0 B4R0.1 C#CC(C)N CS-0072301 [0,0,0,0,0,0|2,0,2]=4 1 B4R0.1 C#CC(N)=O CS-0022393 [0,0,0,0,0,0|2,0,1]=3 2 B4R0.1 C#C[C@H](C)N CS-0147130 [0,0,0,0,0,0|2,0,2]=4 3 B4R0.1 C#C[C@H](C)O CS-0127970 [0,0,0,0,0,0|1,0,3]=4 4 B4R0.1 C(=O)C(=O)O CS-0031458 [0,0,0,0,0,0|3,0,0]=3 5 B4R0.1 C=C(Br)CBr CS-0132263 [0,0,0,0,0,0|3,0,1]=4 6 B4R0.1 C=C(C)CN CS-0204398 [0,0,0,0,0,0|3,0,0]=3 7 B4R0.1 C=CC(=O)O CS-0356466 [0,0,0,0,0,0|2,0,1]=3 8 B4R0.1 C=CC(=O)O CS-0356467 [0,0,0,0,0,0|2,0,1]=3 9 B4R0.1 C=CC(=O)O CS-0356469 [0,0,0,0,0,0|2,0,1]=3 10 B4R0.1 C=CC(=O)O CS-0356470 [0,0,0,0,0,0|2,0,1]=3 11 B4R0.1 C=CC(=O)O CS-0356471 [0,0,0,0,0,0|2,0,1]=3 12 B4R0.1 C=CC(C)N CS-0173225 [0,0,0,0,0,0|2,0,2]=4 13 B4R0.1 C=CC(N)=O CS-0255029 [0,0,0,0,0,0|2,0,1]=3 14 B4R0.1 C=CC(N)=O CS-0255030 [0,0,0,0,0,0|2,0,1]=3 15 B4R0.1 CC(=N)NO CS-W008635 [0,0,0,0,0,0|3,0,0]=3 16 B4R0.1 CC(=O)C=O CS-0031856 [0,0,0,0,0,0|2,0,0]=2 17 B4R0.1 CC(=O)CN CS-W004850 [0,0,0,0,0,0|2,0,0]=2 18 B4R0.1 CC(=O)CO CS-0017823 [0,0,0,0,0,0|2,0,0]=2 19 B4R0.1 CC(=O)NBr CS-0142503 [0,0,0,0,0,0|2,0,0]=2 20 B4R0.1 CC(=O)NN CS-D1403 [0,0,0,0,0,0|2,0,0]=2 21 B4R0.1 CC(=O)NO CS-4881 [0,0,0,0,0,0|2,0,0]=2 22 B4R0.1 CC(=O)O[Ag] CS-0082496 [0,0,0,0,0,0|1,0,0]=1 23 B4R0.1 CC(=O)O[K] CS-W020131 [0,0,0,0,0,0|1,0,0]=1 24 B4R0.1 CC(Br)C#N CS-0020094 [0,0,0,0,0,0|3,0,1]=4 25 B4R0.1 CC(Br)CO CS-0061061 [0,0,0,0,0,0|3,0,1]=4 26 B4R0.1 CC(C)=NO CS-W009556 [0,0,0,0,0,0|3,0,0]=3 27 B4R0.1 CC(C)CN CS-0154223 [0,0,0,0,0,0|3,0,1]=4 28 B4R0.1 CC(C)CN CS-0214073 [0,0,0,0,0,0|3,0,1]=4 29 B4R0.1 CC(C)NO CS-W022923 [0,0,0,0,0,0|3,0,1]=4 30 B4R0.1 CC(C)ON CS-W008733 [0,0,0,0,0,0|2,0,1]=3 31 B4R0.1 CC(N)C#N CS-0095478 [0,0,0,0,0,0|3,0,1]=4 32 B4R0.1 CC(N)CCl CS-0161780 [0,0,0,0,0,0|3,0,1]=4 33 B4R0.1 CC(N)CF CS-0107816 [0,0,0,0,0,0|3,0,1]=4 34 B4R0.1 CC(N)CO CS-W018531 [0,0,0,0,0,0|3,0,1]=4 35 B4R0.1 CC(O)CBr CS-0063182 [0,0,0,0,0,0|2,0,2]=4 36 B4R0.1 CC(O)CN CS-W016685 [0,0,0,0,0,0|2,0,2]=4 37 B4R0.1 CC(O)CO CS-0015917 [0,0,0,0,0,0|2,0,2]=4 38 B4R0.1 CCB(O)O CS-W000933 [0,0,0,0,0,0|3,0,1]=4 39 B4R0.1 CCC(=N)N CS-W019290 [0,0,0,0,0,0|3,0,0]=3 40 B4R0.1 CCC(=N)S CS-W016672 [0,0,0,0,0,0|2,1,0]=3 41 B4R0.1 CCC(N)=O CS-W016688 [0,0,0,0,0,0|2,0,0]=2 42 B4R0.1 CC[C@@H](C)N CS-0379054 [0,0,0,0,0,0|2,0,1]=3 43 B4R0.1 CC[C@@H](C)O CS-0128797 [0,0,0,0,0,0|1,0,2]=3 44 B4R0.1 CC[C@H](C)N CS-0084847 [0,0,0,0,0,0|2,0,1]=3 45 B4R0.1 CNC(=N)N CS-W005028 [0,0,0,0,0,0|3,0,0]=3 46 B4R0.1 CNC(=N)S CS-W011347 [0,0,0,0,0,0|2,1,0]=3 47 B4R0.1 CNC(C)=O CS-0031873 [0,0,0,0,0,0|1,0,0]=1 48 B4R0.1 CNC(N)=O CS-W016687 [0,0,0,0,0,0|2,0,0]=2 49 B4R0.1 CNN(C)C CS-M2145 [0,0,0,0,0,0|3,0,0]=3 50 B4R0.1 COC(=N)N CS-0114088 [0,0,0,0,0,0|2,0,0]=2 51 B4R0.1 COC(=N)N CS-W017615 [0,0,0,0,0,0|2,0,0]=2 52 B4R0.1 COC(=N)N CS-W019574 [0,0,0,0,0,0|2,0,0]=2 53 B4R0.1 COC(N)=O CS-0017839 [0,0,0,0,0,0|1,0,0]=1 54 B4R0.1 CS(=O)O[Na] CS-0019422 [0,0,0,0,0,0|2,0,0]=2 55 B4R0.1 CSC(=N)N CS-0011749 [0,0,0,0,0,0|2,1,0]=3 56 B4R0.1 CSC(=N)N CS-0134406 [0,0,0,0,0,0|2,1,0]=3 57 B4R0.1 CSC(=N)N CS-0199730 [0,0,0,0,0,0|2,1,0]=3 58 B4R0.1 C[C@@H](Cl)CO CS-0186126 [0,0,0,0,0,0|3,0,1]=4 59 B4R0.1 C[C@@H](N)CF CS-0104382 [0,0,0,0,0,0|3,0,1]=4 60 B4R0.1 C[C@@H](N)CN CS-W018220 [0,0,0,0,0,0|3,0,1]=4 61 B4R0.1 C[C@@H](N)CO CS-W011362 [0,0,0,0,0,0|3,0,1]=4 62 B4R0.1 C[C@@H](O)CN CS-W002295 [0,0,0,0,0,0|2,0,2]=4 63 B4R0.1 C[C@@H](O)CO CS-W020032 [0,0,0,0,0,0|2,0,2]=4 64 B4R0.1 C[C@H](N)CF CS-0090252 [0,0,0,0,0,0|3,0,1]=4 65 B4R0.1 C[C@H](N)CO CS-B1303 [0,0,0,0,0,0|3,0,1]=4 66 B4R0.1 C[C@H](O)CN CS-W019029 [0,0,0,0,0,0|2,0,2]=4 67 B4R0.1 C[C@H](O)CO CS-0011520 [0,0,0,0,0,0|2,0,2]=4 68 B4R0.1 N=C(N)CCl CS-W000829 [0,0,0,0,0,0|4,0,0]=4 69 B4R0.1 N=C(N)NN CS-0031844 [0,0,0,0,0,0|4,0,0]=4 70 B4R0.1 N=C(N)NN CS-0201528 [0,0,0,0,0,0|4,0,0]=4 71 B4R0.1 N=C(N)NN CS-4562 [0,0,0,0,0,0|4,0,0]=4 