0 B8R0.28 CC(=O)CCCC(=O)O SY015106 [0,0,0,0,0,0|3,0,1]=4 1 B8R0.28 CC(=O)CCCC(C)=O SY253771 [0,0,0,0,0,0|2,0,1]=3 2 B8R0.28 CC(=O)CCCN(C)C SY147772 [0,0,0,0,0,0|2,0,0]=2 3 B8R0.28 CC(=O)NCCC(=O)O SY025089 [0,0,0,0,0,0|3,0,1]=4 4 B8R0.28 CC(=O)O[Sr]OC(C)=O SY006682 [0,0,0,0,0,0|3,0,1]=4 5 B8R0.28 CC(C)CCCC(C)N SY264522 [0,0,0,0,0,0|2,0,1]=3 6 B8R0.28 CC(C)CCC[N+](=O)[O-] SY266599 [0,0,0,0,0,0|3,0,0]=3 7 B8R0.28 CC(C)CCOC(=O)Cl SY032117 [0,0,0,0,0,0|1,0,0]=1 8 B8R0.28 CN(C)CCCC(=O)O SY058453 [0,0,0,0,0,0|3,0,0]=3 9 B8R0.28 CN(C)C\C=C\C(=O)O SY030493 [0,0,0,0,0,0|3,0,1]=4 10 B7R0.4 CC(=O)OCCCCl SY106444 [1,0,0,0,0,0|1,0,0]=2 11 B7R0.4 CC(C)CC=CC=O SY298528 [1,0,0,0,0,0|1,0,1]=3 12 B7R0.4 CC(C)CCCCO SY083602 [1,0,0,0,0,0|1,0,2]=4 13 B7R0.4 CC(C)CCCON SY281839 [1,0,0,0,0,0|3,0,0]=4 14 B7R0.4 CC(C)CCCON SY281840 [1,0,0,0,0,0|3,0,0]=4 15 B7R0.4 CCCCCC(N)=O SY051726 [1,0,0,0,0,0|2,0,0]=3 16 B7R0.4 CCCCC[N+](=O)[O-] SY266558 [1,0,0,0,0,0|3,0,0]=4 17 B7R0.4 CCCNCC(C)C SY034221 [1,0,0,0,0,0|2,0,1]=4 18 B7R0.4 CCCOCC(=O)O SY025048 [1,0,0,0,0,0|3,0,0]=4 19 B7R0.4 CNCCCC(=O)O SY032531 [1,0,0,0,0,0|3,0,0]=4 20 B7R0.4 COCCCC(=O)O SY045907 [1,0,0,0,0,0|3,0,0]=4 21 B7R0.4 NC(=O)CCCCBr SY253590 [1,0,0,0,0,0|3,0,0]=4 22 B7R0.4 NC(=O)CCCCCl SY184285 [1,0,0,0,0,0|3,0,0]=4 23 B7R0.4 NCCCCC(=O)O SY002964 [1,0,0,0,0,0|3,0,0]=4 24 B7R0.4 NCCCCC(N)=O SY247757 [1,0,0,0,0,0|3,0,0]=4 25 B7R0.4 O=C(Cl)CCCCF SY270893 [1,0,0,0,0,0|3,0,0]=4 26 B7R0.4 O=C(O)CCCCCl SY051600 [1,0,0,0,0,0|3,0,0]=4 27 B7R0.4 O=C(O)CCCCS SY141369 [1,0,0,0,0,0|3,0,0]=4 28 B7R0.4 O=C([O-])CCCCO SY019284 [1,0,0,0,0,0|3,0,0]=4 29 B9R0.1 COC(=O)CCCC(C)=O SY113736 [0,1,0,0,0,0|2,0,1]=4 30 B9R0.7 C[S+](C)CC[C@@H](N)C(=O)O SY268968 [0,1,0,0,0,0|3,0,0]=4 31 B9R0.7 C[S+](C)CC[C@@H](N)C(=O)O SY268975 [0,1,0,0,0,0|3,0,0]=4 32 B9R0.53 CC(C)C[C@H](N)CC(=O)O SY065306 [0,1,0,0,0,0|2,0,0]=3 33 B9R0.53 CC(C)C[C@H](N)CC(=O)O