 67 B9R1.11 COC(=O)C1=CCCC1 2487 [0,0,0,1,0,0|1,0,2]=4 68 B9R1.11 COC(=O)C1CCCO1 2380 [0,0,0,1,0,0|2,0,0]=3 69 B9R1.11 COC(=O)C1CCNC1 18897 [0,0,0,1,0,0|2,0,0]=3 70 B9R1.11 COC(=O)[C@@H]1CCCN1 10887 [0,0,0,1,0,0|2,0,0]=3 71 B9R1.11 COC(=O)[C@@H]1CCNC1 20164 [0,0,0,1,0,0|2,0,0]=3 72 B9R1.11 COC(=O)[C@H]1CCCN1 10888 [0,0,0,1,0,0|2,0,0]=3 73 B9R1.11 NCC(=O)N1CCCC1 26419 [0,0,0,1,0,0|2,0,0]=3 74 B9R1.11 NCC(=S)N1CCCC1 11506 [0,0,0,1,0,0|2,1,0]=4 75 B9R1.49 CN1CCCC(=O)CC1 2442 [0,0,0,1,0,0|1,0,0]=2 76 B9R1.49 CN1CCCC(=O)CC1 2443 [0,0,0,1,0,0|1,0,0]=2 77 B9R1.49 CN1CCCC(N)CC1 35580 [0,0,0,1,0,0|2,0,1]=4 78 B9R1.49 CN1CCCC(O)CC1 2444 [0,0,0,1,0,0|1,0,2]=4 79 B9R1.80 COC(=O)CNC1CC1 30154 [0,0,0,1,0,0|2,0,0]=3 80 B9R1.89 OCC1CCCCCC1 16220 [0,0,0,1,0,0|2,0,1]=4 81 B9R1.118 CCC1(C)CCNCC1 8039 [0,0,0,1,0,0|2,0,1]=4 82 B9R1.118 CCC1(O)CCCCC1 20382 [0,0,0,1,0,0|0,0,2]=3 83 B9R1.118 CCC1(O)CCCCC1 35497 [0,0,0,1,0,0|0,0,2]=3 84 B6R0.6 BrCCCCCBr 3909 [2,0,0,0,0,0|2,0,0]=4 85 B6R0.6 C#CCCCCC 13058 [2,0,0,0,0,0|0,0,2]=4 86 B6R0.6 CCCCCC=O 3077 [2,0,0,0,0,0|0,0,0]=2 87 B6R0.6 CCCCCCBr 3776 [2,0,0,0,0,0|1,0,0]=3 88 B6R0.6 CCCCCCI 3945 [2,0,0,0,0,0|1,0,0]=3 89 B6R0.6 CCCCNCC 10254 [2,0,0,0,0,0|1,0,0]=3 90 B6R0.6 CCCCOCC 12525 [2,0,0,0,0,0|1,0,0]=3 91 B6R0.6 CCCOCCCl 14348 [2,0,0,0,0,0|2,0,0]=4 92 B6R0.6 CCC\C=C\CO 18917 [2,0,0,0,0,0|1,0,1]=4 93 B6R0.6 CCOCCCO 1937 [2,0,0,0,0,0|2,0,0]=4 94 B6R0.6 COCCCCCl 1935 [2,0,0,0,0,0|2,0,0]=4 95 B6R0.6 COCCCCO 1938 [2,0,0,0,0,0|2,0,0]=4 96 B6R0.6 ClCCCCCBr 15271 [2,0,0,0,0,0|2,0,0]=4 97 B6R0.6 ICCCCCI 3853 [2,0,0,0,0,0|2,0,0]=4 98 B6R0.6 O=CCCCCCl 27418 [2,0,0,0,0,0|1,0,0]=3 99 B6R0.6 OCCCCCBr 22989 [2,0,0,0,0,0|2,0,0]=4 100 B6R0.1 CCOC(=O)CF 23757 [2,0,0,0,0,0|2,0,0]=4 101 B6R0.1 CCOC(=O)CN 10926 [2,0,0,0,0,0|2,0,0]=4 102 B6R0.1 CNCC(=O)OC 10901 [2,0,0,0,0,0|2,0,0]=4 103 B6R0.1 COC(=O)CCBr 19970 [2,0,0,0,0,0|2,0,0]=4 