0 B5R0.2 C#CCCCBr 9466AL [0,0,0,0,0,0|3,0,1]=4 1 B5R0.2 C#CCCCI 0230AQ [0,0,0,0,0,0|3,0,1]=4 2 B5R0.2 C=CCCCN 7616AH [0,0,0,0,0,0|3,0,1]=4 3 B5R0.2 C=CCOCC 5601AE [0,0,0,0,0,0|1,1,2]=4 4 B5R0.2 C=CCSSC 7031AL [0,0,0,0,0,0|0,0,2]=2 5 B5R0.2 C=CC\C=C/C 0307AQ [0,0,0,0,0,0|2,0,2]=4 6 B5R0.2 CC#CC#CC 5334AL [0,0,0,0,0,0|2,0,2]=4 7 B5R0.2 CC#CCCO 6150AL [0,0,0,0,0,0|3,0,0]=3 8 B5R0.2 CCCCOC 7303AL [0,0,0,0,0,0|1,1,0]=2 9 B5R0.2 CCCNCC 8554AL [0,0,0,0,0,0|2,0,0]=2 10 B5R0.2 CCCOCC 7892AL [0,0,0,0,0,0|1,1,0]=2 11 B5R0.2 CCCOCCl 4494AB [0,0,0,0,0,0|2,1,0]=3 12 B5R0.2 CCCSCC R576 [0,0,0,0,0,0|1,0,0]=1 13 B5R0.2 CCC\C=N\O 7272AF [0,0,0,0,0,0|3,0,0]=3 14 B5R0.2 CCOCCN 3903AD [0,0,0,0,0,0|2,1,0]=3 15 B5R0.2 CC[Se][Se]CC 7651AL [0,0,0,0,0,0|2,1,0]=3 16 B5R0.2 CC\C=C\C#N 5776AL [0,0,0,0,0,0|3,0,1]=4 17 B5R0.2 COCCCI 9890AH [0,0,0,0,0,0|2,1,0]=3 18 B5R0.2 COCN=C=S 6701AD [0,0,0,0,0,0|4,0,0]=4 19 B5R0.2 CSCCC#N 5452AE [0,0,0,0,0,0|2,0,1]=3 20 B5R0.2 ClCCOCCl 7247AA [0,0,0,0,0,0|3,1,0]=4 21 B5R0.2 [C-]#[N+]CCOC V5938 [0,0,0,0,0,0|2,1,1]=4 22 B4R0.2 CCC=NO 0148AQ [1,0,0,0,0,0|1,1,1]=4 23 B4R0.2 CCCCF 8004AD [1,0,0,0,0,0|2,0,0]=3 24 B4R0.2 CCCNN 4415AE [1,0,0,0,0,0|2,0,0]=3 25 B4R0.2 CCCOC 4896AL [1,0,0,0,0,0|0,1,0]=2 26 B4R0.2 CCCON 6597AE [1,0,0,0,0,0|1,1,0]=3 27 B4R0.2 CCCSC U677 [1,0,0,0,0,0|0,0,0]=1 28 B4R0.2 CCSCC E138 [1,0,0,0,0,0|1,0,0]=2 29 B4R0.2 CNCC#N 8258AL [1,0,0,0,0,0|2,0,1]=4 30 B4R0.2 CSCCBr Y1764 [1,0,0,0,0,0|1,0,0]=2 31 B4R0.2 C\C=C/CC 7428AL [1,0,0,0,0,0|1,0,1]=3 32 B4R0.2 N#CCCS 0102AP [1,0,0,0,0,0|2,0,1]=4 33 B4R0.2 NCCON 6473AB [1,0,0,0,0,0|2,1,0]=4 34 B4R0.2 NCCON 7871AA [1,0,0,0,0,0|2,1,0]=4 35 B6R0.1 C#CC(O)CCC X7102 [0,1,0,0,0,0|2,0,1]=4 36 B6R0.1 C#CCC(O)CC 6781AL [0,1,0,0,0,0|2,0,1]=4 37 B6R0.1 C=CC(C)CCC 6092AL [0,1,0,0,0,0|2,0,1]=4 38 B6R0.1 CCC(=O)CSC K829 [0,1,0,0,0,0|1,0,1]=3 39 B6R0.1 CCC(O)CNN 2943AE [0,1,0,0,0,0|3,0,0]=4 40 B6R0.1 CCCC(=O)SC 8847AJ [0,1,0,0,0,0|1,0,0]=2 41 B6R0.1 CCCC(Br)CC 3975AB [0,1,0,0,0,0|2,0,0]=3 42 B6R0.1 CCCC(C)CC 7810AF [0,1,0,0,0,0|2,0,0]=3 43 B6R0.1 CCCC(C)CO 1207AA [0,1,0,0,0,0|3,0,0]=4 44 B6R0.1 CCCC(O)CC 7557AF [0,1,0,0,0,0|2,0,0]=3 45 B6R0.1 CCC[C@@H](N)CO 2554AC [0,1,0,0,0,0|3,0,0]=4 46 B6R0.1 CCNC(C)CC 7145AD [0,1,0,0,0,0|2,0,0]=3 47 B6R0.1 CCNC(C)CO 8218AD [0,1,0,0,0,0|3,0,0]=4 48 B6R0.1 CCOC(=N)CC 8352AC [0,1,0,0,0,0|1,1,1]=4 49 B6R0.1 CCOC(C)CC 8956AL [0,1,0,0,0,0|1,1,0]=3 50 B6R0.1 CCOC(C)CN 0082AD [0,1,0,0,0,0|2,1,0]=4 51 B6R0.1 CCSC(=O)CC 8960AL [0,1,0,0,0,0|1,0,1]=3 52 B6R0.1 CC[C@H](C)CCO 4202AL [0,1,0,0,0,0|3,0,0]=4 53 B6R0.1 CNC(=O)CCCl 2983AE [0,1,0,0,0,0|3,0,0]=4 54 B6R0.1 CNC(=O)CCO 8079AE [0,1,0,0,0,0|3,0,0]=4 55 B6R0.1 CNC(C)CCO 8891AD [0,1,0,0,0,0|3,0,0]=4 56 B6R0.1 CNCC(=O)NC V5990 [0,1,0,0,0,0|3,0,0]=4 57 B6R0.1 CNCC(C)OC 1691AF [0,1,0,0,0,0|2,1,0]=4 58 B6R0.1 COC(=O)CCN 5700AB [0,1,0,0,0,0|2,1,0]=4 59 B6R0.4 C=C(C)CCCC 5699AL [0,1,0,0,0,0|2,0,0]=3 60 B6R0.4 C=CCCC(C)C 6791AL [0,1,0,0,0,0|2,0,1]=4 61 B6R0.4 CC(=O)CCCBr W5938 [0,1,0,0,0,0|3,0,0]=4 62 B6R0.4 CC(=O)NCCCl W8163 [0,1,0,0,0,0|3,0,0]=4 63 B6R0.4 CC(=O)OCCCl 7237AF [0,1,0,0,0,0|2,1,0]=4 64 B6R0.4 CC(=O)SCC#N 6370AE [0,1,0,0,0,0|2,0,1]=4 65 B6R0.4 CC(=O)SCCN 5884AD [0,1,0,0,0,0|2,0,0]=3 66 B6R0.4 CC(C)CCCCl 6814AE [0,1,0,0,0,0|3,0,0]=4 67 B6R0.4 CC(C)NCCCl 9576AB [0,1,0,0,0,0|3,0,0]=4 68 B6R0.4 CC(C)SCCCl 3252AE [0,1,0,0,0,0|2,0,0]=3 69 B6R0.4 CCCC=C(C)C 5704AL [0,1,0,0,0,0|2,0,0]=3 70 B6R0.4 CCCCC(=O)Br 7391AF [0,1,0,0,0,0|3,0,0]=4 71 B6R0.4 CCCCC(C)Br 5535AL [0,1,0,0,0,0|2,0,0]=3 72 B6R0.4 CCCCC(C)C 5734AL [0,1,0,0,0,0|2,0,0]=3 73 B6R0.4 CCCCC(C)Cl 5578AL [0,1,0,0,0,0|2,0,0]=3 74 B6R0.4 CCCCC(C)N 7573AF [0,1,0,0,0,0|2,0,0]=3 75 B6R0.4 CCCCC(C)O 9467AB [0,1,0,0,0,0|2,0,0]=3 76 B6R0.4 CCCO[N+](=O)[O-] X5340 [0,1,0,0,0,0|2,1,0]=4 77 B6R0.4 CCOCC(C)N 0535AD [0,1,0,0,0,0|1,1,0]=3 78 B6R0.4 CSCCC(=O)Cl 6126AL [0,1,0,0,0,0|2,0,1]=4 79 B6R0.4 C\C=C\CC(C)C 6798AL [0,1,0,0,0,0|2,0,0]=3 80 B6R0.6 C=CCCCCI 0232AQ [0,1,0,0,0,0|2,0,1]=4 81 B6R0.6 C=CCC\C=C\C 4658AL [0,1,0,0,0,0|2,0,1]=4 82 B6R0.6 C=CCSCCC R577 [0,1,0,0,0,0|1,0,1]=3 83 B6R0.6 C=COCCCN 0206AC [0,1,0,0,0,0|1,1,1]=4 84 B6R0.6 CC#CCCCC 5638AL [0,1,0,0,0,0|2,0,0]=3 