SY254213 [0,1,0,0,0,0|2,0,0]=3 34 B9R0.56 CC(=O)SCC[N+](C)(C)C SY022189 [0,1,0,0,0,0|1,1,0]=3 35 B9R1.35 CC(=O)N1CCC(N)C1 SY005627 [0,0,0,1,0,0|2,0,0]=3 36 B9R1.35 CC(=O)N1CCC(O)C1 SY012351 [0,0,0,1,0,0|2,0,0]=3 37 B9R1.35 CC(=O)N1CC[C@@H](O)C1 SY005003 [0,0,0,1,0,0|2,0,0]=3 38 B9R1.35 CC(=O)N1CC[C@H](O)C1 SY005004 [0,0,0,1,0,0|2,0,0]=3 39 B9R1.35 CC(C)[C@@H]1COC(=O)N1 SY021565 [0,0,0,1,0,0|1,0,0]=2 40 B9R1.35 CC(C)[C@H]1COC(=O)N1 SY007944 [0,0,0,1,0,0|1,0,0]=2 41 B9R1.35 CN1CCC(C(=O)O)C1 SY019266 [0,0,0,1,0,0|3,0,0]=4 42 B9R1.35 CN1CCC(C(=O)O)C1 SY020059 [0,0,0,1,0,0|3,0,0]=4 43 B9R1.35 C[C@@H]1CN[C@H](C(=O)O)C1 SY258090 [0,0,0,1,0,0|3,0,0]=4 44 B9R1.35 NC1CCC(C(=O)O)C1 SY006149 [0,0,0,1,0,0|3,0,0]=4 45 B9R1.35 N[C@@H]1CC[C@H](C(=O)O)C1 SY025607 [0,0,0,1,0,0|3,0,0]=4 46 B9R1.35 N[C@@H]1CC[C@H](C(=O)O)C1 SY029549 [0,0,0,1,0,0|3,0,0]=4 47 B9R1.35 N[C@H]1CC[C@@H](C(=O)O)C1 SY016353 [0,0,0,1,0,0|3,0,0]=4 48 B9R1.49 CN1CCCC(=O)CC1 SY002715 [0,0,0,1,0,0|2,0,0]=3 49 B9R1.49 CN1CCNC(=O)CC1 SY022083 [0,0,0,1,0,0|2,0,0]=3 50 B9R1.53 CC(=O)OC1CC(=O)C1 SY025795 [0,0,0,1,0,0|1,0,1]=3 51 B9R1.66 CC1(C)CC(=O)CCN1 SY030979 [0,0,0,1,0,0|2,0,0]=3 52 B9R1.66 CC1(C)CC(=O)CCO1 SY006372 [0,0,0,1,0,0|2,0,0]=3 53 B9R1.66 CC1(C)CC(N)CCO1 SY022790 [0,0,0,1,0,0|2,0,1]=4 54 B9R1.66 CC1(C)CC(O)CCO1 SY023965 [0,0,0,1,0,0|2,0,1]=4 55 B9R1.66 CC1(C)CCCC(N)C1 SY143191 [0,0,0,1,0,0|2,0,1]=4 56 B9R1.66 CC1(C)CCCC(N)C1 SY310009 [0,0,0,1,0,0|2,0,1]=4 57 B9R1.66 CC1(C)COCC(=O)N1 SY045284 [0,0,0,1,0,0|3,0,0]=4 58 B9R1.66 CC1(O)CCOC(=O)C1 SY032939 [0,0,0,1,0,0|1,0,0]=2 59 B9R1.85 O=C(O)CCNC1CC1 SY034664 [0,0,0,1,0,0|3,0,0]=4 60 B7R0.6 CC(=O)CCC(N)=O SY273013 [0,0,0,0,1,0|2,0,1]=4 61 B7R0.6 CC(=O)OCC(C)O SY272306 [0,0,0,0,1,0|1,0,0]=2 62 B7R0.6 CC(C)CCB(O)O SY024043 [0,0,0,0,1,0|2,0,1]=4 63 B7R0.6 CC(C)CCC(=O)O SY001693 [0,0,0,0,1,0|1,0,0]=2 64 B7R0.6 CC(C)CCC(C)Br SY016753 [0,0,0,0,1,0|1,0,1]=3 65 