104 B6R0.1 COC(=O)CCN 10900 [2,0,0,0,0,0|2,0,0]=4 105 B6R0.1 O=C(CBr)CCBr 35308 [2,0,0,0,0,0|2,0,0]=4 106 B6R0.4 C=C(C)CNCC 10272 [2,0,0,0,0,0|2,0,0]=4 107 B6R0.4 CC(=O)CCCCl 17207 [2,0,0,0,0,0|1,0,0]=3 108 B6R0.4 CC(=O)NCCN 19141 [2,0,0,0,0,0|2,0,0]=4 109 B6R0.4 CC(=O)OCCBr 19081 [2,0,0,0,0,0|2,0,0]=4 110 B6R0.4 CCCCC(=O)Cl 21358 [2,0,0,0,0,0|1,0,0]=3 111 B6R0.4 CCCCC(=O)[O-] 27064 [2,0,0,0,0,0|1,0,0]=3 112 B6R0.4 CCCC[C@@H](C)N 6753 [2,0,0,0,0,0|1,0,1]=4 113 B6R0.4 CCCC[C@@H](C)O 6730 [2,0,0,0,0,0|0,0,2]=4 114 B6R0.4 CCCC[C@H](C)N 6750 [2,0,0,0,0,0|1,0,1]=4 115 B6R0.4 CCCC[C@H](C)O 6732 [2,0,0,0,0,0|0,0,2]=4 116 B6R0.4 CCNCC(=O)O 23122 [2,0,0,0,0,0|2,0,0]=4 117 B6R0.4 CC\C=C\C(C)=O 32068 [2,0,0,0,0,0|0,0,2]=4 118 B6R0.4 O=C(Cl)CCCCl 32347 [2,0,0,0,0,0|2,0,0]=4 119 B6R0.4 O=C(O)CCCBr 3754 [2,0,0,0,0,0|2,0,0]=4 120 B6R0.4 O=C(O)CCCS 36247 [2,0,0,0,0,0|2,0,0]=4 121 B8R0.4 BrCCCCCCCBr 3887 [1,1,0,0,0,0|1,0,1]=4 122 B8R0.4 C#CCCCCCCC 13060 [1,1,0,0,0,0|0,0,2]=4 123 B8R0.4 CCCCC#CCCO 13072 [1,1,0,0,0,0|0,0,2]=4 124 B8R0.4 CCCCCC#CCO 13066 [1,1,0,0,0,0|0,0,2]=4 125 B8R0.4 CCCCCCCCI 3959 [1,1,0,0,0,0|0,0,1]=3 126 B8R0.4 CCCCC\C=C\CO 18916 [1,1,0,0,0,0|0,0,1]=3 127 B8R0.4 CCCOCCCCCl 1931 [1,1,0,0,0,0|1,0,1]=4 128 B8R0.4 OCCCCCCCO 11489 [1,1,0,0,0,0|1,0,1]=4 129 B8R0.7 CCCCCCC(C)=O 26418 [1,1,0,0,0,0|0,0,2]=4 130 B8R0.7 CCCCCCC(C)O 21480 [1,1,0,0,0,0|0,0,1]=3 131 B8R0.7 CCCCCC[C@@H](C)N 6754 [1,1,0,0,0,0|0,0,1]=3 132 B8R0.7 CCCCCC[C@@H](C)O 6072 [1,1,0,0,0,0|0,0,1]=3 133 B8R0.7 CCCCCC[C@H](C)N 6748 [1,1,0,0,0,0|0,0,1]=3 134 B8R0.7 CCCCCC[C@H](C)O 17259 [1,1,0,0,0,0|0,0,1]=3 135 B8R0.7 CCCCCC[C@H](C)O 6073 [1,1,0,0,0,0|0,0,1]=3 136 B8R0.3 CCC[C@H](N)C(=O)OC 10951 [1,1,0,0,0,0|1,0,0]=3 137 B8R0.3 CCOC(=O)C(=O)CC 24313 [1,1,0,0,0,0|1,0,1]=4 138 B8R0.19 CCC(=O)CC(=O)CC 21961 [1,1,0,0,0,0|0,0,1]=3 139 B8R0.19 CCC(=O)CC(=O)OC 18684 [1,1,0,0,0,0|1,0,1]=4 