0 B6R0.1 C=COC(=O)CC 7389AF [0,0,0,0,0,0|2,0,1]=3 1 B6R0.1 CCC(=O)CC#N 0486AE [0,0,0,0,0,0|2,0,0]=2 2 B6R0.1 CCC(O)COC 4893AL [0,0,0,0,0,0|0,1,2]=3 3 B6R0.1 CCCC(C)CCl 4812AL [0,0,0,0,0,0|3,0,1]=4 4 B6R0.1 CCC\C(N)=N\O 8990AD [0,0,0,0,0,0|4,0,0]=4 5 B6R0.1 CCNC(=O)CC 8553AL [0,0,0,0,0,0|2,0,0]=2 6 B6R0.1 CCOC(=O)CI 7240AF [0,0,0,0,0,0|3,0,0]=3 7 B6R0.1 CCOC(=O)NO 6247AE [0,0,0,0,0,0|4,0,0]=4 8 B6R0.1 CCOC(=O)OC 7884AL [0,0,0,0,0,0|3,0,0]=3 9 B6R0.1 CNC(=O)CCN 4757AE [0,0,0,0,0,0|3,0,0]=3 10 B6R0.1 COC(=O)C#CBr 1628AB [0,0,0,0,0,0|3,0,1]=4 11 B6R0.1 COC(=O)OCCl 0229AP [0,0,0,0,0,0|4,0,0]=4 12 B6R0.1 COC(=O)\C=C\I 9331AB [0,0,0,0,0,0|3,0,1]=4 13 B6R0.1 C\C=C\C(=O)CC 2730AL [0,0,0,0,0,0|1,0,1]=2 14 B5R0.1 C=C(C)CCBr Z4377 [1,0,0,0,0,0|3,0,0]=4 15 B5R0.1 C=C(C)CCC 5700AL [1,0,0,0,0,0|2,0,0]=3 16 B5R0.1 C=CNC(C)=O 8689AL [1,0,0,0,0,0|2,0,1]=4 17 B5R0.1 CNCC(=O)O 9764AB [1,0,0,0,0,0|2,0,0]=3 18 B5R0.1 CNOC(C)=O 8699AL [1,0,0,0,0,0|2,0,0]=3 19 B5R0.1 COCC(=N)N W4095 [1,0,0,0,0,0|2,1,0]=4 20 B5R0.1 COCC(C)=O U020 [1,0,0,0,0,0|0,1,0]=2 21 B5R0.1 COCC(C)N 0442AC [1,0,0,0,0,0|1,1,1]=4 22 B5R0.1 COC[C@@H](C)N W7467 [1,0,0,0,0,0|1,1,1]=4 23 B5R0.1 CSC=[N+](C)C 8446AL [1,0,0,0,0,0|2,0,1]=4 24 B5R0.1 CSCC(C)=O Y1373 [1,0,0,0,0,0|0,0,0]=1 25 B5R0.1 CSCS(C)=O E772 [1,0,0,0,0,0|1,0,0]=2 26 B5R0.1 NCCC(N)=O 6432AB [1,0,0,0,0,0|3,0,0]=4 27 B5R0.1 O=C(O)CCI 7031AF [1,0,0,0,0,0|3,0,0]=4 28 B5R0.2 CC#CCCC 7448AF [1,0,0,0,0,0|1,0,2]=4 29 B5R0.2 CCCCON 7308AJ [1,0,0,0,0,0|1,1,1]=4 30 B5R0.2 CCCSSC 8846AJ [1,0,0,0,0,0|1,0,1]=3 31 B5R0.2 CC\C=C/CC 7431AL [1,0,0,0,0,0|1,0,1]=3 32 B5R0.2 CC\C=C/CO 3214AL [1,0,0,0,0,0|2,0,1]=4 33 B5R0.2 CC\C=C\CC 3771AD [1,0,0,0,0,0|1,0,1]=3 34 B5R0.2 CNCCSC 7146AJ [1,0,0,0,0,0|1,0,1]=3 35 B5R0.2 C\C=C\C=C\C 5333AL [1,0,0,0,0,0|1,0,2]=4 36 B5R0.3 C=CC(=O)NC 3091AA [1,0,0,0,0,0|1,0,2]=4 37 B5R0.3 CCC(=O)NC 7273AF [1,0,0,0,0,0|1,0,0]=2 38 B5R0.3 CCC(=O)NN 6023AE [1,0,0,0,0,0|2,0,0]=3 39 B5R0.3 CCC(C)CC 6117AL [1,0,0,0,0,0|1,0,1]=3 40 B5R0.3 