72 B4R0.1 NC(=O)CBr CS-W007330 [0,0,0,0,0,0|3,0,0]=3 73 B4R0.1 NC(=O)CI CS-0020050 [0,0,0,0,0,0|3,0,0]=3 74 B4R0.1 NC(=O)CO CS-W016686 [0,0,0,0,0,0|3,0,0]=3 75 B4R0.1 NC(=O)NO CS-2353 [0,0,0,0,0,0|3,0,0]=3 76 B4R0.1 NCC(=O)O CS-0158475 [0,0,0,0,0,0|3,0,0]=3 77 B4R0.1 NCC(=O)O CS-0187433 [0,0,0,0,0,0|3,0,0]=3 78 B4R0.1 NCC(=O)O CS-B1641 [0,0,0,0,0,0|3,0,0]=3 79 B4R0.1 NCC(N)=O CS-0149938 [0,0,0,0,0,0|3,0,0]=3 80 B4R0.1 NCC(N)=O CS-W019695 [0,0,0,0,0,0|3,0,0]=3 81 B4R0.1 NNC(N)=O CS-W018530 [0,0,0,0,0,0|3,0,0]=3 82 B4R0.1 NNC(N)=S CS-0008325 [0,0,0,0,0,0|3,1,0]=4 83 B4R0.1 O=C(O)[Ba]O CS-0015804 [0,0,0,0,0,0|3,0,0]=3 84 B4R0.1 O=C([Co])OO CS-0111382 [0,0,0,0,0,0|2,0,0]=2 85 B4R0.1 O=C([Cu])OO CS-0188508 [0,0,0,0,0,0|2,0,0]=2 86 B4R0.1 O=CC(=O)O CS-W019807 [0,0,0,0,0,0|3,0,0]=3 87 B4R0.1 O=C[Pb](=O)O CS-B1715 [0,0,0,0,0,0|4,0,0]=4 88 B4R0.1 O=P(=O)OO CS-0015364 [0,0,0,0,0,0|3,0,0]=3 89 B4R0.1 O=P(=O)OO CS-0021609 [0,0,0,0,0,0|3,0,0]=3 90 B4R0.1 O=P(=O)OO CS-0144851 [0,0,0,0,0,0|3,0,0]=3 91 B4R0.1 O=P(=O)OO CS-0642537 [0,0,0,0,0,0|3,0,0]=3 92 B4R0.1 O=P(=O)OO CS-0653228 [0,0,0,0,0,0|3,0,0]=3 93 B4R0.1 O=[Si](O)[Ca]O CS-0144587 [0,0,0,0,0,0|3,1,0]=4 94 B4R0.1 O=[Si](O)[Ca]O CS-0180929 [0,0,0,0,0,0|3,1,0]=4 95 B4R0.1 [2H]C(=O)O[Na] CS-0542325 [0,0,0,0,0,0|2,0,0]=2 96 B4R0.1 [C@@H](C)(Cl)CO CS-W016664 [0,0,0,0,0,0|3,0,1]=4 97 B4R0.1 [C@@H](C)(N)CN CS-W008537 [0,0,0,0,0,0|3,0,1]=4 98 B4R0.1 [C@H](C)(O)CCl CS-W005784 [0,0,0,0,0,0|2,0,2]=4 99 B3R0.1 Br\C=C\Br CS-0197272 [1,0,0,0,0,0|3,0,0]=4 100 B3R0.1 C(=O)ON CS-0015274 [1,0,0,0,0,0|1,0,0]=2 101 B3R0.1 CCCN CS-0079898 [1,0,0,0,0,0|2,0,1]=4 102 B3R0.1 CCCN CS-0203559 [1,0,0,0,0,0|2,0,1]=4 103 B3R0.1 CCC[O-] CS-0636169 [1,0,0,0,0,0|1,0,2]=4 104 B3R0.1 CCNC CS-0158300 [1,0,0,0,0,0|1,0,1]=3 105 B3R0.1 CCNN CS-0151959 [1,0,0,0,0,0|2,0,1]=4 106 B3R0.1 CCNN CS-0160233 [1,0,0,0,0,0|2,0,1]=4 107 B3R0.1 CCNO CS-0370696 [1,0,0,0,0,0|2,0,1]=4 108 B3R0.1 CCON CS-0017502 [1,0,0,0,0,0|1,0,1]=3 109 B3R0.1 CCON CS-W011335 [1,0,0,0,0,0|1,0,1]=3 110 B3R0.1 CNNC CS-0530458 [1,0,0,0,0,0|2,0,0]=3 111 B3R0.1 CNOC CS-D1361 [1,0,0,0,0,0|1,0,0]=2 112 B3R0.1 C[Se][Se]C CS-0199215 [1,0,0,0,0,0|1,1,0]=3 113 B3R0.1 O=BOO CS-0013869 [1,0,0,0,0,0|2,0,0]=3 114 B3R0.1 O=CO[Na] CS-0129037 [1,0,0,0,0,0|1,0,0]=2 115 B3R0.1 OOOP CS-0166639 [1,0,0,0,0,0|2,0,1]=4 116 B3R0.1 [Li]OB=O CS-0128725 [1,0,0,0,0,0|2,0,0]=3 117 B3R0.1 [Li]OC=O CS-0158490 [1,0,0,0,0,0|1,0,0]=2 118 B3R0.2 C=[N+](C)C CS-0132319 [1,0,0,0,0,0|2,0,0]=3 119 B3R0.2 CB(O)O CS-W018525 [1,0,0,0,0,0|1,0,1]=3 120 B3R0.2 CC(=N)N CS-0850442 [1,0,0,0,0,0|2,0,0]=3 121 B3R0.2 CC(=O)O CS-0081928 [1,0,0,0,0,0|0,0,0]=1 122 B3R0.2 CC(=O)O CS-0144598 [1,0,0,0,0,0|0,0,0]=1 123 B3R0.2 CC(=O)O CS-0646220 [1,0,0,0,0,0|0,0,0]=1 124 B3R0.2 CC(=O)O CS-0886556 [1,0,0,0,0,0|0,0,0]=1 125 B3R0.2 CC(=O)O CS-W013740 [1,0,0,0,0,0|0,0,0]=1 126 B3R0.2 CC(=O)O CS-W019776 [1,0,0,0,0,0|0,0,0]=1 127 B3R0.2 CC(=O)[O-] CS-0084981 [1,0,0,0,0,0|0,0,1]=2 128 B3R0.2 CC(C)C CS-0035161 [1,0,0,0,0,0|1,0,1]=3 129 B3R0.2 CC(C)N CS-0154205 [1,0,0,0,0,0|1,0,1]=3 130 B3R0.2 CC(C)N CS-0182206 [1,0,0,0,0,0|1,0,1]=3 131 B3R0.2 CC(N)=O CS-0015934 [1,0,0,0,0,0|1,0,0]=2 132 B3R0.2 CC(N)=S CS-W018499 [1,0,0,0,0,0|1,1,0]=3 133 B3R0.2 CN(C)C CS-0204256 [1,0,0,0,0,0|2,0,0]=3 134 B3R0.2 CN(C)C CS-D1390 [1,0,0,0,0,0|2,0,0]=3 135 B3R0.2 CS(C)=O CS-B1637 [1,0,0,0,0,0|1,0,0]=2 136 B3R0.2 C[Cr](C)C CS-0137821 [1,0,0,0,0,0|2,0,0]=3 137 B3R0.2 C[In](C)C CS-0111736 [1,0,0,0,0,0|2,0,0]=3 138 B3R0.2 C[S+](C)Br CS-0311610 [1,0,0,0,0,0|2,0,0]=3 139 B3R0.2 C[S+](C)C CS-0128440 [1,0,0,0,0,0|2,0,0]=3 140 B3R0.2 C[S+](C)C CS-W008974 [1,0,0,0,0,0|2,0,0]=3 141 B3R0.2 N=C(N)Cl CS-0099930 [1,0,0,0,0,0|3,0,0]=4 142 B3R0.2 N=C(N)N CS-0014812 [1,0,0,0,0,0|3,0,0]=4 143 B3R0.2 N=C(N)N CS-0015157 [1,0,0,0,0,0|3,0,0]=4 144 B3R0.2 N=C(N)N