85 B6R0.6 CC=C=CCCO 1076AQ [0,1,0,0,0,0|2,0,1]=4 86 B6R0.6 CCCCCSC 7567AF [0,1,0,0,0,0|1,0,0]=2 87 B6R0.6 CCCCOCC 7302AL [0,1,0,0,0,0|1,1,0]=3 88 B6R0.6 CCCOCCC 7558AF [0,1,0,0,0,0|1,1,0]=3 89 B6R0.6 CCCSCCC 7569AF [0,1,0,0,0,0|1,0,0]=2 90 B6R0.6 CCC\C=C/CO 7423AL [0,1,0,0,0,0|2,0,0]=3 91 B6R0.6 CCOCCNC 5385AD [0,1,0,0,0,0|1,1,0]=3 92 B6R0.6 CC\C=C\CCC 9219AL [0,1,0,0,0,0|2,0,0]=3 93 B6R0.6 CNCCCOC V6596 [0,1,0,0,0,0|1,1,0]=3 94 B6R0.6 COCCN=C=O 3069AE [0,1,0,0,0,0|3,0,0]=4 95 B6R0.6 C\C=C/CCCC 7422AL [0,1,0,0,0,0|2,0,0]=3 96 B6R0.6 C\C=C/CCCCl 7455AL [0,1,0,0,0,0|2,0,0]=3 97 B6R0.6 C\C=C\CCCC 7780AF [0,1,0,0,0,0|2,0,0]=3 98 B6R0.6 C\C=C\SCCC U946 [0,1,0,0,0,0|1,0,0]=2 99 B6R0.6 NCCNCCCl 8169AB [0,1,0,0,0,0|3,0,0]=4 100 B6R0.6 NCCOCCN 1537AL [0,1,0,0,0,0|2,1,0]=4 101 B6R0.6 NCCSCCN K553 [0,1,0,0,0,0|2,0,0]=3 102 B6R0.6 NCCSCCO 8189AD [0,1,0,0,0,0|2,0,0]=3 103 B6R0.6 S=C=NCCCBr 9053AD [0,1,0,0,0,0|3,0,0]=4 104 B6R0.6 SCCSCCS Q406 [0,1,0,0,0,0|2,0,0]=3 105 B6R1.1 C1=NCCCN1 0674AQ [0,0,0,1,0,0|3,0,0]=4 106 B6R1.1 C1CCONC1 9605AH [0,0,0,1,0,0|1,1,0]=3 107 B6R1.1 C1COCCO1 7285AL [0,0,0,1,0,0|2,1,0]=4 108 B6R1.1 C1CSCCN1 8883AB [0,0,0,1,0,0|2,0,0]=3 109 B6R1.2 CC1=CCCC1 9313AJ [0,0,0,1,0,0|2,0,0]=3 110 B6R1.2 CC1=CCCO1 0728AQ [0,0,0,1,0,0|1,1,1]=4 111 B6R1.2 CC1=NNCC1 6440AD [0,0,0,1,0,0|3,0,0]=4 112 B6R1.2 CC1CCCN1 0591AQ [0,0,0,1,0,0|2,0,0]=3 113 B6R1.2 CC1CCCS1 7972AJ [0,0,0,1,0,0|1,0,0]=2 114 B6R1.2 CC1CCNC1 X9461 [0,0,0,1,0,0|2,0,0]=3 115 B6R1.2 CC1CCOC1 6124AL [0,0,0,1,0,0|1,1,0]=3 116 B6R1.2 CC1COCO1 6593AL [0,0,0,1,0,0|2,1,0]=4 117 B6R1.2 CC1OCCO1 7260AF [0,0,0,1,0,0|2,1,0]=4 118 B6R1.2 C[C@@H]1CCCN1 V2030 [0,0,0,1,0,0|2,0,0]=3 119 B6R1.2 ClC1=CCCC1 9304AJ [0,0,0,1,0,0|3,0,0]=4 120 B6R1.2 FC1CCCC1 7941AL [0,0,0,1,0,0|3,0,0]=4 121 B6R1.2 FC1CCNC1 W3697 [0,0,0,1,0,0|3,0,0]=4 122 B6R1.2 FC1CCNC1 X9172 [0,0,0,1,0,0|3,0,0]=4 123 B6R1.2 F[C@H]1CCNC1 9169AH [0,0,0,1,0,0|3,0,0]=4 124 B6R1.2 NC1CCOC1 W9158 [0,0,0,1,0,0|2,1,0]=4 125 B6R1.2 NN1CCCC1 8436AA [0,0,0,1,0,0|3,0,0]=4 126 B6R1.2 N[C@H]1CCNC1 N118 [0,0,0,1,0,0|3,0,0]=4 127 B6R1.2 N[C@H]1CCOC1 W4304 [0,0,0,1,0,0|2,1,0]=4 128 B6R1.2 OC1CNOC1 0177AF [0,0,0,1,0,0|2,1,0]=4 129 B6R1.2 O[C@H]1CCSC1 Y1948 [0,0,0,1,0,0|2,0,0]=3 130 B6R1.3 BrCCC1CC1 8486AH [0,0,0,1,0,0|3,0,0]=4 131 B6R1.3 CCCC1CO1 4468AL [0,0,0,1,0,0|1,1,0]=3 132 B6R1.3 CCNC1CC1 2347AB [0,0,0,1,0,0|2,0,0]=3 133 B6R1.3 CCNC1CC1 3977AJ [0,0,0,1,0,0|2,0,0]=3 134 B6R1.3 COC[C@@H]1CO1 9238AJ [0,0,0,1,0,0|2,1,0]=4 135 B6R1.3 COC[C@H]1CO1 9221AJ [0,0,0,1,0,0|2,1,0]=4 136 B6R1.3 CONC1CC1 Z3770 [0,0,0,1,0,0|1,1,0]=3 137 B6R1.3 ICCC1CC1 8514AH [0,0,0,1,0,0|3,0,0]=4 138 B6R1.3 NNCC1CC1 4780AJ [0,0,0,1,0,0|3,0,0]=4 139 B6R1.3 O=C=NC1CC1 X4805 [0,0,0,1,0,0|3,0,0]=4 140 B6R1.6 CNC1CNC1 1896AB [0,0,0,1,0,0|3,0,0]=4 141 B6R1.6 COC1CNC1 Y5064 [0,0,0,1,0,0|2,1,0]=4 142 B6R1.6 ClCC1COC1 2027AJ [0,0,0,1,0,0|2,1,0]=4 143 B6R1.6 NCC1CCN1 0858AA [0,0,0,1,0,0|3,0,0]=4 144 B6R1.6 NCC1CCN1 6521AH [0,0,0,1,0,0|3,0,0]=4 145 B6R1.6 NCC1CCO1 V8594 [0,0,0,1,0,0|2,1,0]=4 146 B6R1.6 NCC1CNC1 2747AA [0,0,0,1,0,0|3,0,0]=4 147 B6R1.6 NCC1COC1 W7450 [0,0,0,1,0,0|2,1,0]=4 148 B6R1.6 NNC1CCC1 3961AJ [0,0,0,1,0,0|3,0,0]=4 149 B3R0.1 CCCF 3973AE [2,0,0,0,0,0|1,0,0]=3 150 B3R0.1 NCCN 6791AA [2,0,0,0,0,0|2,0,0]=4 151 B3R0.1 NCCN 6876AF [2,0,0,0,0,0|2,0,0]=4 152 B3R0.1 NCCN 9393AJ [2,0,0,0,0,0|2,0,0]=4 153 B3R0.1 NCCN E395 [2,0,0,0,0,0|2,0,0]=4 154 B5R0.1 C#CCC(C)O 6664AL [1,1,0,0,0,0|1,0,1]=4 155 B5R0.1 C=CCC(C)C 6595AL [1,1,0,0,0,0|1,0,1]=4 156 B5R0.1 C=CCC(C)O 7318AF [1,1,0,0,0,0|1,0,1]=4 157 B5R0.1 CC#CC(C)C 6601AL [1,1,0,0,0,0|1,0,1]=4 158 B5R0.1 CC(Br)CC#N 6005AL [1,1,0,0,0,0|2,0,0]=4 159 B5R0.1 CC(C)CCCl 7326AF [1,1,0,0,0,0|2,0,0]=4 160 B5R0.1 CC(O)CON 3604AB [1,1,0,0,0,0|1,1,0]=4 161 B5R0.1 CCC=C(C)C 7499AF [1,1,0,0,0,0|1,0,1]=4 162 B5R0.1 CCOC(C)C 7879AL [1,1,0,0,0,0|1,1,0]=4 163 B5R0.1 CCSC(=N)N 2034AH [1,1,0,0,0,0|2,0,0]=4 164 B5R0.1 CCSC(C)C 7880AL [1,1,0,0,0,0|1,0,0]=3 165 B5R0.1 CNCC(C)=O 4565AF [1,1,0,0,0,0|1,0,1]=4 166 B5R0.1 CNCC(C)C 8603AL [1,1,0,0,0,0|1,0,0]=3 167 B5R0.1 COC[C@H](C)O W4988 [1,1,0,0,0,0|0,1,0]=3 168 B5R0.1 CSCC(=N)N 1816AJ [1,1,0,0,0,0|1,0,1]=4 169 B5R0.1 C[C@H](N)CCO 3502AC [1,1,0,0,0,0|1,1,0]=4 170 B5R0.1 C\C=C\C(C)C 7501AF [1,1,0,0,0,0|1,0,1]=4 171 B5R0.3 C=C(SC)SC 4356AL [1,1,0,0,0,0|1,0,1]=4 172 B5R0.3 CCC(=S)OC R571 [1,1,0,0,0,0|0,1,1]=4 173 B5R0.3 CCC(C)CCl U282 [1,1,0,0,0,0|2,0,0]=4 174 B5R0.3 CCC(C)NN 9798AD [1,1,0,0,0,0|2,0,0]=4 175 B5R0.3 CCC(Cl)CCl 4449AL [1,1,0,0,0,0|2,0,0]=4 176 B5R0.3 CCC(O)C#N 7246AF [1,1,0,0,0,0|2,0,0]=4 177 B5R0.3 CCC(O)CBr 4766AL [1,1,0,0,0,0|2,0,0]=4 178 B5R0.3 CCC(S)CS 4441AL [1,1,0,0,0,0|1,0,0]=3 179 B5R0.3 CC[C@H](C)CCl 4194AL [1,1,0,0,0,0|2,0,0]=4 180 B5R0.3 C\C=C(/C)CC 0241AQ [1,1,0,0,0,0|1,0,1]=4 181 B5R0.3 C\C=C(/C)CC 9220AL [1,1,0,0,0,0|1,0,1]=4 182 B5R0.3 C\C=C(\C)CC 7440AL [1,1,0,0,0,0|1,0,1]=4 183 B7R0.2 C=C(C)CC(C)CC 5312AL [0,2,0,0,0,0|2,0,0]=4 184 B7R0.2 CCC(C)CC(C)C 5322AL [0,2,0,0,0,0|2,0,0]=4 185 B7R0.3 C=C(CC)CCCC 5608AL [0,2,0,0,0,0|2,0,0]=4 186 B7R0.3 CC#CCC(O)CC 6775AL [0,2,0,0,0,0|2,0,0]=4 187 B7R0.3 CCC(Cl)CCCCl 4475AE [0,2,0,0,0,0|2,0,0]=4 188 B7R0.3 CCCCC(C)CC 6251AE [0,2,0,0,0,0|2,0,0]=4 189 B7R0.3 CCCCC(O)CC 8762AB [0,2,0,0,0,0|2,0,0]=4 190 B7R0.3 CCCC[C@H](N)CO 7337AH [0,2,0,0,0,0|2,0,0]=4 191 B7R0.3 CCC\C=C(/C)CC 6104AL [0,2,0,0,0,0|2,0,0]=4 192 B7R0.3 CCN(C)CCCO 4272AE [0,2,0,0,0,0|2,0,0]=4 193 B7R0.3 CCNCC(=O)OC 2143AA [0,2,0,0,0,0|1,1,0]=4 194 B7R0.3 CCNCC(=O)OC 2988AC [0,2,0,0,0,0|1,1,0]=4 195 B7R0.3 CCOCC(N)CC 8270AE [0,2,0,0,0,0|1,1,0]=4 196 B7R0.3 CCOCC(O)CN 1272AE [0,2,0,0,0,0|1,1,0]=4 197 B7R0.3 CC[C@H](C)CCCO 4203AL [0,2,0,0,0,0|2,0,0]=4 198 B7R0.3 CNC(=O)CCCN 5583AD [0,2,0,0,0,0|2,0,0]=4 199 B7R0.3 CNCCC(=O)NC 4515AE [0,2,0,0,0,0|2,0,0]=4 200 B7R0.3 CNCCC(=O)NC 5845AE [0,2,0,0,0,0|2,0,0]=4 201 B7R0.3 CNCCC(=O)OC 1857AB [0,2,0,0,0,0|1,1,0]=4 202 B7R0.3 CNCCC(=O)OC X3419 [0,2,0,0,0,0|1,1,0]=4 203 B7R0.3 COC(=N)CCCCl 2164AC [0,2,0,0,0,0|1,1,0]=4 204 B7R0.3 COC(=O)CCCS X9990 [0,2,0,0,0,0|1,1,0]=4 205 B7R0.3 CSCCC(N)CO 8517AA [0,2,0,0,0,0|1,0,0]=3 206 B7R0.5 CCCC(=O)C(C)C 5712AL [0,2,0,0,0,0|2,0,0]=4 207 B7R0.5 COCC(N)C(C)C 9904AH [0,2,0,0,0,0|1,1,0]=4 208 B7R0.7 