CCC(C)CI 4886AL [1,0,0,0,0,0|2,0,1]=4 41 B5R0.3 CCC(C)NC 9511AE [1,0,0,0,0,0|2,0,1]=4 42 B5R0.3 CCC(O)CN 6349AA [1,0,0,0,0,0|1,0,2]=4 43 B5R0.3 CCN(C)CC 7490AH [1,0,0,0,0,0|2,0,0]=3 44 B5R0.3 CC[C@H](O)CO 1422AC [1,0,0,0,0,0|0,1,2]=4 45 B5R0.3 CC\C(N)=N\O 9295AD [1,0,0,0,0,0|2,1,0]=4 46 B5R0.3 COS(=O)OC 6871AF [1,0,0,0,0,0|2,1,0]=4 47 B5R0.3 CS\C(O)=[SH]/C K552 [1,0,0,0,0,0|1,0,1]=3 48 B5R0.3 NNC(=O)CO 4389AB [1,0,0,0,0,0|2,1,0]=4 49 B5R0.3 OCC(S)CS F878 [1,0,0,0,0,0|1,1,1]=4 50 B7R0.2 CC(C)NC(=O)CN 6712AE [0,1,0,0,0,0|3,0,0]=4 51 B7R0.2 CC(C)OC(=O)CN Y6052 [0,1,0,0,0,0|3,0,0]=4 52 B7R0.2 CCC(=O)CC(C)C 9385AB [0,1,0,0,0,0|1,0,0]=2 53 B7R0.2 CCC(=O)OC(C)C 7522AF [0,1,0,0,0,0|2,0,0]=3 54 B7R0.2 CNC(=O)NC(C)=O 7251AF [0,1,0,0,0,0|3,0,0]=4 55 B7R0.2 COC(=O)CC(C)C 8842AJ [0,1,0,0,0,0|2,0,0]=3 56 B7R0.2 COC(=O)CN(C)C X7323 [0,1,0,0,0,0|2,0,0]=3 57 B7R0.3 C=CCNC(=O)CCl U937 [0,1,0,0,0,0|2,0,1]=4 58 B7R0.3 C=CCOC(=O)OC Z3261 [0,1,0,0,0,0|2,0,1]=4 59 B7R0.3 CCCCC(=O)CC 7786AF [0,1,0,0,0,0|1,0,0]=2 60 B7R0.3 CCCCC(=O)NN X5269 [0,1,0,0,0,0|3,0,0]=4 61 B7R0.3 CCCCC(Br)CC 6006AL [0,1,0,0,0,0|2,0,1]=4 62 B7R0.3 CCCNC(=O)CN V6930 [0,1,0,0,0,0|2,0,0]=3 63 B7R0.3 CCCOC(=O)CBr U694 [0,1,0,0,0,0|2,0,0]=3 64 B7R0.3 CCCOC(=O)CC 7524AF [0,1,0,0,0,0|1,0,0]=2 65 B7R0.3 COC(=O)CCCN 3563AL [0,1,0,0,0,0|2,0,0]=3 66 B7R0.3 COC(=O)CN=C=S 7159AD [0,1,0,0,0,0|2,0,1]=4 67 B7R0.3 COC(=O)CNC=O 3413AB [0,1,0,0,0,0|2,0,1]=4 68 B7R0.3 NNC(=O)CCCO 2288AE [0,1,0,0,0,0|3,0,0]=4 69 B7R0.5 CC(C)C(=O)CC#N W5204 [0,1,0,0,0,0|2,0,0]=3 70 B7R0.5 CCOC(=O)C(Cl)Cl 7192AF [0,1,0,0,0,0|3,0,0]=4 71 B7R0.5 CCOC(=O)C(F)Cl 2611AE [0,1,0,0,0,0|3,0,0]=4 72 B7R0.5 CCOC(=O)C(F)I 2612AE [0,1,0,0,0,0|3,0,0]=4 73 B7R0.7 CCCC(C)CCC 6609AL [0,1,0,0,0,0|2,0,1]=4 74 B7R0.7 CCCC(O)CCC 6512AL [0,1,0,0,0,0|1,0,2]=4 75 B7R0.7 CCCC(S)CCO U459 [0,1,0,0,0,0|1,1,1]=4 76 B7R0.7 CCNC(=O)CC#N 4652AD [0,1,0,0,0,0|2,0,0]=3 77 B7R0.7 CCNC(=O)CCCl 3193AE [0,1,0,0,0,0|2,0,0]=3 78 B7R0.7 CCOC(=O)OCCl Z4637 [0,1,0,0,0,0|3,0,0]=4 