B7R0.6 CC(C)CC[N+](=O)[O-] SY224455 [0,0,0,0,1,0|2,0,0]=3 66 B7R0.6 CC(Cl)CCC(=O)Cl SY027798 [0,0,0,0,1,0|2,0,0]=3 67 B7R0.6 CC(O)CCC(=O)[O-] SY159293 [0,0,0,0,1,0|2,0,0]=3 68 B7R0.6 CN(C)CCC(=O)O SY031864 [0,0,0,0,1,0|2,0,0]=3 69 B7R0.6 C[C@@H](N)CCC(=O)O SY297613 [0,0,0,0,1,0|2,0,0]=3 70 B7R0.6 C[C@H](N)CCC(=O)O SY297612 [0,0,0,0,1,0|2,0,0]=3 71 B9R0.55 CC(=O)NCCCN(C)C SY028365 [0,0,0,0,0,1|2,0,0]=3 72 B9R0.55 CC(C)=CCCCC(=O)O SY253607 [0,0,0,0,0,1|2,0,1]=4 73 B9R0.55 CC(C)NCCCN(C)C SY270832 [0,0,0,0,0,1|3,0,0]=4 74 B9R0.55 CN(C)CCCCC(=O)O SY018643 [0,0,0,0,0,1|3,0,0]=4 75 B9R0.55 CN(C)CCCCC(=O)O SY019232 [0,0,0,0,0,1|3,0,0]=4 76 B6R0.4 C=CCC[C@H](C)O SY307699 [2,0,0,0,0,0|1,0,1]=4 77 B6R0.4 CC(=O)CCCO SY002852 [2,0,0,0,0,0|1,0,0]=3 78 B6R0.4 CC(=O)NCCN SY313725 [2,0,0,0,0,0|2,0,0]=4 79 B6R0.4 CC(C)CCCO SY016761 [2,0,0,0,0,0|0,0,2]=4 80 B6R0.4 CC(C)CCNN SY048082 [2,0,0,0,0,0|2,0,0]=4 81 B6R0.4 CC(C)CCON SY045359 [2,0,0,0,0,0|1,0,0]=3 82 B6R0.4 CC(C)CCON SY281670 [2,0,0,0,0,0|1,0,0]=3 83 B6R0.4 CC(C)OCC=O SY269035 [2,0,0,0,0,0|1,0,0]=3 84 B6R0.4 CCCCC(=N)N SY020380 [2,0,0,0,0,0|2,0,0]=4 85 B6R0.4 CCCCC(=N)N SY020382 [2,0,0,0,0,0|2,0,0]=4 86 B6R0.4 CCCOC(N)=O SY114484 [2,0,0,0,0,0|1,0,0]=3 87 B6R0.4 CN(C)CCC=O SY022382 [2,0,0,0,0,0|1,0,0]=3 88 B6R0.4 CNCCC(=O)O SY005345 [2,0,0,0,0,0|2,0,0]=4 89 B6R0.4 CNCCC(=O)O SY112486 [2,0,0,0,0,0|2,0,0]=4 90 B6R0.4 COCCC(=O)O SY028921 [2,0,0,0,0,0|2,0,0]=4 91 B6R0.4 NCCCC(N)=O SY174709 [2,0,0,0,0,0|2,0,0]=4 92 B6R0.4 O=C(O)CCCBr SY001501 [2,0,0,0,0,0|2,0,0]=4 93 B6R0.6 CCCCOCCl SY264650 [2,0,0,0,0,0|1,0,1]=4 94 B6R0.6 C\C=C\CCCO SY066633 [2,0,0,0,0,0|2,0,0]=4 95 B6R0.6 O=CCCCCCl SY024458 [2,0,0,0,0,0|2,0,0]=4 96 B6R0.6 O=CCCCCO SY047027 [2,0,0,0,0,0|2,0,0]=4 97 B6R0.6 O=CNCCCO SY261924 [2,0,0,0,0,0|2,0,0]=4 98 B8R0.5 CCCC(C)OC(=O)Cl SY285574 [1,1,0,0,0,0|1,0,0]=3 99 B8R0.6 CCC\C=C\C(=O)OC SY015809 [1,1,0,0,0,0|1,0,1]=4 