CCCC(C)CCO 6091AL [0,2,0,0,0,0|2,0,0]=4 209 B7R0.7 CCCN(C)CCC 0883AE [0,2,0,0,0,0|2,0,0]=4 210 B7R0.7 CCC[C@H](N)CCO 0636AC [0,2,0,0,0,0|2,0,0]=4 211 B7R0.10 CCC(=O)C(O)CC 8871AL [0,2,0,0,0,0|2,0,0]=4 212 B7R0.10 CCC(C)C(C)CC 5907AL [0,2,0,0,0,0|2,0,0]=4 213 B7R0.11 CCOC(C)(C)CC 9029AL [0,2,0,0,0,0|1,1,0]=4 214 B7R0.12 CCNC(CC)CC 2358AE [0,2,0,0,0,0|2,0,0]=4 215 B7R0.12 CCN[C@@H](CC)CO 2889AC [0,2,0,0,0,0|2,0,0]=4 216 B7R0.4 C=C(C)CCCCC 5698AL [0,2,0,0,0,0|2,0,0]=4 217 B7R0.4 CC(=O)NCCCN V5818 [0,2,0,0,0,0|2,0,0]=4 218 B7R0.4 CC(=O)NCCCN V6432 [0,2,0,0,0,0|2,0,0]=4 219 B7R0.4 CC(=O)NCCCO 8280AC [0,2,0,0,0,0|2,0,0]=4 220 B7R0.4 CC(C)CCCCO 6988AE [0,2,0,0,0,0|2,0,0]=4 221 B7R0.4 CC(C)COCCN 0042AD [0,2,0,0,0,0|1,1,0]=4 222 B7R0.4 CC(C)CSCCO 5051AL [0,2,0,0,0,0|1,0,0]=3 223 B7R0.4 CC(C)OCCCCl U192 [0,2,0,0,0,0|1,1,0]=4 224 B7R0.4 CC(C)OCCCO 9315AD [0,2,0,0,0,0|1,1,0]=4 225 B7R0.4 CC(O)CNCCO 7542AE [0,2,0,0,0,0|2,0,0]=4 226 B7R0.4 CCCCCC(C)C 5733AL [0,2,0,0,0,0|2,0,0]=4 227 B7R0.4 CCCCCC(C)Cl 5577AL [0,2,0,0,0,0|2,0,0]=4 228 B7R0.4 CCCCNC(C)=O 7541AF [0,2,0,0,0,0|2,0,0]=4 229 B7R0.4 CCCCNC(C)C 2334AE [0,2,0,0,0,0|2,0,0]=4 230 B7R0.4 CCCCOC(Cl)Cl 7617AL [0,2,0,0,0,0|1,1,0]=4 231 B7R0.4 CCOCCC(C)=O 6489AL [0,2,0,0,0,0|1,1,0]=4 232 B7R0.4 CCSCCC(=O)O 8721AE [0,2,0,0,0,0|1,0,1]=4 233 B7R0.4 CN(C)CCCCN 1354AE [0,2,0,0,0,0|2,0,0]=4 234 B7R0.4 COCCNC(C)C 8018AC [0,2,0,0,0,0|1,1,0]=4 235 B7R0.6 C=C(C)CCC(C)C 5371AL [0,2,0,0,0,0|2,0,0]=4 236 B7R0.6 CC(C)CCC(C)C 5381AL [0,2,0,0,0,0|2,0,0]=4 237 B7R0.6 CC(C)CNC(C)C 2335AE [0,2,0,0,0,0|2,0,0]=4 238 B7R0.6 C[C@H](O)CC[C@H](C)O 4119AB [0,2,0,0,0,0|2,0,0]=4 239 B7R0.8 CC(C)(C)SCCN 7714AD [0,2,0,0,0,0|2,0,0]=4 240 B7R0.8 CCCCC(C)(C)C 5136AL [0,2,0,0,0,0|2,0,0]=4 241 B7R0.8 CCCC[Si](C)(C)Cl 8911AJ [0,2,0,0,0,0|2,0,0]=4 242 B7R0.8 CCNCC(C)(C)O 9524AH [0,2,0,0,0,0|2,0,0]=4 243 B7R0.8 CNCCC(C)(C)C 9066AC [0,2,0,0,0,0|2,0,0]=4 244 B7R0.1 C#CCNCCCC 3830AE [0,2,0,0,0,0|2,0,0]=4 245 B7R0.1 C=CCOCCCC 7029AL [0,2,0,0,0,0|1,1,0]=4 246 B7R0.1 CC#CCCC#CC 5428AL [0,2,0,0,0,0|2,0,0]=4 247 B7R0.1 CCC#CCCCC 