79 B7R0.7 CCOC(=O)\C=C\I V5131 [0,1,0,0,0,0|2,0,1]=4 80 B7R0.7 CCOC(=O)\C=C\[O-] 8763AB [0,1,0,0,0,0|2,0,1]=4 81 B7R0.7 COCC(=O)COC 9752AA [0,1,0,0,0,0|0,1,0]=2 82 B7R0.7 O=C(CCO)CCO 5879AB [0,1,0,0,0,0|2,0,0]=3 83 B7R0.10 C=C(OC)C(=O)OC 3529AL [0,1,0,0,0,0|1,1,1]=4 84 B7R0.10 C=CC(O)C(=O)OC 7788AL [0,1,0,0,0,0|2,0,1]=4 85 B7R0.10 CCC(C)C(=O)NN 8409AE [0,1,0,0,0,0|3,0,0]=4 86 B7R0.10 CC[C@H](O)C(=O)OC 9869AL [0,1,0,0,0,0|2,0,0]=3 87 B7R0.10 CNC(=O)C(=O)NC R814 [0,1,0,0,0,0|2,0,1]=4 88 B7R0.10 CNC(C)C(=O)OC 4207AJ [0,1,0,0,0,0|2,0,0]=3 89 B7R0.10 CN[C@@H](C)C(=O)OC V5398 [0,1,0,0,0,0|2,0,0]=3 90 B7R0.10 COC(=O)C(=O)CBr S720 [0,1,0,0,0,0|1,1,1]=4 91 B7R0.10 COC(=O)C(C)OC X3976 [0,1,0,0,0,0|1,1,0]=3 92 B7R0.10 COC(=O)[C@@H](C)CBr 4140AL [0,1,0,0,0,0|3,0,0]=4 93 B7R0.10 COC(=O)[C@@H](O)CO X8639 [0,1,0,0,0,0|3,0,0]=4 94 B7R0.10 COC(=O)[C@H](C)CBr 4182AL [0,1,0,0,0,0|3,0,0]=4 95 B7R0.10 COC(=O)[C@H](C)CO X3275 [0,1,0,0,0,0|3,0,0]=4 96 B7R0.10 COC(=O)[C@H](N)CCl 2170AA [0,1,0,0,0,0|3,0,0]=4 97 B7R0.10 COC(=O)[C@H](N)CS 8434AE [0,1,0,0,0,0|3,0,0]=4 98 B7R0.10 COC(=O)[C@H](O)CO 9042AH [0,1,0,0,0,0|3,0,0]=4 99 B7R0.10 C\C=C(/Br)C(=O)OC 3521AL [0,1,0,0,0,0|2,0,1]=4 100 B7R0.10 C\C=C(/C)C(=O)OC 8251AL [0,1,0,0,0,0|2,0,1]=4 101 B7R0.10 O=C(CO)[C@@H](O)CO 8755AJ [0,1,0,0,0,0|3,0,0]=4 102 B7R0.11 CCS(=O)(=O)CCCl 8368AD [0,1,0,0,0,0|3,0,0]=4 103 B7R0.12 CCN(CCO)N=O 8548AL [0,1,0,0,0,0|3,0,0]=4 104 B7R1.1 CCC1=CSC=C1 X4152 [0,0,0,1,0,0|1,0,2]=4 105 B7R1.1 CCC1=NCCN1 5611AL [0,0,0,1,0,0|3,0,0]=4 106 B7R1.1 COC1=NCCC1 7443AB [0,0,0,1,0,0|3,0,0]=4 107 B7R1.2 CC1CCC(=O)N1 1659AA [0,0,0,1,0,0|2,0,0]=3 108 B7R1.2 CC1COC(=O)N1 5156AD [0,0,0,1,0,0|3,0,0]=4 109 B7R1.2 CN1CCC(N)C1 9936AH [0,0,0,1,0,0|2,0,1]=4 110 B7R1.2 CN1CCC(N)C1 X9823 [0,0,0,1,0,0|2,0,1]=4 111 B7R1.2 CN1CC[C@@H](N)C1 3935AE [0,0,0,1,0,0|2,0,1]=4 112 B7R1.2 C[C@@H]1COC(=O)N1 5441AB [0,0,0,1,0,0|3,0,0]=4 113 B7R1.2 C[C@H]1COC(=O)N1 5440AB [0,0,0,1,0,0|3,0,0]=4 114 B7R1.3 BrC1CCCOC1 X9769 [0,0,0,1,0,0|1,1,1]=4 115 B7R1.3 CC1=CCCNC1 V9748 [0,0,0,1,0,0|2,0,1]=4 116 B7R1.3 NC1CCCNC1 5237AE [0,0,0,1,0,0|2,0,1]=4 117 B7R1.3 NC1CCCOC1 X9447 [0,0,0,1,0,0|1,1,1]=4 118 B7R1.3 NN1CCCCC1 O184 [0,0,0,1,0,0|3,0,0]=4 119 B7R1.3 N[C@@H]1CCCOC1 5857AA [0,0,0,1,0,0|1,1,1]=4 120 B7R1.3 O=C1CCCNC1 7001AB [0,0,0,1,0,0|1,0,0]=2 121 B7R1.3 O=C1CCCSC1 Z4344 [0,0,0,1,0,0|0,0,0]=1 122 B7R1.3 O=C1CCNCC1 5781AB [0,0,0,1,0,0|2,0,0]=3 123 B7R1.3 O=C1COCCO1 3182AB [0,0,0,1,0,0|1,1,0]=3 124 B7R1.3 O[C@@H]1CCCNC1 9408AB [0,0,0,1,0,0|1,0,2]=4 125 B7R1.4 CC1CCNC1=O Y8455 [0,0,0,1,0,0|2,0,0]=3 126 B7R1.4 CC1CCOC1=O W3659 [0,0,0,1,0,0|2,0,0]=3 127 B7R1.4 CC1CSCC1=O 6972AB [0,0,0,1,0,0|0,0,0]=1 128 B7R1.4 CC1SCCC1=O 6512AA [0,0,0,1,0,0|2,0,0]=3 129 B7R1.4 CN1CCCC1=S 4914AL [0,0,0,1,0,0|2,1,0]=4 130 B7R1.4 CN1N=CCC1=O 0601AA [0,0,0,1,0,0|3,0,0]=4 131 B7R1.4 NC1CCNC1=O 0020AD [0,0,0,1,0,0|3,0,0]=4 132 B7R1.4 NC1CONC1=O Z5032 [0,0,0,1,0,0|2,1,0]=4 133 B7R1.4 O=C1OCCC1O 0071AB [0,0,0,1,0,0|3,0,0]=4 134 B7R1.4 O=C1OCC[C@H]1O 8329AB [0,0,0,1,0,0|3,0,0]=4 135 B7R1.22 [C@@H]1(C(=O)OC)CO1 4453AH [0,0,0,1,0,0|1,1,0]=3 136 B7R1.25 CC1(CO)CSC1 5905AE [0,0,0,1,0,0|2,0,1]=4 137 B4R0.1 CC(=O)O[Cu] X3614 [2,0,0,0,0,0|1,1,0]=4 138 B4R0.1 CC(=O)O[Tl] 6845AF [2,0,0,0,0,0|1,1,0]=4 139 B4R0.1 CCC(N)=S 9153AL [2,0,0,0,0,0|1,0,1]=4 140 B4R0.1 NCC(N)=O 1224AA [2,0,0,0,0,0|2,0,0]=4 141 B4R0.1 NCC(N)=O W7259 [2,0,0,0,0,0|2,0,0]=4 142 B4R0.2 C=CCCC 7306AF [2,0,0,0,0,0|1,0,1]=4 143 B4R0.2 CCCC#N A365 [2,0,0,0,0,0|2,0,0]=4 144 B4R0.2 CCCCC 8942AJ [2,0,0,0,0,0|0,0,1]=3 145 B4R0.2 CCCCN 7306AL [2,0,0,0,0,0|1,0,1]=4 146 B4R0.2 CCCCS 4787AL [2,0,0,0,0,0|0,0,1]=3 147 B4R0.2 CCNCC 7648AL [2,0,0,0,0,0|1,0,0]=3 148 B4R0.2 CCNCC 7649AL [2,0,0,0,0,0|1,0,0]=3 149 B4R0.2 CCNCC 7650AL [2,0,0,0,0,0|1,0,0]=3 150 B4R0.2 CNCCN X9276 [2,0,0,0,0,0|2,0,0]=4 151 B4R0.2 CSCCO U461 [2,0,0,0,0,0|1,0,0]=3 152 B4R0.2 CSSSC 8583AJ [2,0,0,0,0,0|2,0,0]=4 153 B4R0.2 C\C=C\CC 7309AF [2,0,0,0,0,0|0,0,1]=3 154 B4R0.2 C\C=C\OC 