100 B8R0.6 CCNCCC(=O)OC SY019881 [1,1,0,0,0,0|2,0,0]=4 101 B8R0.6 COC(=O)CCCCBr SY013898 [1,1,0,0,0,0|2,0,0]=4 102 B8R0.6 COC(=O)CCCCN SY117564 [1,1,0,0,0,0|2,0,0]=4 103 B8R0.6 COCCCC(=O)OC SY096667 [1,1,0,0,0,0|2,0,0]=4 104 B8R0.7 CC(=O)OCCCCBr SY048653 [1,1,0,0,0,0|0,0,0]=2 105 B8R0.7 CC(=O)OCCCCO SY294143 [1,1,0,0,0,0|0,0,0]=2 106 B8R0.7 CC(=O)SCCCCN SY290150 [1,1,0,0,0,0|0,1,0]=3 107 B8R0.7 CCCCOCC(=O)O SY002472 [1,1,0,0,0,0|1,0,0]=3 108 B8R0.7 COCCOCC(=O)O SY035294 [1,1,0,0,0,0|2,0,0]=4 109 B8R0.7 NC(=O)CCCCCBr SY103908 [1,1,0,0,0,0|2,0,0]=4 110 B8R0.7 NC(=O)CCCCCO SY247977 [1,1,0,0,0,0|2,0,0]=4 111 B8R0.7 NCCCCCC(=O)O SY003109 [1,1,0,0,0,0|2,0,0]=4 112 B8R0.7 NCCCCCC(N)=O SY247974 [1,1,0,0,0,0|2,0,0]=4 113 B8R0.7 O=C(O)CCCCCCl SY053214 [1,1,0,0,0,0|2,0,0]=4 114 B8R0.7 O=C(O)CCCCCO SY032043 [1,1,0,0,0,0|2,0,0]=4 115 B8R0.7 O=C([O-])CCCCCO SY121174 [1,1,0,0,0,0|2,0,0]=4 116 B8R0.8 CCCCC(N)C(=O)O SY038236 [1,1,0,0,0,0|2,0,0]=4 117 B8R0.8 CCCC[C@@H](N)C(=O)O SY062052 [1,1,0,0,0,0|2,0,0]=4 118 B8R0.8 CCCC[C@H](N)C(=O)O SY036145 [1,1,0,0,0,0|2,0,0]=4 119 B8R0.9 CCC(C)COC(=O)Cl SY036985 [1,1,0,0,0,0|1,0,0]=3 120 B8R0.9 CCC(Cl)CCC(=O)Cl SY027792 [1,1,0,0,0,0|2,0,0]=4 121 B8R0.21 CCCCOS(C)(=O)=O SY058921 [1,1,0,0,0,0|1,0,0]=3 122 B8R0.21 COCCOS(C)(=O)=O SY055164 [1,1,0,0,0,0|2,0,0]=4 123 B8R0.23 CC(=O)CC(=O)C(C)C SY021087 [0,1,0,0,1,0|0,0,1]=3 124 B8R0.23 CC(C)C(N)CC(=O)O SY016724 [0,1,0,0,1,0|1,0,0]=3 125 B8R0.23 CC(C)CC(N)C(=O)O SY006365 [0,1,0,0,1,0|1,0,0]=3 126 B8R0.23 CC(C)C[C@@H](N)C(=O)O SY033229 [0,1,0,0,1,0|1,0,0]=3 127 B8R0.23 CC(C)C[C@@H](O)C(=O)O SY066416 [0,1,0,0,1,0|1,0,0]=3 128 B8R0.23 CC(C)C[C@H](N)C(=O)O SY005863 [0,1,0,0,1,0|1,0,0]=3 129 B8R0.23 CC(C)C[C@H](O)C(=O)O SY066744 [0,1,0,0,1,0|1,0,0]=3 130 B8R0.23 CC(C)[C@@H](N)CC(=O)O SY064256 [0,1,0,0,1,0|1,0,0]=3 131 B8R0.23 CC(C)[C@H](N)CC(=O)O SY077258 [0,1,0,0,1,0|1,0,0]=3 132 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O SY254067 [0,1,0,0,1,0|2,0,0]=4 133 B8R0.29 CC(=O)CCC(C)(C)C SY200187 [0,1,0,0,1,0|0,0,0]=2 134 B8R0.29 CC(C)(C)CC[N+](=O)[O-] SY266553 [0,1,0,0,1,0|2,0,0]=4 135 B8R0.29 CC(C)(C)NCC(=O)O SY045863 [0,1,0,0,1,0|2,0,0]=4 136 B8R0.29 CC(C)(C)OCC(=O)O SY040142 [0,1,0,0,1,0|2,0,0]=4 137 B8R0.29 CC(C)(O)CC[N+](=O)[O-] SY266613 [0,1,0,0,1,0|2,0,0]=4 138 B10R0.96 CC(=O)CC(=O)OCC(C)C SY052364 [0,1,0,0,0,1|1,0,1]=4 139 B10R0.98 CC(=O)OCCC(Cl)C(C)=O SY019538 [0,1,0,0,0,1|1,0,1]=4 140 B10R0.3 CC(C)=CCC[C@H](C)CCO SY066737 [0,2,0,0,0,0|2,0,0]=4 141 B10R0.57 CNC(=O)[C@@H](N)CCC(C)C SY290103 [0,2,0,0,0,0|1,0,0]=3 142 B10R0.77 CCN(CC)CCCC(C)=O SY113877 [0,2,0,0,0,0|2,0,0]=4 143 B10R0.31 CC(C[N+](C)(C)C)OC(N)=O SY112089 [0,2,0,0,0,0|2,0,0]=4 144 B8R1.1 CCC1CCC(=O)O1 SY015382 [1,0,0,1,0,0|2,0,0]=4 145 B8R1.1 NCC1COC(=O)N1 SY040257 [1,0,0,1,0,0|2,0,0]=4 146 B8R1.1 O=C1CC(CBr)CN1 SY205276 [1,0,0,1,0,0|2,0,0]=4 147 B8R1.1 O=C1CC(CO)CN1 SY008749 [1,0,0,1,0,0|2,0,0]=4 148 B8R1.1 O=C1NC(CO)CO1 SY038213 [1,0,0,1,0,0|2,0,0]=4 149 B8R1.1 O=C1N[C@@H](CO)CO1 SY284529 [1,0,0,1,0,0|2,0,0]=4 150 B8R1.1 O=C1N[C@H](CO)CO1 SY251331 [1,0,0,1,0,0|2,0,0]=4 151 B8R1.1 O=C1OCC(CO)O1 SY037075 [1,0,0,1,0,0|2,0,0]=4 152 B8R1.4 CC1CC(O)CCO1 SY023229 [1,0,0,1,0,0|1,0,1]=4 153 B8R1.4 CC1CCCC(=O)N1 SY033090 [1,0,0,1,0,0|2,0,0]=4 154 B8R1.4 CC1CCCC(=O)O1 SY048899 [1,0,0,1,0,0|2,0,0]=4 155 B8R1.4 CC1CCNC(=O)C1 SY033089 [1,0,0,1,0,0|1,0,0]=3 156 B8R1.4 CN1CCCC(=O)C1 SY023480 [1,0,0,1,0,0|2,0,0]=4 157 B8R1.4 C[C@@H]1CC(=O)CCN1 SY259242 [1,0,0,1,0,0|2,0,0]=4 158 B8R1.4 C[C@H]1CC(=O)CCN1 SY234011 [1,0,0,1,0,0|2,0,0]=4 159 B8R1.4 C[C@H]1CCCC(=O)C1 SY290780 [1,0,0,1,0,0|1,0,0]=3 160 B8R1.4 NC1CCNC(=O)C1 SY098707 [1,0,0,1,0,0|2,0,0]=4 161 B8R1.4 O=C1CC(O)CCN1 SY029027 [1,0,0,1,0,0|2,0,0]=4 162 B8R1.4 O=C1C[C@H](O)CCN1 SY238615 [1,0,0,1,0,0|2,0,0]=4 163 B8R1.7 CC(=O)C1CCCC1 