CS-0158502 [1,0,0,0,0,0|3,0,0]=4 145 B3R0.2 N=C(N)N CS-0214056 [1,0,0,0,0,0|3,0,0]=4 146 B3R0.2 N=C(N)N CS-2056 [1,0,0,0,0,0|3,0,0]=4 147 B3R0.2 NC(=S)[S-] CS-0187303 [1,0,0,0,0,0|1,2,0]=4 148 B3R0.2 NC(N)=O CS-0653234 [1,0,0,0,0,0|2,0,0]=3 149 B3R0.2 NC(N)=O CS-B1800 [1,0,0,0,0,0|2,0,0]=3 150 B3R0.2 O=[N+]([O-])[Ag] CS-0082535 [1,0,0,0,0,0|2,0,1]=4 151 B3R0.2 O=[N+]([O-])[O-] CS-1102172 [1,0,0,0,0,0|2,0,1]=4 152 B3R0.2 O=[Si]([O-])[O-] CS-0021591 [1,0,0,0,0,0|1,1,1]=4 153 B3R0.2 O=[W](=O)=O CS-0198133 [1,0,0,0,0,0|2,0,1]=4 154 B3R0.2 O[AlH3](O)O CS-0013311 [1,0,0,0,0,0|2,0,1]=4 155 B3R0.2 O[Au](O)O CS-0167620 [1,0,0,0,0,0|2,0,1]=4 156 B3R0.2 O[In](O)O CS-0166623 [1,0,0,0,0,0|2,0,1]=4 157 B5R0.1 C#CCC(=O)O CS-W004784 [0,1,0,0,0,0|2,0,1]=4 158 B5R0.1 C=CCC(=O)O CS-0069849 [0,1,0,0,0,0|2,0,1]=4 159 B5R0.1 CC#CC(=O)O CS-W007936 [0,1,0,0,0,0|2,0,0]=3 160 B5R0.1 CC(=O)CCCl CS-W022162 [0,1,0,0,0,0|1,0,0]=2 161 B5R0.1 CC(=O)CCN CS-0209803 [0,1,0,0,0,0|1,0,0]=2 162 B5R0.1 CC(=O)NCO CS-0061075 [0,1,0,0,0,0|1,0,0]=2 163 B5R0.1 CC(=O)OCBr CS-0090812 [0,1,0,0,0,0|0,0,0]=1 164 B5R0.1 CC(=O)OCCl CS-0139458 [0,1,0,0,0,0|0,0,0]=1 165 B5R0.1 CC(C)=CCCl CS-0204351 [0,1,0,0,0,0|2,0,0]=3 166 B5R0.1 CC(C)=CCN CS-0236946 [0,1,0,0,0,0|2,0,0]=3 167 B5R0.1 CC(C)=CCO CS-W013751 [0,1,0,0,0,0|2,0,0]=3 168 B5R0.1 CC(C)CON CS-0136014 [0,1,0,0,0,0|2,0,1]=4 169 B5R0.1 CC(N)CCO CS-W004841 [0,1,0,0,0,0|2,0,1]=4 170 B5R0.1 CC(O)CCBr CS-0142519 [0,1,0,0,0,0|1,0,2]=4 171 B5R0.1 CC(O)CCO CS-0115644 [0,1,0,0,0,0|1,0,2]=4 172 B5R0.1 CCCC(=N)N CS-W013544 [0,1,0,0,0,0|3,0,0]=4 173 B5R0.1 CCCC(=O)O CS-0977378 [0,1,0,0,0,0|2,0,0]=3 174 B5R0.1 CCCC(N)=O CS-0130522 [0,1,0,0,0,0|2,0,0]=3 175 B5R0.1 CCC[C@@H](C)N CS-0162182 [0,1,0,0,0,0|2,0,1]=4 176 B5R0.1 CCC[C@H](C)N CS-W006528 [0,1,0,0,0,0|2,0,1]=4 177 B5R0.1 CCNC(N)=O CS-W011351 [0,1,0,0,0,0|2,0,0]=3 178 B5R0.1 CCNC(N)=S CS-0180914 [0,1,0,0,0,0|2,1,0]=4 179 B5R0.1 CCOC(=N)N CS-W019160 [0,1,0,0,0,0|2,0,0]=3 180 B5R0.1 CCOC(C)=N CS-W008601 [0,1,0,0,0,0|1,0,0]=2 181 B5R0.1 CCOC(N)=O CS-4731 [0,1,0,0,0,0|1,0,0]=2 182 B5R0.1 CCSC(=N)N CS-0021039 [0,1,0,0,0,0|2,1,0]=4 183 B5R0.1 CN(C)CCBr CS-W004693 [0,1,0,0,0,0|3,0,0]=4 184 B5R0.1 CNCC(=O)O CS-W013507 [0,1,0,0,0,0|2,0,0]=3 185 B5R0.1 CNCC(=O)O CS-W018511 [0,1,0,0,0,0|2,0,0]=3 186 B5R0.1 CNCC(C)O CS-0216704 [0,1,0,0,0,0|1,0,2]=4 187 B5R0.1 CNCC(N)=O CS-W011178 [0,1,0,0,0,0|2,0,0]=3 188 B5R0.1 COCC(=N)N CS-W003564 [0,1,0,0,0,0|2,0,0]=3 189 B5R0.1 COCC(=O)O CS-W020123 [0,1,0,0,0,0|1,0,0]=2 190 B5R0.1 COC[C@@H](C)N CS-W019198 [0,1,0,0,0,0|1,0,1]=3 191 B5R0.1 COC[C@H](C)N CS-0148795 [0,1,0,0,0,0|1,0,1]=3 192 B5R0.1 COC[C@H](C)O CS-0031378 [0,1,0,0,0,0|0,0,2]=3 193 B5R0.1 CSCC(=O)O CS-0015159 [0,1,0,0,0,0|1,1,0]=3 194 B5R0.1 CSCC(N)=O CS-0150088 [0,1,0,0,0,0|1,1,0]=3 195 B5R0.1 CSCS(C)=O CS-0146450 [0,1,0,0,0,0|1,1,0]=3 196 B5R0.1 C[C@@H](N)CCO CS-W013746 [0,1,0,0,0,0|2,0,1]=4 197 B5R0.1 C[C@@H](O)CCO CS-M1638 [0,1,0,0,0,0|1,0,2]=4 198 B5R0.1 C[C@H](N)CCO CS-W019851 [0,1,0,0,0,0|2,0,1]=4 199 B5R0.1 C[C@H](O)CCO CS-W016671 [0,1,0,0,0,0|1,0,2]=4 200 B5R0.1 C\C(N)=C\C#N CS-0005803 [0,1,0,0,0,0|2,0,1]=4 201 B5R0.1 C\C=C\C(=O)O CS-0017976 [0,1,0,0,0,0|2,0,0]=3 202 B5R0.1 C\C=C\C(C)=O CS-0022376 [0,1,0,0,0,0|1,0,0]=2 203 B5R0.1 C\C=C\C(C)=O CS-0513711 [0,1,0,0,0,0|1,0,0]=2 204 B5R0.1 N#CCC(=O)[O-] CS-0162555 [0,1,0,0,0,0|2,0,1]=4 205 B5R0.1 N=C(O)CCN CS-W007497 [0,1,0,0,0,0|2,0,1]=4 206 B5R0.1 NC(=O)CCBr CS-0046169 [0,1,0,0,0,0|2,0,0]=3 207 B5R0.1 NC(=O)CCCl CS-0204808 [0,1,0,0,0,0|2,0,0]=3 208 B5R0.1 NC(=O)CCO CS-0205185 [0,1,0,0,0,0|2,0,0]=3 209 B5R0.1 NCCC(=O)O CS-0668359 [0,1,0,0,0,0|2,0,0]=3 210 B5R0.1 NCCC(=O)O CS-W020126 [0,1,0,0,0,0|2,0,0]=3 211 B5R0.1 NCCS(=O)O CS-6985 [0,1,0,0,0,0|3,0,0]=4 212 B5R0.1 NOCC(=O)O CS-8158 [0,1,0,0,0,0|2,0,0]=3 213 B5R0.1 O=C(O)CCF CS-0038385 [0,1,0,0,0,0|2,0,0]=3 214 B5R0.1 O=C(O)CCI CS-0204563 [0,1,0,0,0,0|2,0,0]=3 215 B5R0.1 O=C(O)CCO CS-0147832 [0,1,0,0,0,0|2,0,0]=3 216 B5R0.1 O=C(O)\C=C/Cl CS-0196837 [0,1,0,0,0,0|2,0,1]=4 217 B5R0.1 O=C(O)\C=C/I CS-0668652 [0,1,0,0,0,0|2,0,1]=4 218 B5R0.1 O=C(O)\C=C\Br CS-0063842 [0,1,0,0,0,0|2,0,1]=4 219 B5R0.1 O=C(O)\C=C\I CS-0092724 [0,1,0,0,0,0|2,0,1]=4 220 B5R0.1 O=P(=O)OO[Na] CS-0017801 [0,1,0,0,0,0|3,0,0]=4 221 B5R0.1 O=[N+]([O-])CCO CS-W013741 [0,1,0,0,0,0|3,0,0]=4 222 B5R0.3 C#CC(=O)NC CS-0202683 [0,1,0,0,0,0|1,0,1]=3 223 B5R0.3 C#CC(=O)O[Na] CS-0620485 [0,1,0,0,0,0|1,0,1]=3 224 B5R0.3 C=C(CCl)CCl CS-W011177 [0,1,0,0,0,0|3,0,0]=4 225 B5R0.3 C=C(CO)CO CS-W009247 [0,1,0,0,0,0|3,0,0]=4 226 B5R0.3 C=CC(=O)NC CS-0134564 [0,1,0,0,0,0|1,0,1]=3 227 B5R0.3 C=CC(=O)O[K] CS-0196459 [0,1,0,0,0,0|1,0,1]=3 228 B5R0.3 CCC(=N)NO CS-D0340 [0,1,0,0,0,0|2,0,1]=4 229 B5R0.3 CCC(=O)CBr CS-0131119 [0,1,0,0,0,0|1,0,0]=2 230 B5R0.3 CCC(=O)CN CS-W005374 [0,1,0,0,0,0|1,0,0]=2 231 B5R0.3 CCC(=O)CO CS-W005327 [0,1,0,0,0,0|1,0,0]=2 232 B5R0.3 CCC(=O)NC CS-0179730 [0,1,0,0,0,0|1,0,0]=2 233 B5R0.3 CCC(=O)NN CS-0206618 [0,1,0,0,0,0|2,0,0]=3 234 B5R0.3 CCC(=O)O[K] CS-0019431 [0,1,0,0,0,0|1,0,0]=2 235 B5R0.3 CCC(=O)O[Na] CS-0013802 [0,1,0,0,0,0|1,0,0]=2 236 B5R0.3 CCC(Br)CC CS-0015742 [0,1,0,0,0,0|2,0,1]=4 237 B5R0.3 CCC(C)C#N CS-0648856 [0,1,0,0,0,0|2,0,1]=4 238 B5R0.3 CCC(C)C#N CS-0649016 [0,1,0,0,0,0|2,0,1]=4 239 B5R0.3 CCC(C)C#N CS-0649019 [0,1,0,0,0,0|2,0,1]=4 240 B5R0.3 CCC(N)CC CS-0128806 [0,1,0,0,0,0|2,0,1]=4 241 B5R0.3 CCC(O)CC CS-0128838 [0,1,0,0,0,0|1,0,2]=4 242 B5R0.3 CCC(O)CN CS-0109319 [0,1,0,0,0,0|1,0,2]=4 243 B5R0.3 CCS(=O)CC CS-0199213 [0,1,0,0,0,0|2,0,0]=3 244 B5R0.3 CCS(=O)O[Na] CS-0020098 [0,1,0,0,0,0|2,0,0]=3 245 B5R0.3 CC[C@@H](C)CBr CS-0539690 [0,1,0,0,0,0|2,0,1]=4 246 B5R0.3 CC[C@@H](N)CO CS-W020734 [0,1,0,0,0,0|2,0,1]=4 247 B5R0.3 CC[C@H](C)CO CS-0139702 [0,1,0,0,0,0|1,0,2]=4 248 B5R0.3 CC[C@H](N)CO CS-W013745 [0,1,0,0,0,0|2,0,1]=4 249 B5R0.3 CC[C@H](O)CO CS-0031373 [0,1,0,0,0,0|1,0,2]=4 250 B5R0.3 CNC(=N)NN CS-0371525 [0,1,0,0,0,0|3,0,0]=4 251 B5R0.3 CNC(=O)CBr CS-0023001 [0,1,0,0,0,0|1,0,0]=2 252 B5R0.3 CNC(=O)CCl CS-W007769 [0,1,0,0,0,0|1,0,0]=2 253 B5R0.3 CNC(=O)CI CS-0244983 [0,1,0,0,0,0|1,0,0]=2 254 B5R0.3 CNC(=O)CN CS-0008246 [0,1,0,0,0,0|1,0,0]=2 255 B5R0.3 CNC(=O)CN CS-0130384 [0,1,0,0,0,0|1,0,0]=2 256 B5R0.3 CNC(=S)NC CS-0071975 [0,1,0,0,0,0|1,1,0]=3 257 B5R0.3 CNC(C)CO CS-0197105 [0,1,0,0,0,0|1,0,2]=4 258 B5R0.3 CN[C@@H](C)CO CS-0139480 [0,1,0,0,0,0|1,0,2]=4 259 B5R0.3 CN[C@@H](C)CO CS-0162089 [0,1,0,0,0,0|1,0,2]=4 260 B5R0.3 CN[C@H](C)CO CS-0162211 [0,1,0,0,0,0|1,0,2]=4 261 B5R0.3 COC(=N)CCl CS-0150960 [0,1,0,0,0,0|1,0,0]=2 262 B5R0.3 COC(=O)CI CS-0235696 [0,1,0,0,0,0|0,0,0]=1 263 B5R0.3 COC(=O)CN CS-W018508 [0,1,0,0,0,0|0,0,0]=1 264 B5R0.3 COC(=O)CO CS-W004068 [0,1,0,0,0,0|0,0,0]=1 265 B5R0.3 COC(=O)NN CS-0015902 [0,1,0,0,0,0|1,0,0]=2 266 B5R0.3 COC(=O)SCl CS-0313613 [0,1,0,0,0,0|1,0,0]=2 267 B5R0.3 COC(C)C#N CS-0372147 [0,1,0,0,0,0|1,0,1]=3 268 B5R0.3 CON(C)C=O CS-0128675 [0,1,0,0,0,0|1,0,0]=2 269 B5R0.3 COS(=O)OC CS-0230894 [0,1,0,0,0,0|1,0,0]=2 270 B5R0.3 CO[C@@H](C)CN CS-W021167 [0,1,0,0,0,0|1,0,1]=3 271 B5R0.3 CO[C@@H](C)CO CS-0096324 [0,1,0,0,0,0|0,0,2]=3 272 B5R0.3 CO[C@H](C)CN CS-0148788 [0,1,0,0,0,0|1,0,1]=3 273 B5R0.3 CO[C@H](C)CN CS-0613352 [0,1,0,0,0,0|1,0,1]=3 274 B5R0.3 CO[C@H](C)CO CS-W011349 [0,1,0,0,0,0|0,0,2]=3 275 B5R0.3 CSC(=N)NN CS-0105940 [0,1,0,0,0,0|2,1,0]=4 276 B5R0.3 CSC(=S)NN CS-0033768 [0,1,0,0,0,0|1,2,0]=4 277 B5R0.3 NCC(=O)O[Na] CS-W016662 [0,1,0,0,0,0|1,0,0]=2 278 B5R0.3 NNC(=O)CCl CS-0199719 [0,1,0,0,0,0|2,0,0]=3 279 B5R0.3 NNC(=O)CO CS-W006527 [0,1,0,0,0,0|2,0,0]=3 280 B5R0.3 NNC(=O)NN CS-0149890 [0,1,0,0,0,0|3,0,0]=4 281 B5R0.3 NNC(=O)NO CS-0328319 [0,1,0,0,0,0|3,0,0]=4 282 B5R0.3 