140 B8R0.19 CC[C@@H](N)CC(=O)OC 23281 [1,1,0,0,0,0|1,0,0]=3 141 B8R0.19 CC[C@H](O)CC(=O)OC 21119 [1,1,0,0,0,0|1,0,0]=3 142 B8R0.19 COC(=O)CC(O)CCl 21114 [1,1,0,0,0,0|2,0,0]=4 143 B8R0.19 COC(=O)C[C@H](O)CBr 15563 [1,1,0,0,0,0|2,0,0]=4 144 B8R0.5 CCOC(=O)CC(C)=O 14160 [1,1,0,0,0,0|1,0,1]=4 145 B8R0.5 COCC(C)OC(C)=O 4049 [1,1,0,0,0,0|2,0,0]=4 146 B8R0.21 CCCCCS(=O)(=O)[O-] 25498 [1,1,0,0,0,0|2,0,0]=4 147 B8R0.28 CC(=O)CCC=C(C)C 35423 [1,1,0,0,0,0|0,0,2]=4 148 B8R0.28 CC(C)CCCC(=O)O 36049 [1,1,0,0,0,0|1,0,0]=3 149 B8R0.28 CN(C)CCCC(=O)O 35953 [1,1,0,0,0,0|2,0,0]=4 150 B10R0.3 CCOC(=O)CCCC(=O)Cl 16647 [0,2,0,0,0,0|1,0,1]=4 151 B10R0.3 CCOC(=O)CCCC(C)=O 27277 [0,2,0,0,0,0|0,0,1]=3 152 B10R0.65 CCC(C)(O)CCCC(C)C 35062 [0,2,0,0,0,0|0,0,2]=4 153 B10R0.1 CCOC(=O)CCCCCBr 3953 [0,2,0,0,0,0|0,0,0]=2 154 B10R0.2 CCOC(=O)CC(=O)OCC 23745 [0,2,0,0,0,0|1,0,1]=4 155 B10R0.2 CCOC(=O)C[C@@H](O)CC#N 21112 [0,2,0,0,0,0|1,0,1]=4 156 B10R0.2 CCOC(=O)C[C@H](O)CC#N 5748 [0,2,0,0,0,0|1,0,1]=4 157 B10R0.6 COCCOC(=O)CC(C)=O 35975 [0,2,0,0,0,0|2,0,0]=4 158 B10R0.19 CCCCC(=O)C(=O)OCC 18138 [0,2,0,0,0,0|0,0,1]=3 159 B10R0.19 CCOC(=O)[C@@H](N)CCSC 14924 [0,2,0,0,0,0|1,0,0]=3 160 B10R0.83 COC(=O)[C@@H](N)CCCCN 18979 [0,2,0,0,0,0|1,0,0]=3 161 B10R0.74 CCCCCC#CC(=O)OC 45055 [0,2,0,0,0,0|1,0,0]=3 162 B8R1.2 BrCC1CCCCC1 3103 [1,0,0,1,0,0|1,0,1]=4 163 B8R1.2 BrCC1CCNCC1 18594 [1,0,0,1,0,0|2,0,0]=4 164 B8R1.2 BrCC1CCOCC1 9559 [1,0,0,1,0,0|2,0,0]=4 165 B8R1.2 CCC1CCCCN1 6758 [1,0,0,1,0,0|1,0,1]=4 166 B8R1.2 CCN1CCCCC1 7713 [1,0,0,1,0,0|1,0,0]=3 167 B8R1.2 CCN1CCNCC1 8562 [1,0,0,1,0,0|2,0,0]=4 168 B8R1.2 CC[C@@H]1CCCCN1 15599 [1,0,0,1,0,0|1,0,1]=4 169 B8R1.2 CC[C@H]1CCCCN1 15598 [1,0,0,1,0,0|1,0,1]=4 170 B8R1.2 CNC1CCOCC1 17652 [1,0,0,1,0,0|2,0,0]=4 171 B8R1.2 COC1CCNCC1 8024 [1,0,0,1,0,0|2,0,0]=4 172 B8R1.2 ClCC1CCCCC1 9647 [1,0,0,1,0,0|1,0,1]=4 173 B8R1.2 NCC1CCCCC1 20540 [1,0,0,1,0,0|1,0,1]=4 174 B8R1.2 NCC1CCNCC1 6720 [1,0,0,1,0,0|2,0,0]=4 175 B8R1.2 NCC1CCOCC1 9707 [1,0,0,1,0,0|2,0,0]=4 176 B8R1.2 NCC1CCOCC1 9728 [1,0,0,1,0,0|2,0,0]=4 177 B8R1.2 OCC1CCCCC1 3098 [1,0,0,1,0,0|1,0,1]=4 178 B8R1.2 OCC1CCNCC1 6777 [1,0,0,1,0,0|2,0,0]=4 179 B8R1.2 OCC1CCNCC1 6819 [1,0,0,1,0,0|2,0,0]=4 180 B8R1.2 OCC1CCOCC1 7872 [1,0,0,1,0,0|2,0,0]=4 181 B8R1.5 CC1CCCCC1O 10840 [1,0,0,1,0,0|1,0,1]=4 182 B8R1.5 CC1CCCNC1C 6756 [1,0,0,1,0,0|1,0,0]=3 183 B8R1.1 O=C1CCC(CO)N1 21689 [1,0,0,1,0,0|2,0,0]=4 184 B8R1.1 O=C1CCC(CO)O1 21691 [1,0,0,1,0,0|2,0,0]=4 185 B8R1.1 O=C1CC[C@@H](CBr)N1 13850 [1,0,0,1,0,0|2,0,0]=4 186 B8R1.1 O=C1CC[C@@H](CO)N1 13847 [1,0,0,1,0,0|2,0,0]=4 187 B8R1.1 O=C1CC[C@@H](CO)O1 7065 [1,0,0,1,0,0|2,0,0]=4 188 B8R1.1 O=C1CC[C@H](CBr)N1 13849 [1,0,0,1,0,0|2,0,0]=4 189 B8R1.1 O=C1CC[C@H](CO)N1 13848 [1,0,0,1,0,0|2,0,0]=4 190 B8R1.1 O=C1CC[C@H](CO)O1 21692 [1,0,0,1,0,0|2,0,0]=4 191 B8R1.1 O=C1C[C@H](CF)CO1 29192 [1,0,0,1,0,0|2,0,0]=4 192 B8R1.3 CN1CCC(=O)CC1 8508 [1,0,0,1,0,0|1,0,0]=3 193 B8R1.3 C[C@H]1CC[C@H](N)CC1 20721 [1,0,0,1,0,0|1,0,1]=4 194 B8R1.3 O=C1CCC(=O)CC1 13686 [1,0,0,1,0,0|1,0,1]=4 195 B8R1.3 O=C1CCC(O)CN1 20072 [1,0,0,1,0,0|2,0,0]=4 196 B8R1.3 O=C1CC[C@@H](O)CN1 20077 [1,0,0,1,0,0|2,0,0]=4 197 B8R1.3 O=C1CC[C@H](O)CN1 20075 [1,0,0,1,0,0|2,0,0]=4 198 B8R1.38 COC(=O)C1CCC1 23839 [1,0,0,1,0,0|1,0,0]=3 199 B8R1.38 COC(=O)C1CCN1 23978 [1,0,0,1,0,0|2,0,0]=4 200 B8R1.38 COC(=O)C1CNC1 18800 [1,0,0,1,0,0|2,0,0]=4 201 B8R1.38 COC(=O)C1CNC1 23516 [1,0,0,1,0,0|2,0,0]=4 202 B8R1.40 NCC(=O)NC1CC1 16649 [1,0,0,1,0,0|2,0,0]=4 203 B8R1.50 CC1C(=O)CCC1=O 2206 [1,0,0,1,0,0|1,0,1]=4 204 B8R1.4 CN1CCNC(=O)C1 23318 [1,0,0,1,0,0|2,0,0]=4 205 B8R1.4 C[C@H]1CCC[C@@H](C)N1 35553 [1,0,0,1,0,0|1,0,1]=4 206 B8R1.4 NC1CCNC(=O)C1 22226 [1,0,0,1,0,0|2,0,0]=4 207 B8R1.4 O=C1CCCC(=O)C1 11104 [1,0,0,1,0,0|1,0,1]=4 208 B8R1.7 