SY035519 [1,0,0,1,0,0|1,0,0]=3 164 B8R1.19 CC1(C)CC=CC1=O SY262050 [1,0,0,1,0,0|1,0,1]=4 165 B8R1.19 CC1(C)CCNC1=O SY067839 [1,0,0,1,0,0|1,0,0]=3 166 B8R1.19 CC1(C)CCOC1=O SY029932 [1,0,0,1,0,0|0,0,0]=2 167 B8R1.19 CC1(C)CONC1=O SY267935 [1,0,0,1,0,0|2,0,0]=4 168 B8R1.22 O=C1C=CCCCC1 SY041083 [1,0,0,1,0,0|1,0,1]=4 169 B8R1.22 O=C1CCCCNC1 SY040205 [1,0,0,1,0,0|2,0,0]=4 170 B8R1.22 O=C1CCCNCC1 SY017922 [1,0,0,1,0,0|2,0,0]=4 171 B8R1.22 O=C1CCCOCC1 SY036485 [1,0,0,1,0,0|2,0,0]=4 172 B8R1.22 O=C1CCNCCN1 SY019808 [1,0,0,1,0,0|2,0,0]=4 173 B8R1.22 O=C1CCNCCN1 SY075066 [1,0,0,1,0,0|2,0,0]=4 174 B8R1.22 O=C1CCOCCN1 SY029460 [1,0,0,1,0,0|2,0,0]=4 175 B8R1.22 O=C1CNCCCN1 SY032801 [1,0,0,1,0,0|2,0,0]=4 176 B8R1.22 OC1CCCOCC1 SY036492 [1,0,0,1,0,0|1,0,1]=4 177 B8R1.34 O=C(O)CC1CCC1 SY011888 [1,0,0,1,0,0|2,0,0]=4 178 B8R1.35 O=C(Cl)OCC1CC1 SY248050 [1,0,0,1,0,0|1,0,0]=3 179 B8R1.35 O=C(O)CCC1CC1 SY042777 [1,0,0,1,0,0|2,0,0]=4 180 B8R1.72 CC1(Br)CCOCC1 SY232990 [1,0,0,1,0,0|1,0,1]=4 181 B8R1.72 CC1(C)CCNCC1 SY023190 [1,0,0,1,0,0|1,0,1]=4 182 B8R1.72 CC1(C)CCNCC1 SY025578 [1,0,0,1,0,0|1,0,1]=4 183 B8R1.72 CC1(N)CCOCC1 SY025330 [1,0,0,1,0,0|1,0,1]=4 184 B8R1.72 CC1(O)CCOCC1 SY110761 [1,0,0,1,0,0|1,0,1]=4 185 B8R1.72 O=S1(=O)CCCCO1 SY006382 [1,0,0,1,0,0|2,0,0]=4 186 B8R1.3 CC1C=CC(=O)CC1 SY100224 [0,0,0,1,1,0|0,0,2]=4 187 B8R1.3 CC1CNC(=O)CO1 SY032981 [0,0,0,1,1,0|2,0,0]=4 188 B8R1.3 C[C@H]1CC[C@@H](N)CC1 SY235531 [0,0,0,1,1,0|1,0,1]=4 189 B8R1.3 C[C@H]1CC[C@H](N)CC1 SY022606 [0,0,0,1,1,0|1,0,1]=4 190 B8R1.3 C[C@H]1CC[C@H](N)CC1 SY025288 [0,0,0,1,1,0|1,0,1]=4 191 B8R1.3 C[C@H]1CC[C@H](O)CC1 SY043391 [0,0,0,1,1,0|0,0,2]=4 192 B8R1.3 NC1CCC(=O)CC1 SY017243 [0,0,0,1,1,0|1,0,0]=3 193 B8R1.3 NC1CCC(=O)NC1 SY022821 [0,0,0,1,1,0|2,0,0]=4 194 B8R1.3 N[C@@H]1CCC(=O)NC1 SY036453 [0,0,0,1,1,0|2,0,0]=4 195 B8R1.3 O=C1CCC(=O)CC1 SY002914 [0,0,0,1,1,0|1,0,1]=4 196 B8R1.3 