O=C(CBr)CBr CS-W020932 [0,1,0,0,0,0|2,0,0]=3 283 B5R0.3 O=C(CI)O[Na] CS-0014819 [0,1,0,0,0,0|1,0,0]=2 284 B5R0.3 O=C(CO)CO CS-W019614 [0,1,0,0,0,0|2,0,0]=3 285 B5R0.3 O=C(CS)O[Na] CS-0197966 [0,1,0,0,0,0|1,0,0]=2 286 B5R0.3 O=C(OO)[Ag][Ag] CS-0015156 [0,1,0,0,0,0|2,0,0]=3 287 B5R0.3 O=S(CO)O[Na] CS-0046582 [0,1,0,0,0,0|2,0,0]=3 288 B5R0.3 O=[AlH3][AlH3]([Rh])OO CS-0133600 [0,1,0,0,0,0|3,0,0]=4 289 B5R0.3 [C@@H](O)(CC)CO CS-W005888 [0,1,0,0,0,0|1,0,2]=4 290 B5R0.4 CC(C)(C)ON CS-W004243 [0,1,0,0,0,0|2,0,1]=4 291 B5R0.4 CCC(C)(C)Br CS-0204230 [0,1,0,0,0,0|2,0,1]=4 292 B5R0.4 CCS(=O)(=O)O CS-0019432 [0,1,0,0,0,0|3,0,0]=4 293 B5R0.4 CCS(C)(=O)=O CS-0197307 [0,1,0,0,0,0|2,0,0]=3 294 B5R0.4 CCS(N)(=O)=O CS-W003034 [0,1,0,0,0,0|3,0,0]=4 295 B5R0.4 CC[N+](C)(C)C CS-0153899 [0,1,0,0,0,0|3,0,0]=4 296 B5R0.4 CNS(=O)(=O)Cl CS-0150984 [0,1,0,0,0,0|3,0,0]=4 297 B5R0.4 CNS(C)(=O)=O CS-W008054 [0,1,0,0,0,0|2,0,0]=3 298 B5R0.4 CNS(N)(=O)=O CS-0035488 [0,1,0,0,0,0|3,0,0]=4 299 B5R0.4 COS(C)(=O)=O CS-W004702 [0,1,0,0,0,0|1,0,0]=2 300 B5R0.4 CS(=O)(=O)NN CS-W022771 [0,1,0,0,0,0|3,0,0]=4 301 B5R0.4 CS(=O)(=O)O[K] CS-0179391 [0,1,0,0,0,0|2,0,0]=3 302 B5R0.4 CS(=O)(=O)O[Na] CS-0084592 [0,1,0,0,0,0|2,0,0]=3 303 B5R0.4 CS(=O)(=O)S[Na] CS-W013381 [0,1,0,0,0,0|2,1,0]=4 304 B5R0.4 C[Si](C)(C)O[K] CS-0006201 [0,1,0,0,0,0|2,1,0]=4 305 B5R0.4 NOS(=O)(=O)O CS-D1413 [0,1,0,0,0,0|3,0,0]=4 306 B5R0.4 O=S(=O)([Na])O[Na] CS-0015407 [0,1,0,0,0,0|3,0,0]=4 307 B5R0.4 O=S(O)(=[Ca])OO CS-0031707 [0,1,0,0,0,0|3,0,0]=4 308 B5R0.4 O=S(O)(=[Mg])OO CS-0017232 [0,1,0,0,0,0|3,0,0]=4 309 B5R0.5 C=C(C)B(O)O CS-0175097 [0,1,0,0,0,0|3,0,0]=4 310 B5R0.5 C=C(C)C(=O)[O-] CS-W012887 [0,1,0,0,0,0|2,0,0]=3 311 B5R0.5 C=C(C)C(N)=O CS-0031911 [0,1,0,0,0,0|2,0,0]=3 312 B5R0.5 C=C(Cl)C(=O)O CS-0187884 [0,1,0,0,0,0|2,0,1]=4 313 B5R0.5 C=C(F)C(=O)O CS-W005285 [0,1,0,0,0,0|2,0,1]=4 314 B5R0.5 CC(=O)C(=O)O CS-W020190 [0,1,0,0,0,0|2,0,0]=3 315 B5R0.5 CC(=O)C(=O)[O-] CS-W014944 [0,1,0,0,0,0|2,0,0]=3 316 B5R0.5 CC(=O)C(C)Br CS-0130132 [0,1,0,0,0,0|1,0,0]=2 317 B5R0.5 CC(=O)C(C)N CS-0105630 [0,1,0,0,0,0|1,0,0]=2 318 B5R0.5 CC(=O)C(F)F CS-0121252 [0,1,0,0,0,0|2,0,0]=3 319 B5R0.5 CC(=O)N(C)C CS-W023195 [0,1,0,0,0,0|1,0,0]=2 320 B5R0.5 CC(=O)[13C](=O)O CS-0514226 [0,1,0,0,0,0|2,0,0]=3 321 B5R0.5 CC(=O)[C@H](C)N CS-0197276 [0,1,0,0,0,0|1,0,0]=2 322 B5R0.5 CC(Br)C(N)=O CS-0139914 [0,1,0,0,0,0|2,0,0]=3 323 B5R0.5 CC(C)=C(C)Br CS-0188281 [0,1,0,0,0,0|2,0,0]=3 324 B5R0.5 CC(C)C(=N)N CS-0120122 [0,1,0,0,0,0|3,0,0]=4 325 B5R0.5 CC(C)C(N)=O CS-W019979 [0,1,0,0,0,0|2,0,0]=3 326 B5R0.5 CC(F)C(=O)O CS-0180920 [0,1,0,0,0,0|2,0,0]=3 327 B5R0.5 CC(N)C(=O)O CS-0022544 [0,1,0,0,0,0|2,0,0]=3 328 B5R0.5 CC(N)C(C)O CS-0217255 [0,1,0,0,0,0|1,0,2]=4 329 B5R0.5 CC(N)C(N)=O CS-0186552 [0,1,0,0,0,0|2,0,0]=3 330 B5R0.5 CC(O)C(=O)O CS-0013338 [0,1,0,0,0,0|2,0,0]=3 331 B5R0.5 CC(O)C(=O)O CS-0031116 [0,1,0,0,0,0|2,0,0]=3 332 B5R0.5 CC(O)C(=O)O CS-0310546 [0,1,0,0,0,0|2,0,0]=3 333 B5R0.5 CC(O)C(=O)[O-] CS-0021602 [0,1,0,0,0,0|2,0,0]=3 334 B5R0.5 CC(O)C(C)O CS-0099502 [0,1,0,0,0,0|1,0,2]=4 335 B5R0.5 CC(O)C(N)=O CS-0068194 [0,1,0,0,0,0|2,0,0]=3 336 B5R0.5 CN(C)C(=N)N CS-0036167 [0,1,0,0,0,0|3,0,0]=4 337 B5R0.5 CN(C)C(=N)N CS-0151357 [0,1,0,0,0,0|3,0,0]=4 338 B5R0.5 CN(C)C(N)=O CS-0132397 [0,1,0,0,0,0|2,0,0]=3 339 B5R0.5 CN(C)C(N)=S CS-0231074 [0,1,0,0,0,0|2,1,0]=4 340 B5R0.5 CN(N)C(=N)S CS-W013679 [0,1,0,0,0,0|2,1,0]=4 341 B5R0.5 C[C@@H](Cl)C(=O)O CS-0022394 [0,1,0,0,0,0|2,0,0]=3 342 B5R0.5 C[C@@H](F)C(N)=O CS-0637276 [0,1,0,0,0,0|2,0,0]=3 343 B5R0.5 C[C@@H](N)C(=O)O CS-W020127 [0,1,0,0,0,0|2,0,0]=3 344 B5R0.5 C[C@@H](N)C(N)=O CS-W005248 [0,1,0,0,0,0|2,0,0]=3 345 B5R0.5 C[C@@H](N)C(N)=O CS-W022738 [0,1,0,0,0,0|2,0,0]=3 346 B5R0.5 C[C@@H](O)C(N)=O CS-W016674 [0,1,0,0,0,0|2,0,0]=3 347 B5R0.5 C[C@@H](O)[C@@H](C)O CS-W016670 [0,1,0,0,0,0|1,0,2]=4 348 B5R0.5 C[C@H](Cl)C(=O)O CS-0020146 [0,1,0,0,0,0|2,0,0]=3 349 B5R0.5 C[C@H](F)C(N)=O CS-0637032 [0,1,0,0,0,0|2,0,0]=3 350 B5R0.5 C[C@H](N)C(=O)O CS-W020002 [0,1,0,0,0,0|2,0,0]=3 351 B5R0.5 C[C@H](N)C(N)=O CS-0005782 [0,1,0,0,0,0|2,0,0]=3 352 B5R0.5 C[C@H](N)C(N)=O CS-0119942 [0,1,0,0,0,0|2,0,0]=3 353 B5R0.5 C[C@H](N)C(N)=O CS-0539407 [0,1,0,0,0,0|2,0,0]=3 354 B5R0.5 C[C@H](O)C(=O)O CS-0015266 [0,1,0,0,0,0|2,0,0]=3 355 B5R0.5 C[C@H](O)C(N)=O CS-0330478 [0,1,0,0,0,0|2,0,0]=3 356 B5R0.5 C[C@H](O)[C@@H](C)O CS-0545500 [0,1,0,0,0,0|1,0,2]=4 357 B5R0.5 C[C@H](O)[C@H](C)O CS-0106462 [0,1,0,0,0,0|1,0,2]=4 358 B5R0.5 NC(=O)C(=O)O CS-W013748 [0,1,0,0,0,0|3,0,0]=4 359 B5R0.5 NC(=O)C(F)F CS-0109914 [0,1,0,0,0,0|3,0,0]=4 360 B5R0.5 NC(=O)C(N)=O CS-W016676 [0,1,0,0,0,0|3,0,0]=4 361 B5R0.5 NC(O)C(=O)O CS-0380752 [0,1,0,0,0,0|3,0,0]=4 362 B5R0.5 O=C(O)C(=O)O CS-0013716 [0,1,0,0,0,0|3,0,0]=4 363 B5R0.5 O=C(O)C(=O)O CS-0017264 [0,1,0,0,0,0|3,0,0]=4 364 B5R0.5 O=C(O)C(=O)O CS-0882464 [0,1,0,0,0,0|3,0,0]=4 365 B5R0.5 O=C(O)C(=O)O CS-W004907 [0,1,0,0,0,0|3,0,0]=4 366 B5R0.5 O=C(O)C(F)Cl CS-0204955 [0,1,0,0,0,0|3,0,0]=4 367 B5R0.5 O=C(O)[C@H](F)Cl CS-0434926 [0,1,0,0,0,0|3,0,0]=4 368 B5R0.5 O=C([O-])C(=O)[O-] CS-0199246 [0,1,0,0,0,0|3,0,0]=4 369 B5R0.5 O=C([O-])C(F)F CS-0121641 [0,1,0,0,0,0|3,0,0]=4 370 B5R0.5 [C@@H](C)(N)C(=O)O CS-0044074 [0,1,0,0,0,0|2,0,0]=3 371 B5R1.2 BrC1CCC1 CS-0044363 [0,0,0,1,0,0|2,0,1]=4 372 B5R1.2 CC1CCN1 CS-0051841 [0,0,0,1,0,0|2,0,1]=4 373 B5R1.2 C[C@@H]1CCN1 CS-0100346 [0,0,0,1,0,0|2,0,1]=4 374 B5R1.2 NC1CCC1 CS-0006655 [0,0,0,1,0,0|2,0,1]=4 375 B5R1.2 O=C1CCN1 CS-W011364 [0,0,0,1,0,0|1,0,0]=2 376 B5R1.2 O=C1CNC1 CS-W019264 [0,0,0,1,0,0|2,0,0]=3 377 B5R1.2 O=C1COC1 CS-M1912 [0,0,0,1,0,0|2,0,0]=3 378 B5R1.2 O=C1CSC1 CS-B0978 [0,0,0,1,0,0|2,0,0]=3 379 B5R1.2 OC1CCC1 CS-W013758 [0,0,0,1,0,0|1,0,2]=4 380 B5R1.3 CNC1CC1 CS-W019814 [0,0,0,1,0,0|2,0,1]=4 381 B5R1.5 CC1(N)CC1 CS-W003769 [0,0,0,1,0,0|2,0,1]=4 382 B2R0.1 C=CO CS-0015822 [2,0,0,0,0,0|0,0,1]=3 383 B2R0.1 CNC CS-0214151 [2,0,0,0,0,0|1,0,0]=3 384 B2R0.1 CNN CS-W022891 [2,0,0,0,0,0|2,0,0]=4 385 B2R0.1 CNO CS-W007348 [2,0,0,0,0,0|1,0,0]=3 386 B2R0.1 CON CS-W020192 [2,0,0,0,0,0|1,0,0]=3 387 B2R0.1 C[BiH]C CS-0085798 [2,0,0,0,0,0|1,0,0]=3 388 B2R0.1 C[Pd]C CS-1098490 [2,0,0,0,0,0|1,0,0]=3 389 B2R0.1 C[Pd]C CS-W002072 [2,0,0,0,0,0|1,0,0]=3 390 B2R0.1 C[SnH2]C CS-0199194 [2,0,0,0,0,0|1,0,0]=3 391 B2R0.1 N=CN CS-0214067 [2,0,0,0,0,0|2,0,0]=4 392 B2R0.1 N=CN CS-0214153 [2,0,0,0,0,0|2,0,0]=4 393 B2R0.1 N=CN CS-W007673 [2,0,0,0,0,0|2,0,0]=4 394 B2R0.1 O=CO CS-0205410 [2,0,0,0,0,0|0,0,0]=2 395 B2R0.1 O=C[O-] CS-0111021 [2,0,0,0,0,0|0,0,1]=3 396 B2R0.1 O=[Bi]Cl CS-0160141 [2,0,0,0,0,0|2,0,0]=4 397 B2R0.1 O=[Ir]=O CS-0082569 [2,0,0,0,0,0|1,0,1]=4 398 B2R0.1 O=[Mo]=O CS-0181883 [2,0,0,0,0,0|1,0,1]=4 399 B2R0.1 O=[Pt]=O CS-0149885 [2,0,0,0,0,0|1,0,1]=4 400 B2R0.1 O=[Pt]=O CS-W007817 [2,0,0,0,0,0|1,0,1]=4 401 B2R0.1 O=[Ru]=O CS-0015275 [2,0,0,0,0,0|1,0,1]=4 402 B2R0.1 O=[Ru]=O CS-0080854 [2,0,0,0,0,0|1,0,1]=4 403 B2R0.1 O=[Te]=O CS-0085576 [2,0,0,0,0,0|1,0,1]=4 404 B2R0.1 O=[Ti]=O CS-0044209 [2,0,0,0,0,0|1,0,1]=4 405 B2R0.1 O=[V]=O CS-0111597 [2,0,0,0,0,0|1,0,1]=4 406 B2R0.1 O=[Zr]=O CS-0111468 [2,0,0,0,0,0|1,0,1]=4 407 B2R0.1 O[Ni]O CS-0089243 [2,0,0,0,0,0|1,0,1]=4 408 B2R0.1 O[Zn]O CS-0635439 [2,0,0,0,0,0|1,0,1]=4 409 B4R0.2 C=CCCI CS-0139149 [1,1,0,0,0,0|1,0,1]=4 410 B4R0.2 C=CCCN CS-0028781 [1,1,0,0,0,0|1,0,1]=4 411 B4R0.2 C=CCON CS-0010194 [1,1,0,0,0,0|1,0,1]=4 412 B4R0.2 CC#CCN CS-0307944 [1,1,0,0,0,0|1,0,1]=4 413 B4R0.2 CC#CCO CS-B1382 [1,1,0,0,0,0|1,0,1]=4 414 B4R0.2 CCCCN CS-0214149 [1,1,0,0,0,0|1,0,1]=4 415 B4R0.2 CCNC=O CS-0187584 [1,1,0,0,0,0|1,0,0]=3 416 B4R0.2 CCNCC CS-0160324 [1,1,0,0,0,0|1,0,1]=4 417 B4R0.2 CCOC=N CS-0333913 [1,1,0,0,0,0|1,0,0]=3 