1641AL [2,0,0,0,0,0|0,1,1]=4 155 B6R0.2 CC(=O)NC(C)=O 7247AF [1,1,0,0,0,0|2,0,0]=4 156 B6R0.2 CC(=O)NC(C)C X8984 [1,1,0,0,0,0|2,0,0]=4 157 B6R0.2 CC(Cl)CC(=O)O 7238AF [1,1,0,0,0,0|2,0,0]=4 158 B6R0.2 CC(N)CC(=O)O 3162AL [1,1,0,0,0,0|2,0,0]=4 159 B6R0.2 C[C@@H](N)CC(=O)O Z5926 [1,1,0,0,0,0|2,0,0]=4 160 B6R0.2 C[C@H](N)CC(=O)O W5861 [1,1,0,0,0,0|2,0,0]=4 161 B6R0.3 CC(=O)C(C)C#N 6171AB [1,1,0,0,0,0|2,0,0]=4 162 B6R0.3 CCC(=O)C(C)=O 7386AF [1,1,0,0,0,0|1,0,1]=4 163 B6R0.3 CCC(Br)C(=O)Cl 5533AL [1,1,0,0,0,0|2,0,0]=4 164 B6R0.3 CCC(Cl)C(=O)O 7236AF [1,1,0,0,0,0|2,0,0]=4 165 B6R0.3 CCC(O)C(=O)O Z2570 [1,1,0,0,0,0|2,0,0]=4 166 B6R0.3 CC[C@H](N)C(N)=O V3235 [1,1,0,0,0,0|2,0,0]=4 167 B6R0.3 CNC(C)C(=O)O 0549AP [1,1,0,0,0,0|2,0,0]=4 168 B6R0.4 CCC#CC(C)=O 6057AL [1,1,0,0,0,0|1,0,1]=4 169 B6R0.4 CCCNC(N)=O P685 [1,1,0,0,0,0|2,0,0]=4 170 B6R0.4 CCCOC(N)=O 9471AB [1,1,0,0,0,0|2,0,0]=4 171 B6R0.4 CCCSC(C)=O R568 [1,1,0,0,0,0|1,0,0]=3 172 B6R0.4 CCNCC(=O)O X5133 [1,1,0,0,0,0|2,0,0]=4 173 B6R0.4 CSCCC(C)=O L760 [1,1,0,0,0,0|0,0,0]=2 174 B6R0.4 NC(=O)CCCCl Y1653 [1,1,0,0,0,0|2,0,0]=4 175 B6R0.4 NCCCC(N)=O 5556AA [1,1,0,0,0,0|2,0,0]=4 176 B6R0.4 O=C([O-])CNCO 0872AC [1,1,0,0,0,0|2,0,0]=4 177 B6R0.6 CCCCSCC 7568AF [1,1,0,0,0,0|0,0,1]=3 178 B6R0.6 CCCNCCO 8316AA [1,1,0,0,0,0|2,0,0]=4 179 B6R0.6 CCSSSCC U690 [1,1,0,0,0,0|2,0,0]=4 180 B6R0.6 CNCCCCO 5794AB [1,1,0,0,0,0|1,0,1]=4 181 B6R0.6 C\C=C/CCCO 7448AL [1,1,0,0,0,0|1,0,1]=4 182 B6R0.9 CC=C(CC)CC 6043AL [1,1,0,0,0,0|1,0,0]=3 183 B6R0.9 CCN(CC)CC C978 [1,1,0,0,0,0|2,0,0]=4 184 B6R0.9 CCN(CC)CC X6424 [1,1,0,0,0,0|2,0,0]=4 185 B8R0.2 COC(=O)C(N)C(C)O W7414 [0,2,0,0,0,0|2,0,0]=4 186 B8R0.2 COC(=O)[C@@H](N)[C@@H](C)O 3963AB [0,2,0,0,0,0|2,0,0]=4 187 B8R0.2 COC(=O)[C@@H](N)[C@H](C)O W8506 [0,2,0,0,0,0|2,0,0]=4 188 B8R0.2 [C@@H](O)(C(=O)OC)C(C)C 9861AL [0,2,0,0,0,0|2,0,0]=4 189 B8R0.5 CC(C)NC(=O)CCCl 7774AD [0,2,0,0,0,0|2,0,0]=4 190 B8R0.5 CC(C)OC(=O)CCS 6074AL [0,2,0,0,0,0|2,0,0]=4 191 B8R0.5 CCOC(=O)CC(=N)N W7089 [0,2,0,0,0,0|2,0,0]=4 192 B8R0.5 CCOC(=O)CC(C)N W6751 [0,2,0,0,0,0|1,0,0]=3 193 B8R0.5 CCOC(=O)CC(N)=S 6448AA [0,2,0,0,0,0|2,0,0]=4 194 B8R0.19 CCC(C)NC(=O)CCl 0194AE [0,2,0,0,0,0|2,0,0]=4 195 B8R0.19 CC[C@H](O)CC(=O)OC 5880AB [0,2,0,0,0,0|2,0,0]=4 196 B8R0.19 COC(=O)CN(C)C=O V7303 [0,2,0,0,0,0|2,0,0]=4 197 B8R0.23 CC(=O)CC(=O)C(C)C 8868AE [0,2,0,0,0,0|1,0,0]=3 198 B8R0.23 CC(=O)CC(=O)C(F)F 5749AB [0,2,0,0,0,0|2,0,0]=4 199 B8R0.23 CC(C)CC(=O)N(C)C 5171AE [0,2,0,0,0,0|2,0,0]=4 200 B8R0.23 CC(C)OC(=O)C(C)C 7796AF [0,2,0,0,0,0|2,0,0]=4 201 B8R0.23 CC(C)OC(=O)[C@H](C)N V5718 [0,2,0,0,0,0|2,0,0]=4 202 B8R0.24 CCC(=O)OC(C)(C)C 0517AB [0,2,0,0,0,0|2,0,0]=4 203 B8R0.24 COC(=O)C[Si](C)(C)C 8796AJ [0,2,0,0,0,0|2,0,0]=4 204 B8R0.1 C=CCCC(=O)OCC 7864AL [0,2,0,0,0,0|1,0,1]=4 205 B8R0.1 C=CCOC(=O)OCC 7327AL [0,2,0,0,0,0|1,0,1]=4 206 B8R0.1 CCCOC(=O)CCC 9026AJ [0,2,0,0,0,0|1,0,0]=3 207 B8R0.1 CCOC(=O)CCC#N 7342AC [0,2,0,0,0,0|1,0,1]=4 208 B8R0.1 CCOC(=O)CCCI 1537AC [0,2,0,0,0,0|1,0,0]=3 209 B8R0.1 CCOC(=O)CCNC 7579AD [0,2,0,0,0,0|1,0,0]=3 210 B8R0.1 CCOC(=O)NCCCl S838 [0,2,0,0,0,0|2,0,0]=4 211 B8R0.1 N#CCC(=O)NCCO 4656AD [0,2,0,0,0,0|2,0,0]=4 212 B8R0.3 CCCC(=O)C(=O)OC 8222AL [0,2,0,0,0,0|0,1,1]=4 213 B8R0.3 CCCC(=O)N(C)OC 1862AA [0,2,0,0,0,0|1,1,0]=4 214 B8R0.3 CCOC(=O)C(=O)CC W3459 [0,2,0,0,0,0|0,1,1]=4 215 B8R0.3 CCOC(=O)C(C)CN X7010 [0,2,0,0,0,0|2,0,0]=4 216 B8R0.3 CCOC(=O)C(Cl)CCl 7382AF [0,2,0,0,0,0|2,0,0]=4 217 B8R0.3 CCOC(=O)C(Cl)CCl X7347 [0,2,0,0,0,0|2,0,0]=4 218 B8R0.3 CCOC(=O)C(N)C#N X3969 [0,2,0,0,0,0|2,0,0]=4 219 B8R0.3 CCOC(=O)C(O)CC 5067AH [0,2,0,0,0,0|1,0,0]=3 220 B8R0.3 COC(=O)C(C)CCCl 4098AD [0,2,0,0,0,0|2,0,0]=4 221 B8R0.6 CCCCCC(=O)CC 6144AL [0,2,0,0,0,0|1,0,0]=3 222 B8R0.6 CCCCNC(=O)CC 8516AL [0,2,0,0,0,0|1,0,0]=3 223 B8R0.6 CCC\C=C\C(=O)OC 6957AJ [0,2,0,0,0,0|2,0,0]=4 224 B8R0.6 COC(=O)CCCCN 3063AB [0,2,0,0,0,0|2,0,0]=4 225 B8R0.6 COC(=O)COCCCl 2910AC [0,2,0,0,0,0|1,1,0]=4 226 B8R0.6 COCCOC(=O)CCl 7354AL [0,2,0,0,0,0|1,1,0]=4 227 