O=C1CCC(Br)CC1 SY275581 [0,0,0,1,1,0|1,0,0]=3 197 B8R1.3 O=C1CCC(O)CC1 SY005938 [0,0,0,1,1,0|1,0,0]=3 198 B8R1.3 O=C1CCC(O)CN1 SY034611 [0,0,0,1,1,0|2,0,0]=4 199 B8R1.3 O=C1CC[C@H](O)CN1 SY107535 [0,0,0,1,1,0|2,0,0]=4 200 B8R1.23 CC(=O)N1CC(N)C1 SY099776 [0,0,0,1,1,0|2,0,0]=4 201 B8R1.23 CC(=O)N1CC(O)C1 SY005005 [0,0,0,1,1,0|2,0,0]=4 202 B8R1.23 CC1CC(C(=O)O)C1 SY042063 [0,0,0,1,1,0|1,0,0]=3 203 B8R1.23 CN1CC(C(=O)Cl)C1 SY247770 [0,0,0,1,1,0|2,0,0]=4 204 B8R1.23 CN1CC(C(=O)O)C1 SY097022 [0,0,0,1,1,0|2,0,0]=4 205 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 SY026883 [0,0,0,1,1,0|2,0,0]=4 206 B8R1.23 N[C@H]1C[C@H](C(=O)O)C1 SY026884 [0,0,0,1,1,0|2,0,0]=4 207 B8R1.23 O=C(O)C1CC(Cl)C1 SY024876 [0,0,0,1,1,0|2,0,0]=4 208 B8R1.23 O=C(O)C1CC(O)C1 SY098700 [0,0,0,1,1,0|2,0,0]=4 209 B8R1.23 O=C(O)[C@H]1C[C@@H](O)C1 SY042433 [0,0,0,1,1,0|2,0,0]=4 210 B8R1.23 O=C(O)[C@H]1C[C@H](O)C1 SY042435 [0,0,0,1,1,0|2,0,0]=4 211 B8R1.51 CC1(C)CCC(=O)C1 SY043145 [0,0,0,1,1,0|0,0,0]=2 212 B8R1.51 CC1(C)CCC(=O)N1 SY023743 [0,0,0,1,1,0|1,0,0]=3 213 B8R1.51 CC1(C)CNC(=O)C1 SY015235 [0,0,0,1,1,0|1,0,0]=3 214 B8R1.51 CC1(C)CNC(=O)N1 SY273056 [0,0,0,1,1,0|2,0,0]=4 215 B8R1.51 CC1COS(=O)(=O)C1 SY264357 [0,0,0,1,1,0|2,0,0]=4 216 B8R1.51 CN1CCC(C)(C)C1 SY275505 [0,0,0,1,1,0|2,0,0]=4 217 B8R1.77 CC1(C)CC1C(N)=O SY284377 [0,0,0,1,1,0|1,0,0]=3 218 B8R1.77 CC1(C)C[C@@H]1C(=O)O SY108102 [0,0,0,1,1,0|1,0,0]=3 219 B8R1.77 CC1(C)C[C@@H]1C(N)=O SY042583 [0,0,0,1,1,0|1,0,0]=3 220 B8R1.77 CC1(C)OC1C(=O)O SY224321 [0,0,0,1,1,0|2,0,0]=4 221 B10R1.54 CC(=O)O[C@H]1C=C[C@@H](O)C1 SY096978 [0,0,0,1,0,1|1,0,1]=4 222 B10R1.54 CC(=O)O[C@H]1C=C[C@H](O)C1 SY291850 [0,0,0,1,0,1|1,0,1]=4 223 B10R1.54 CC(C)C[C@H]1COC(=O)N1 SY037850 [0,0,0,1,0,1|1,0,0]=3 224 B10R1.113 CC(=O)N1CCCC(N)C1 SY006435 [0,0,0,1,0,1|2,0,0]=4 225 B10R1.113 CC(C)C1CCCC(=O)C1 SY163056 [0,0,0,1,0,1|1,0,0]=3 226 B10R1.13 CC(=O)N1CCC(N)CC1 