418 B4R0.2 CNCCBr CS-0042068 [1,1,0,0,0,0|1,0,1]=4 419 B4R0.2 CNCCCl CS-W019383 [1,1,0,0,0,0|1,0,1]=4 420 B4R0.2 CNCCO CS-0542090 [1,1,0,0,0,0|1,0,1]=4 421 B4R0.2 CNCCO CS-W008875 [1,1,0,0,0,0|1,0,1]=4 422 B4R0.2 COCC#N CS-0128800 [1,1,0,0,0,0|0,0,2]=4 423 B4R0.2 COCCBr CS-0015336 [1,1,0,0,0,0|0,0,1]=3 424 B4R0.2 COCCI CS-0139205 [1,1,0,0,0,0|0,0,1]=3 425 B4R0.2 COCCO CS-0179325 [1,1,0,0,0,0|0,0,1]=3 426 B4R0.2 COCCO CS-0200432 [1,1,0,0,0,0|0,0,1]=3 427 B4R0.2 CSCCN CS-0063136 [1,1,0,0,0,0|0,1,1]=4 428 B4R0.2 CSCCO CS-0150086 [1,1,0,0,0,0|0,1,1]=4 429 B4R0.2 CSCSC CS-W013673 [1,1,0,0,0,0|0,1,1]=4 430 B4R0.2 NCCON CS-M2746 [1,1,0,0,0,0|1,0,1]=4 431 B4R0.2 NOCCO CS-W011361 [1,1,0,0,0,0|1,0,1]=4 432 B4R0.2 O=COO[Cs] CS-0534192 [1,1,0,0,0,0|1,0,0]=3 433 B4R0.2 O=COO[Cs] CS-W008901 [1,1,0,0,0,0|1,0,0]=3 434 B4R0.2 O=COO[K] CS-0644452 [1,1,0,0,0,0|1,0,0]=3 435 B4R0.2 O=COO[Rb] CS-0146110 [1,1,0,0,0,0|1,0,0]=3 436 B4R0.2 O=C[N-]C=O CS-0170804 [1,1,0,0,0,0|1,0,1]=4 437 B4R0.2 O=NOO[Rb] CS-0146112 [1,1,0,0,0,0|2,0,0]=4 438 B4R0.2 [Li]OOC=O CS-0013647 [1,1,0,0,0,0|1,0,0]=3 439 B4R0.3 CC(C)(C)N CS-0161392 [1,1,0,0,0,0|1,0,1]=4 440 B4R0.3 CN(C)(C)=O CS-0063748 [1,1,0,0,0,0|1,0,0]=3 441 B4R0.3 CP(C)(=O)O CS-0772300 [1,1,0,0,0,0|1,0,0]=3 442 B4R0.3 CS(=O)(=O)O CS-0035248 [1,1,0,0,0,0|1,0,0]=3 443 B4R0.3 CS(=O)(=O)O CS-0620387 [1,1,0,0,0,0|1,0,0]=3 444 B4R0.3 CS(C)(=N)=O CS-W000747 [1,1,0,0,0,0|1,0,0]=3 445 B4R0.3 CS(C)(=O)=O CS-0017786 [1,1,0,0,0,0|1,0,0]=3 446 B4R0.3 CS(N)(=O)=O CS-W020062 [1,1,0,0,0,0|1,0,1]=4 447 B4R0.3 C[N+](C)(C)C CS-0146412 [1,1,0,0,0,0|2,0,0]=4 448 B4R0.3 C[N+](C)(C)C CS-0179507 [1,1,0,0,0,0|2,0,0]=4 449 B4R0.3 C[N+](C)(C)C CS-0185871 [1,1,0,0,0,0|2,0,0]=4 450 B4R0.3 C[N+](C)(C)C CS-0188513 [1,1,0,0,0,0|2,0,0]=4 451 B4R0.3 C[N+](C)(C)C CS-0212442 [1,1,0,0,0,0|2,0,0]=4 452 B4R0.3 C[N+](C)(C)C CS-0528869 [1,1,0,0,0,0|2,0,0]=4 453 B4R0.3 C[N+](C)(C)C CS-W018526 [1,1,0,0,0,0|2,0,0]=4 454 B4R0.3 C[N+](C)(C)C CS-W020924 [1,1,0,0,0,0|2,0,0]=4 455 B4R0.3 C[N+](C)(C)[O-] CS-0031514 [1,1,0,0,0,0|1,0,1]=4 456 B4R0.3 C[Pt](C)(C)C CS-0105950 [1,1,0,0,0,0|2,0,0]=4 457 B4R0.3 C[Pt](C)(C)I CS-0085768 [1,1,0,0,0,0|2,0,0]=4 458 B4R0.3 C[Re](=O)(=O)=O CS-0111758 [1,1,0,0,0,0|1,0,1]=4 459 B4R0.3 C[S+](C)(C)=O CS-0097768 [1,1,0,0,0,0|1,0,0]=3 460 B4R0.3 C[S+](C)(C)=O CS-W018549 [1,1,0,0,0,0|1,0,0]=3 461 B4R0.3 C[Ti](C)(Cl)Cl CS-0026546 [1,1,0,0,0,0|2,0,0]=4 462 B4R0.3 C[Zr](C)(Cl)Cl CS-0020515 [1,1,0,0,0,0|2,0,0]=4 463 B4R0.3 NS(=O)(=O)O CS-W020895 [1,1,0,0,0,0|2,0,0]=4 464 B4R0.3 O=P(O)(O)O CS-0013600 [1,1,0,0,0,0|2,0,0]=4 465 B4R0.3 O=P(O)(O)O CS-0187434 [1,1,0,0,0,0|2,0,0]=4 466 B4R0.3 O=P(O)(O)O CS-0465635 [1,1,0,0,0,0|2,0,0]=4 467 B4R0.3 O=P(O)(O)O CS-0667101 [1,1,0,0,0,0|2,0,0]=4 468 B4R0.3 O=S(=O)(O)O CS-W013315 [1,1,0,0,0,0|2,0,0]=4 469 B4R0.3 O=[Bi](O)(O)[Na] CS-0144857 [1,1,0,0,0,0|2,0,0]=4 470 B6R0.1 C#CC(=O)NCC CS-0168077 [0,2,0,0,0,0|1,0,1]=4 471 B6R0.1 C=CC(=O)NCC CS-W013719 [0,2,0,0,0,0|1,0,1]=4 472 B6R0.1 C=CCC(=O)OC CS-0158011 [0,2,0,0,0,0|0,0,0]=2 473 B6R0.1 CC#CC(=O)OC CS-0066219 [0,2,0,0,0,0|0,0,0]=2 474 B6R0.1 CCC(=O)COC CS-0213932 [0,2,0,0,0,0|0,0,0]=2 475 B6R0.1 CCCC(=O)NN CS-0152447 [0,2,0,0,0,0|2,0,0]=4 476 B6R0.1 CCNC(=O)CBr CS-0239382 [0,2,0,0,0,0|1,0,0]=3 477 B6R0.1 CCOC(=O)C#N CS-0022374 [0,2,0,0,0,0|0,0,1]=3 478 B6R0.1 CCOC(=O)CN CS-W020007 [0,2,0,0,0,0|0,0,0]=2 479 B6R0.1 CCOC(=O)CO CS-W019892 [0,2,0,0,0,0|0,0,0]=2 480 B6R0.1 CCOC(=O)NN CS-W008412 [0,2,0,0,0,0|1,0,0]=3 481 B6R0.1 CCOC(C)CC CS-0196425 [0,2,0,0,0,0|1,0,1]=4 482 B6R0.1 CCO\C(C)=N\O CS-W013688 [0,2,0,0,0,0|0,0,1]=3 483 B6R0.1 CNC(=O)CC#N CS-W018827 [0,2,0,0,0,0|1,0,0]=3 484 B6R0.1 CNC(=O)CCCl CS-0143787 [0,2,0,0,0,0|1,0,0]=3 485 B6R0.1 CNC(=O)CCO CS-0188403 [0,2,0,0,0,0|1,0,0]=3 486 B6R0.1 CNC(C)COC CS-0301311 [0,2,0,0,0,0|1,0,1]=4 487 