B8R0.8 C=CCOC(=O)[C@H](C)N V4209 [0,2,0,0,0,0|1,0,1]=4 228 B8R0.8 CCCOC(=O)C(C)C 8881AL [0,2,0,0,0,0|1,0,0]=3 229 B8R0.8 CCCOC(=O)C(C)O 8130AL [0,2,0,0,0,0|1,0,0]=3 230 B8R0.9 CC(C)CNC(=O)CCl 0237AE [0,2,0,0,0,0|2,0,0]=4 231 B8R0.9 CCC(=O)CCC(=O)O 8820AC [0,2,0,0,0,0|1,0,1]=4 232 B8R0.9 CNC(=O)CNC(C)=O 4960AH [0,2,0,0,0,0|2,0,0]=4 233 B8R0.11 CCC\C=C(\C=O)CC 5610AL [0,2,0,0,0,0|1,0,0]=3 234 B8R0.14 CCOC(=O)C(C)(C)C 7793AF [0,2,0,0,0,0|2,0,0]=4 235 B8R0.14 CCOC(=O)C(C)(C)N V3777 [0,2,0,0,0,0|2,0,0]=4 236 B8R0.13 CC[C@](C)(N)C(=O)OC 1282AL [0,2,0,0,0,0|2,0,0]=4 237 B8R0.13 CNC(C)(C)C(=O)OC 7644AB [0,2,0,0,0,0|2,0,0]=4 238 B8R0.20 CCC(=O)N(CC)CC P947 [0,2,0,0,0,0|2,0,0]=4 239 B6R1.2 O=C1CCNN1 W3840 [1,0,0,1,0,0|2,0,0]=4 240 B6R1.2 O=C1CCON1 3285AA [1,0,0,1,0,0|1,1,0]=4 241 B6R1.2 O=C1CNCN1 X9977 [1,0,0,1,0,0|2,0,0]=4 242 B6R1.2 O=S1CCCC1 X4814 [1,0,0,1,0,0|2,0,0]=4 243 B6R1.5 CC1CC(=O)O1 7160AL [1,0,0,1,0,0|2,0,0]=4 244 B6R1.5 O=C1CC(Br)C1 8034AD [1,0,0,1,0,0|2,0,0]=4 245 B6R1.10 CC1(N)CSC1 3915AF [1,0,0,1,0,0|1,0,1]=4 246 B6R1.1 C1=CCNCC1 V3961 [1,0,0,1,0,0|1,0,1]=4 247 B6R1.1 C1=CCOCC1 X4947 [1,0,0,1,0,0|0,1,1]=4 248 B6R1.1 C1CSCCO1 7266AF [1,0,0,1,0,0|1,0,1]=4 249 B6R1.6 CNC1CCC1 4414AJ [1,0,0,1,0,0|1,0,1]=4 250 B8R1.1 COC1=CC(=O)CC1 6398AB [0,1,0,1,0,0|0,1,1]=4 251 B8R1.1 NCC1CCC(=O)N1 2507AA [0,1,0,1,0,0|2,0,0]=4 252 B8R1.1 O=C1CCC(CBr)O1 3312AH [0,1,0,1,0,0|2,0,0]=4 253 B8R1.1 O=C1CCC(CO)O1 X3393 [0,1,0,1,0,0|2,0,0]=4 254 B8R1.1 O=C1CC[C@@H](CBr)N1 W8109 [0,1,0,1,0,0|2,0,0]=4 255 B8R1.1 O=C1CC[C@@H](CO)O1 N841 [0,1,0,1,0,0|2,0,0]=4 256 B8R1.1 O=C1CC[C@H](CBr)N1 W9851 [0,1,0,1,0,0|2,0,0]=4 257 B8R1.1 O=C1CC[C@H](CO)O1 B249 [0,1,0,1,0,0|2,0,0]=4 258 B8R1.4 CC1CC(=O)CCN1 6568AA [0,1,0,1,0,0|1,0,0]=3 259 B8R1.4 CC1CC(=O)CCO1 3309AA [0,1,0,1,0,0|1,0,0]=3 260 B8R1.4 CC1CCNC(=N)C1 1356AH [0,1,0,1,0,0|2,0,0]=4 261 B8R1.4 CN1CCOC(=O)C1 9637AA [0,1,0,1,0,0|1,0,0]=3 262 B8R1.4 O=C1CC(O)CCN1 V1296 [0,1,0,1,0,0|2,0,0]=4 263 B8R1.4 O=C1COCC(=O)C1 9192AB [0,1,0,1,0,0|0,1,1]=4 264 B8R1.4 O=C1C[C@@H](O)CCN1 W6428 [0,1,0,1,0,0|2,0,0]=4 265 B8R1.40 NCC(=O)NC1CC1 3544AA [0,1,0,1,0,0|2,0,0]=4 266 B8R1.40 O=C(CCl)NC1CC1 Y8105 [0,1,0,1,0,0|2,0,0]=4 267 B8R1.51 CC1(C)CCC(=O)N1 7217AB [0,1,0,1,0,0|2,0,0]=4 268 B8R1.51 CC1(C)CNC(=O)C1 0268AC [0,1,0,1,0,0|2,0,0]=4 269 B8R1.51 CC1CCS(=O)(=O)C1 7323AF [0,1,0,1,0,0|2,0,0]=4 270 B8R1.2 O=CC1=CCCOC1 Z4103 [0,1,0,1,0,0|0,1,1]=4 271 B8R1.2 O=CC1CCCOC1 2092AC [0,1,0,1,0,0|0,1,1]=4 272 B8R1.3 O=C1CCC(O)CN1 W4138 [0,1,0,1,0,0|2,0,0]=4 273 B8R1.5 CC1CCCNC1=O Y8918 [0,1,0,1,0,0|1,0,0]=3 274 B8R1.5 CC1CNCCC1=O W6393 [0,1,0,1,0,0|1,0,0]=3 275 B8R1.5 CC1SCCNC1=O 8229AE [0,1,0,1,0,0|1,0,0]=3 276 B8R1.5 CN1CCCNC1=O 7411AC [0,1,0,1,0,0|2,0,0]=4 277 B8R1.5 CN1CCNCC1=O 1842AA [0,1,0,1,0,0|2,0,0]=4 278 B8R1.5 CN1CCNCC1=O 6558AD [0,1,0,1,0,0|2,0,0]=4 279 B8R1.5 CN1CCNCC1=O X7943 [0,1,0,1,0,0|2,0,0]=4 280 B8R1.5 C[C@@H]1NCCNC1=O 2295AC [0,1,0,1,0,0|2,0,0]=4 281 B8R1.5 C[C@H]1NCCNC1=O 5574AC [0,1,0,1,0,0|2,0,0]=4 282 B8R1.5 N[C@@H]1CCCNC1=O 4809AJ [0,1,0,1,0,0|2,0,0]=4 283 B8R1.5 N[C@H]1CCCNC1=O 5871AB [0,1,0,1,0,0|2,0,0]=4 284 B8R1.5 O=C1NCCCC1O W4139 [0,1,0,1,0,0|2,0,0]=4 285 B8R1.22 O=C1C=CCCCC1 X8995 [0,1,0,1,0,0|1,0,1]=4 286 B8R1.22 O=C1CCOCCN1 0717AP [0,1,0,1,0,0|1,1,0]=4 287 B8R1.22 O=C1CCOCCO1 4654AL [0,1,0,1,0,0|1,1,0]=4 288 B8R1.38 COC(=O)C1CCC1 9430AE [0,1,0,1,0,0|2,0,0]=4 289 B8R1.38 COC(=O)C1CCN1 3825AJ [0,1,0,1,0,0|2,0,0]=4 290 B8R1.38 O=C(CCl)N1CCC1 7072AE [0,1,0,1,0,0|2,0,0]=4 291 B8R1.50 CC1CCC(=O)C1=O 6795AA [0,1,0,1,0,0|1,0,1]=4 292 B8R1.50 CN1C(=O)CSC1=O 8285AA [0,1,0,1,0,0|1,0,1]=4 293 B8R1.50 CN1CCC(N)C1=O 0714AD [0,1,0,1,0,0|2,0,0]=4 294 B8R1.19 CC1(C)CCNC1=O 4182AE [0,1,0,1,0,0|2,0,0]=4 295 B8R1.37 CCOC(=N)C1CC1 9615AB [0,1,0,1,0,0|2,0,0]=4 296 B8R1.11 CCC1CCCC1=O 6742AB [0,1,0,1,0,0|1,0,0]=3 297 B8R1.11 N#CC1CCCC1=O U935 [0,1,0,1,0,0|1,0,1]=4 298 B8R1.39 COC(=O)C1(N)CC1 V7506 [0,1,0,1,0,0|2,0,0]=4 299 B8R1.60 CCC1(C=O)COC1 V9816 [0,1,0,1,0,0|0,1,1]=4