CC(=O)C1CCCC1 16480 [1,0,0,1,0,0|0,0,0]=2 209 B8R1.7 NC(=O)[C@@H]1CCCN1 13020 [1,0,0,1,0,0|2,0,0]=4 210 B8R1.7 NC(=O)[C@@H]1CCCN1 5667 [1,0,0,1,0,0|2,0,0]=4 211 B8R1.7 NC(=O)[C@H]1CCCN1 10997 [1,0,0,1,0,0|2,0,0]=4 212 B8R1.7 O=C(Cl)C1CCCC1 13237 [1,0,0,1,0,0|1,0,0]=3 213 B8R1.7 O=C(Cl)C1CCOC1 30317 [1,0,0,1,0,0|2,0,0]=4 214 B8R1.7 O=C(O)C1CCCC1 14153 [1,0,0,1,0,0|1,0,0]=3 215 B8R1.7 O=C(O)C1CCCN1 20613 [1,0,0,1,0,0|2,0,0]=4 216 B8R1.7 O=C(O)C1CCCO1 7088 [1,0,0,1,0,0|2,0,0]=4 217 B8R1.7 O=C(O)C1CCNC1 10439 [1,0,0,1,0,0|2,0,0]=4 218 B8R1.7 O=C(O)C1CCNC1 16223 [1,0,0,1,0,0|2,0,0]=4 219 B8R1.7 O=C(O)C1CCOC1 22077 [1,0,0,1,0,0|2,0,0]=4 220 B8R1.7 O=C(O)[C@@H]1CCCO1 5795 [1,0,0,1,0,0|2,0,0]=4 221 B8R1.7 O=C(O)[C@@H]1CCNC1 11127 [1,0,0,1,0,0|2,0,0]=4 222 B8R1.7 O=C(O)[C@@H]1CCNC1 15979 [1,0,0,1,0,0|2,0,0]=4 223 B8R1.7 O=C(O)[C@H]1CCCN1 10979 [1,0,0,1,0,0|2,0,0]=4 224 B8R1.7 O=C(O)[C@H]1CCCO1 5796 [1,0,0,1,0,0|2,0,0]=4 225 B8R1.7 O=C(O)[C@H]1CCNC1 11126 [1,0,0,1,0,0|2,0,0]=4 226 B8R1.7 O=C(O)[C@H]1CCNC1 15978 [1,0,0,1,0,0|2,0,0]=4 227 B8R1.72 CC1(O)CCCCC1 20381 [1,0,0,1,0,0|0,0,2]=4 228 B8R1.72 CC1(O)CCCCC1 26390 [1,0,0,1,0,0|0,0,2]=4 229 B8R1.72 C[Si]1(C)CCCCC1 27252 [1,0,0,1,0,0|1,1,0]=4 230 B10R1.13 CC(=O)N1CCC(=O)CC1 19615 [0,1,0,1,0,0|1,0,1]=4 231 B10R1.13 CC(C)N1CCC(=O)CC1 8897 [0,1,0,1,0,0|1,0,0]=3 232 B10R1.13 NC(=O)C1CCC(=O)CC1 26304 [0,1,0,1,0,0|1,0,1]=4 233 B10R1.13 O=C1CCC(C(=O)O)CC1 12606 [0,1,0,1,0,0|1,0,1]=4 234 B10R1.14 COC(=O)C1CCC(=O)C1 15798 [0,1,0,1,0,0|1,0,1]=4 235 B10R1.14 COC(=O)[C@@H]1C[C@@H](O)CN1 14917 [0,1,0,1,0,0|2,0,0]=4 236 B10R1.11 CCOC(=O)C1CC=CC1 20010 [0,1,0,1,0,0|0,0,2]=4 237 B10R1.11 CCOC(=O)C1CCCN1 15638 [0,1,0,1,0,0|1,0,0]=3 238 B10R1.11 CCOC(=O)C1CCCO1 7091 [0,1,0,1,0,0|1,0,0]=3 239 B10R1.11 CCOC(=O)C1CCNC1 14291 [0,1,0,1,0,0|1,0,0]=3 240 B10R1.11 CCOC(=O)C1CCNC1 18711 [0,1,0,1,0,0|1,0,0]=3 241 B10R1.11 