7931AF [0,2,0,0,0,0|2,0,0]=4 248 B7R0.1 CCCCCC[Mg]Br 8700AJ [0,2,0,0,0,0|2,0,0]=4 249 B7R0.1 CCCCOCCCl 5574AL [0,2,0,0,0,0|1,1,0]=4 250 B7R0.1 CCCCOCCN 7133AE [0,2,0,0,0,0|1,1,0]=4 251 B7R0.1 CCCC\C=C\CO 9204AL [0,2,0,0,0,0|2,0,0]=4 252 B7R0.1 CCNCCOCC 2091AE [0,2,0,0,0,0|1,1,0]=4 253 B7R0.1 CC\C=C\CCCC 9221AL [0,2,0,0,0,0|2,0,0]=4 254 B7R0.1 COCCOCCI 0278AP [0,2,0,0,0,0|1,1,0]=4 255 B7R0.1 COCCOCCS 1037AQ [0,2,0,0,0,0|1,1,0]=4 256 B7R0.1 C\C=C/CCCCC 7427AL [0,2,0,0,0,0|2,0,0]=4 257 B7R0.1 C\C=C\CCCCC 7960AF [0,2,0,0,0,0|2,0,0]=4 258 B7R0.1 N#CCCSCCO 4958AD [0,2,0,0,0,0|1,0,1]=4 259 B7R0.1 OCCCNCCO 2316AL [0,2,0,0,0,0|2,0,0]=4 260 B5R1.1 C1CNNC1 Z5309 [1,0,0,1,0,0|2,0,0]=4 261 B5R1.1 C1CNOC1 2460AE [1,0,0,1,0,0|1,1,0]=4 262 B5R1.1 C1CSCS1 0673AQ [1,0,0,1,0,0|1,0,0]=3 263 B5R1.2 C=C1CCC1 3599AL [1,0,0,1,0,0|1,0,1]=4 264 B5R1.2 IC1CNC1 2304AJ [1,0,0,1,0,0|2,0,0]=4 265 B5R1.2 NC1CSC1 V9418 [1,0,0,1,0,0|1,0,0]=3 266 B5R1.2 OC1CSC1 Z6583 [1,0,0,1,0,0|1,0,0]=3 267 B5R1.3 CNC1CC1 X4771 [1,0,0,1,0,0|1,0,0]=3 268 B5R1.3 FCC1CO1 1377AQ [1,0,0,1,0,0|1,1,0]=4 269 B5R1.3 OCC1CO1 Y6562 [1,0,0,1,0,0|1,1,0]=4 270 B5R1.3 [C-]#[N+]C1CC1 6101AE [1,0,0,1,0,0|1,0,1]=4 271 B7R1.1 BrCC1CCCN1 6324AA [0,1,0,1,0,0|2,0,0]=4 272 B7R1.1 BrCC1CCOC1 8390AA [0,1,0,1,0,0|1,1,0]=4 273 B7R1.1 CCC1CCCC1 7901AL [0,1,0,1,0,0|2,0,0]=4 274 B7R1.1 CCC1CCCN1 7143AC [0,1,0,1,0,0|2,0,0]=4 275 B7R1.1 CCC1CCNC1 9496AE [0,1,0,1,0,0|2,0,0]=4 276 B7R1.1 CCN1CCCC1 8555AL [0,1,0,1,0,0|2,0,0]=4 277 B7R1.1 CNC1CCNC1 2827AC [0,1,0,1,0,0|2,0,0]=4 278 B7R1.1 CNC1CCOC1 Z5570 [0,1,0,1,0,0|1,1,0]=4 279 B7R1.1 CN[C@@H]1CCNC1 X6025 [0,1,0,1,0,0|2,0,0]=4 280 B7R1.1 CN[C@@H]1CCOC1 2045AJ [0,1,0,1,0,0|1,1,0]=4 281 B7R1.1 CN[C@@H]1CCOC1 9048AH [0,1,0,1,0,0|1,1,0]=4 282 B7R1.1 CSC1=NCCN1 1402AQ [0,1,0,1,0,0|2,0,0]=4 283 B7R1.1 CSC1=NCCS1 X2626 [0,1,0,1,0,0|1,0,0]=3 284 B7R1.1 ClC[C@@H]1CCCN1 9398AA [0,1,0,1,0,0|2,0,0]=4 285 B7R1.1 FC[C@@H]1CCCN1 1290AF [0,1,0,1,0,0|2,0,0]=4 286 B7R1.1 NCC1CCCC1 3974AJ [0,1,0,1,0,0|2,0,0]=4 287 B7R1.1 NCC1CCCC1 3975AJ [0,1,0,1,0,0|2,0,0]=4 288 B7R1.1 