SY005622 [0,1,0,1,0,0|2,0,0]=4 227 B10R1.13 CC(=O)N1CCC(N)CC1 SY022645 [0,1,0,1,0,0|2,0,0]=4 228 B10R1.13 CC(=O)N1CCN(C)CC1 SY032062 [0,1,0,1,0,0|2,0,0]=4 229 B10R1.13 CC1CCC(C(=O)O)CC1 SY113256 [0,1,0,1,0,0|2,0,0]=4 230 B10R1.13 CN(C)C1CCC(=O)CC1 SY017445 [0,1,0,1,0,0|2,0,0]=4 231 B10R1.13 C[C@H]1CC[C@H](C(=O)O)CC1 SY066773 [0,1,0,1,0,0|2,0,0]=4 232 B10R1.14 COC(=O)C1CCC(N)C1 SY021245 [0,1,0,1,0,0|2,0,0]=4 233 B10R1.14 COC(=O)[C@@H]1CC[C@H](N)C1 SY029550 [0,1,0,1,0,0|2,0,0]=4 234 B10R1.14 COC(=O)[C@@H]1C[C@H](C)CN1 SY246556 [0,1,0,1,0,0|2,0,0]=4 235 B10R1.153 COC(=O)CCNC1CC1 SY029092 [0,1,0,1,0,0|2,0,0]=4 236 B10R1.302 O=C1CCCC(F)(F)CC1 SY262536 [0,1,0,1,0,0|2,0,0]=4 237 B10R1.349 CC(C)C1CC(C(=O)O)C1 SY259355 [0,1,0,1,0,0|2,0,0]=4 238 B10R1.59 CC(C)C1NC(=O)OC1=O SY007692 [0,1,0,1,0,0|1,0,1]=4 239 B10R1.59 CC(C)[C@@H]1NC(=O)OC1=O SY062319 [0,1,0,1,0,0|1,0,1]=4 240 B10R1.59 CC(C)[C@H]1NC(=O)OC1=O SY225255 [0,1,0,1,0,0|1,0,1]=4 241 B10R1.329 CC1(C)CC(=O)CC(=O)C1 SY010547 [0,1,0,1,0,0|1,0,1]=4 242 B10R1.329 CC1(C)CC(=O)NC(=O)C1 SY047201 [0,1,0,1,0,0|1,0,1]=4 243 B10R2.178 O=C1NCC2CCC1C2 SY288304 [0,0,0,2,0,0|2,0,0]=4 244 B10R2.365 O=C(O)CC12CC(C1)C2 SY099408 [0,0,0,2,0,0|2,0,0]=4 245 B10R2.534 O=C1CCCC2(CC2)C1 SY100211 [0,0,0,2,0,0|1,0,0]=3 246 B6R0.2 CC(=O)NC(C)C SY107538 [0,0,0,0,2,0|1,0,0]=3 247 B6R0.2 CC(=O)OC(C)Br SY067153 [0,0,0,0,2,0|1,0,0]=3 248 B6R0.2 CC(Cl)CC(=O)Cl SY222037 [0,0,0,0,2,0|2,0,0]=4 249 B6R0.2 CC(N)CC(=O)O SY022577 [0,0,0,0,2,0|2,0,0]=4 250 B6R0.2 CN(C)CC(=O)O SY001194 [0,0,0,0,2,0|2,0,0]=4 251 B6R0.2 CN(C)CC(=O)O SY005006 [0,0,0,0,2,0|2,0,0]=4 252 B6R0.2 C[C@@H](N)CC(=O)O SY019803 [0,0,0,0,2,0|2,0,0]=4 253 B6R0.2 C[C@@H](N)CC(=O)O SY025783 [0,0,0,0,2,0|2,0,0]=4 254 B6R0.2 C[C@@H](O)CC(=O)[O-] SY107283 [0,0,0,0,2,0|2,0,0]=4 255 B6R0.2 C[C@H](N)CC(=O)O SY022578 [0,0,0,0,2,0|2,0,0]=4 256 B6R0.2 C[C@H](N)CC(=O)O SY025782 [0,0,0,0,2,0|2,0,0]=4