CCOC(=O)C1CCNC1 20614 [0,1,0,1,0,0|1,0,0]=3 242 B10R1.11 CCOC(=O)[C@H]1CCCN1 45085 [0,1,0,1,0,0|1,0,0]=3 243 B10R1.29 CCCCN1CCCC1=O 9159 [0,1,0,1,0,0|1,0,0]=3 244 B10R1.85 ClCCN1CCCCCC1 21389 [0,1,0,1,0,0|2,0,0]=4 245 B10R1.85 NCCN1CCCCCC1 23366 [0,1,0,1,0,0|2,0,0]=4 246 B10R1.138 CCCC(=O)OC[C@@H]1CO1 5837 [0,1,0,1,0,0|2,0,0]=4 247 B10R1.138 CCCC(=O)OC[C@H]1CO1 5834 [0,1,0,1,0,0|2,0,0]=4 248 B10R1.377 CCCC1(O)CCCCC1 20383 [0,1,0,1,0,0|0,0,2]=4 249 B10R1.7 NC1CCCCCNC1=O 14099 [0,1,0,1,0,0|1,0,0]=3 250 B10R1.15 COC(=O)C1=CCCCC1 11031 [0,1,0,1,0,0|1,0,1]=4 251 B10R1.15 COC(=O)C1CCCCC1 11146 [0,1,0,1,0,0|1,0,0]=3 252 B10R1.15 COC(=O)C1CCCCN1 9441 [0,1,0,1,0,0|1,0,0]=3 253 B10R1.15 COC(=O)C1CCCCO1 19541 [0,1,0,1,0,0|1,0,0]=3 254 B10R1.15 COC(=O)C1CCCNC1 11756 [0,1,0,1,0,0|1,0,0]=3 255 B10R1.15 COC(=O)C1CCNCC1 7745 [0,1,0,1,0,0|1,0,0]=3 256 B10R1.15 COC(=O)C1CCOCC1 9715 [0,1,0,1,0,0|1,0,0]=3 257 B10R1.15 COC(=O)N1CCNCC1 45137 [0,1,0,1,0,0|2,0,0]=4 258 B10R1.15 COC(=O)[C@H]1CCCCN1 24184 [0,1,0,1,0,0|1,0,0]=3 259 B10R1.15 NCC(=O)N1CCCCC1 9268 [0,1,0,1,0,0|1,0,0]=3 260 B10R1.15 O=C(CCl)N1CCCCC1 8026 [0,1,0,1,0,0|1,0,0]=3 261 B10R1.411 COC(=O)C1(N)CCCC1 13876 [0,1,0,1,0,0|1,0,0]=3 262 B10R1.149 COC(=O)C1CCCC1O 17158 [0,1,0,1,0,0|1,0,0]=3 263 B10R1.1 CCCC1CCC(=O)CC1 14023 [0,1,0,1,0,0|0,0,0]=2 264 B10R1.1 CCCN1CCC(=O)CC1 2038 [0,1,0,1,0,0|0,0,0]=2 265 B10R1.1 CCCN1CCC(N)CC1 8022 [0,1,0,1,0,0|1,0,1]=4 266 B10R1.1 CNCC1CCN(C)CC1 16878 [0,1,0,1,0,0|2,0,0]=4 267 B10R1.23 C[C@H](N)C(=S)N1CCCC1 11505 [0,1,0,1,0,0|1,1,0]=4 268 B10R1.23 C[C@H](O)C(=O)N1CCCC1 32044 [0,1,0,1,0,0|1,0,0]=3 269 B10R1.363 CC(C)C1(O)CCCCC1 20241 [0,1,0,1,0,0|0,0,2]=4 270 B10R2.335 O=C1CCC2(CC1)CC2 20286 [0,0,0,2,0,0|0,0,0]=2 271 B10R2.408 B1C2CCCC1CCC2 18188 [0,0,0,2,0,0|1,0,1]=4 272 B10R2.2 NN1CC2CCCC2C1 20719 [0,0,0,2,0,0|2,0,0]=4 273 B10R2.2 NN1CC2CCCC2C1 36121 [0,0,0,2,0,0|2,0,0]=4