NCC1CCNC1 0361AC [0,1,0,1,0,0|2,0,0]=4 289 B7R1.1 NC[C@@H]1CCCN1 O008 [0,1,0,1,0,0|2,0,0]=4 290 B7R1.1 NC[C@H]1CCCN1 1217AC [0,1,0,1,0,0|2,0,0]=4 291 B7R1.1 OCC1CCNC1 W6601 [0,1,0,1,0,0|2,0,0]=4 292 B7R1.2 CC1CCC(C)O1 Z5431 [0,1,0,1,0,0|1,1,0]=4 293 B7R1.2 CC1CNC(=O)C1 X7991 [0,1,0,1,0,0|2,0,0]=4 294 B7R1.2 CN1CCC(Br)C1 1332AA [0,1,0,1,0,0|2,0,0]=4 295 B7R1.2 CN1CC[C@H](N)C1 Y4288 [0,1,0,1,0,0|2,0,0]=4 296 B7R1.2 C[C@H]1C[C@H](O)CN1 1991AA [0,1,0,1,0,0|2,0,0]=4 297 B7R1.3 BrC1=CCCCC1 Z0360 [0,1,0,1,0,0|2,0,0]=4 298 B7R1.3 CC1C=CCCC1 6090AL [0,1,0,1,0,0|2,0,0]=4 299 B7R1.3 CC1CCCCN1 7117AB [0,1,0,1,0,0|2,0,0]=4 300 B7R1.3 CC1CCOCO1 8171AJ [0,1,0,1,0,0|1,1,0]=4 301 B7R1.3 CC1CNCCO1 8808AB [0,1,0,1,0,0|1,1,0]=4 302 B7R1.3 C[C@@H]1CCCNC1 Z4441 [0,1,0,1,0,0|2,0,0]=4 303 B7R1.3 FC1CCCCC1 1850AE [0,1,0,1,0,0|2,0,0]=4 304 B7R1.3 FC1CCCNC1 0816AQ [0,1,0,1,0,0|2,0,0]=4 305 B7R1.3 IC1CCNCC1 Z9919 [0,1,0,1,0,0|2,0,0]=4 306 B7R1.3 NC1CC=CCC1 3966AJ [0,1,0,1,0,0|2,0,0]=4 307 B7R1.3 NC1CCCOC1 0386AC [0,1,0,1,0,0|1,1,0]=4 308 B7R1.3 N[C@@H]1CCCNC1 X9699 [0,1,0,1,0,0|2,0,0]=4 309 B7R1.3 N[C@H]1CCCNC1 Y4134 [0,1,0,1,0,0|2,0,0]=4 310 B7R1.3 ON1CCCCC1 W6467 [0,1,0,1,0,0|2,0,0]=4 311 B7R1.3 S=C1NCCCS1 5563AE [0,1,0,1,0,0|2,0,0]=4 312 B7R1.4 NC1CSCC1O 0027AD [0,1,0,1,0,0|2,0,0]=4 313 B7R1.6 CCOC1CNC1 4280AC [0,1,0,1,0,0|1,1,0]=4 314 B7R1.6 CNCC1CCC1 3149AD [0,1,0,1,0,0|2,0,0]=4 315 B7R1.6 ClCCN1CCC1 2792AA [0,1,0,1,0,0|2,0,0]=4 316 B7R1.6 OCCN1CCC1 0462AC [0,1,0,1,0,0|2,0,0]=4 317 B7R1.10 CCN1CC(O)C1 2284AJ [0,1,0,1,0,0|2,0,0]=4 318 B7R1.22 CCC(N)C1CC1 7479AD [0,1,0,1,0,0|2,0,0]=4 319 B7R1.7 CCNCC1CC1 8749AD [0,1,0,1,0,0|2,0,0]=4 320 B7R1.7 CCOCC1CO1 7875AL [0,1,0,1,0,0|1,1,0]=4 321 B7R1.7 CO\C=C\C1CC1 8518AH [0,1,0,1,0,0|1,1,0]=4 322 B7R1.14 CC1(C)CCNC1 2404AC [0,1,0,1,0,0|2,0,0]=4 323 B7R1.14 CC1(N)CCCC1 0991AQ [0,1,0,1,0,0|2,0,0]=4 324 B7R1.20 CC(C)NC1CC1 V4644 [0,1,0,1,0,0|2,0,0]=4 325 B7R1.24 C1=CCCCCC1 7508AL [0,1,0,1,0,0|2,0,0]=4 326 B7R2.13 C1CC2CC2N1 1555AJ [0,0,0,2,0,0|2,0,0]=4 327 B7R2.13 C1NCC2CC12 Z1877 [0,0,0,2,0,0|2,0,0]=4