B6R0.1 CNCC(=O)O[Na] CS-0077129 [0,2,0,0,0,0|1,0,0]=3 488 B6R0.1 COC(=O)C#CBr CS-0043861 [0,2,0,0,0,0|0,0,1]=3 489 B6R0.1 COC(=O)C#CI CS-0513737 [0,2,0,0,0,0|0,0,1]=3 490 B6R0.1 COC(=O)CC#N CS-W016657 [0,2,0,0,0,0|0,0,0]=2 491 B6R0.1 COC(=O)CCBr CS-W008728 [0,2,0,0,0,0|0,0,0]=2 492 B6R0.1 COC(=O)CCCl CS-0131786 [0,2,0,0,0,0|0,0,0]=2 493 B6R0.1 COC(=O)CCI CS-0615889 [0,2,0,0,0,0|0,0,0]=2 494 B6R0.1 COC(=O)CCN CS-W007648 [0,2,0,0,0,0|0,0,0]=2 495 B6R0.1 COC(=O)CCO CS-0022864 [0,2,0,0,0,0|0,0,0]=2 496 B6R0.1 COC(=O)CCS CS-0000049 [0,2,0,0,0,0|0,0,0]=2 497 B6R0.1 COC(=O)OCCl CS-0067504 [0,2,0,0,0,0|0,0,0]=2 498 B6R0.1 COC(=O)\C=C/I CS-0150951 [0,2,0,0,0,0|0,0,1]=3 499 B6R0.1 COC(=O)\C=C\I CS-0042162 [0,2,0,0,0,0|0,0,1]=3 500 B6R0.1 COC(C)CCO CS-W013686 [0,2,0,0,0,0|0,0,2]=4 501 B6R0.1 COCC(=O)NN CS-W005634 [0,2,0,0,0,0|1,0,0]=3 502 B6R0.1 COCC(N)CO CS-0106469 [0,2,0,0,0,0|1,0,1]=4 503 B6R0.1 COCC(O)CN CS-0106474 [0,2,0,0,0,0|0,0,2]=4 504 B6R0.1 N#CCC(=O)NN CS-4488 [0,2,0,0,0,0|2,0,0]=4 505 B6R0.1 N#CCC(=O)O[Na] CS-0187634 [0,2,0,0,0,0|1,0,0]=3 506 B6R0.1 NNC(=O)CCS CS-0513962 [0,2,0,0,0,0|2,0,0]=4 507 B6R0.1 O=C(CCl)NCO CS-0147071 [0,2,0,0,0,0|1,0,0]=3 508 B6R0.2 CC(=O)CC(N)=O CS-0134202 [0,2,0,0,0,0|1,0,1]=4 509 B6R0.2 CC(=O)CN(C)C CS-0204530 [0,2,0,0,0,0|1,0,0]=3 510 B6R0.2 CC(=O)C[C@@H](C)N CS-0434876 [0,2,0,0,0,0|1,0,0]=3 511 B6R0.2 CC(=O)NC(C)C CS-M3536 [0,2,0,0,0,0|1,0,0]=3 512 B6R0.2 CC(=O)OC(C)Br CS-0135277 [0,2,0,0,0,0|0,0,0]=2 513 B6R0.2 CC(=O)[CH-]C(C)=O CS-0196895 [0,2,0,0,0,0|1,0,0]=3 514 B6R0.2 CC(=O)\C=C(\C)[O-] CS-0035182 [0,2,0,0,0,0|1,0,0]=3 515 B6R0.2 CC(=O)\C=C(\C)[O-] CS-0085298 [0,2,0,0,0,0|1,0,0]=3 516 B6R0.2 CC(=O)\C=C(\C)[O-] CS-0085476 [0,2,0,0,0,0|1,0,0]=3 517 B6R0.2 CC(=O)\C=C(\C)[O-] CS-0105902 [0,2,0,0,0,0|1,0,0]=3 518 B6R0.2 CC(C)=CC(=O)O CS-W011327 [0,2,0,0,0,0|2,0,0]=4 519 B6R0.2 CC(C)CC(=O)O CS-0881782 [0,2,0,0,0,0|2,0,0]=4 520 B6R0.2 CC(C)CC(=O)O CS-W013696 [0,2,0,0,0,0|2,0,0]=4 521 B6R0.2 CC(C)NC(N)=O CS-0162822 [0,2,0,0,0,0|2,0,0]=4 522 B6R0.2 CC(C)OC(=S)[S-] CS-0154170 [0,2,0,0,0,0|1,1,0]=4 523 B6R0.2 CC(C)OC(N)=O CS-0119929 [0,2,0,0,0,0|1,0,0]=3 524 B6R0.2 CC(N)CC(=O)O CS-W009549 [0,2,0,0,0,0|2,0,0]=4 525 B6R0.2 CC(O)CC(=O)O CS-0062335 [0,2,0,0,0,0|2,0,0]=4 526 B6R0.2 CC(O)CC(N)=O CS-0435186 [0,2,0,0,0,0|2,0,0]=4 527 B6R0.2 CN(C)CC(=O)O CS-D1391 [0,2,0,0,0,0|2,0,0]=4 528 B6R0.2 CN(C)CC(=O)O CS-W001158 [0,2,0,0,0,0|2,0,0]=4 529 B6R0.2 C[C@H](N)CC(=O)O CS-0031371 [0,2,0,0,0,0|2,0,0]=4 530 B6R0.2 C[C@H](N)CC(=O)O CS-W001210 [0,2,0,0,0,0|2,0,0]=4 531 B6R0.2 C[C@H](O)CC(=O)O CS-0031375 [0,2,0,0,0,0|2,0,0]=4 532 B6R0.2 C\C(Cl)=C/C(=O)O CS-0834363 [0,2,0,0,0,0|2,0,0]=4 533 B6R0.2 C\C(Cl)=C\C(=O)O CS-0834361 [0,2,0,0,0,0|2,0,0]=4 534 B6R0.2 [C@H](C)(N)CC(=O)O CS-0044025 [0,2,0,0,0,0|2,0,0]=4 535 B6R0.2 [C@H](C)(N)CC(=O)O CS-W005235 [0,2,0,0,0,0|2,0,0]=4 536 B6R0.2 [C@H](C)(O)CC(=O)O CS-0044101 [0,2,0,0,0,0|2,0,0]=4 537 B6R0.3 C(C)=C(/C)C(=O)O CS-W009553 [0,2,0,0,0,0|1,0,0]=3 538 B6R0.3 C=C(C)C(=O)NC CS-0167922 [0,2,0,0,0,0|1,0,0]=3 539 B6R0.3 C=C(C)C(=O)O[Na] CS-W016633 [0,2,0,0,0,0|1,0,0]=3 540 B6R0.3 C=C(CBr)C(=O)O CS-W017896 [0,2,0,0,0,0|2,0,0]=4 541 B6R0.3 C=CC(=O)N(C)C CS-0016062 [0,2,0,0,0,0|1,0,1]=4 542 B6R0.3 C=CC(C)C(=O)O CS-0006592 [0,2,0,0,0,0|2,0,0]=4 543 B6R0.3 C=CN(C)C(C)=O CS-W013718 [0,2,0,0,0,0|1,0,0]=3 544 B6R0.3 CC(=O)C(=O)CBr CS-0199660 [0,2,0,0,0,0|1,0,0]=3 545 B6R0.3 CC(=O)C(=O)O[K] CS-0155155 [0,2,0,0,0,0|1,0,0]=3 546 B6R0.3 CC(=O)C(=O)O[Na] CS-W016629 [0,2,0,0,0,0|1,0,0]=3 547 B6R0.3 CC(C#N)C(=O)O CS-0139286 [0,2,0,0,0,0|2,0,0]=4 548 B6R0.3 CC(C)C(=O)CBr CS-0020096 [0,2,0,0,0,0|1,0,0]=3 549 B6R0.3 CC(C)C(=O)NN CS-0053723 [0,2,0,0,0,0|2,0,0]=4 550 B6R0.3 CC(C)C(=O)O[K] CS-0196930 [0,2,0,0,0,0|1,0,0]=3 551 B6R0.3 CC(C)C(=O)O[Na] CS-0040347 [0,2,0,0,0,0|1,0,0]=3 552 B6R0.3 CC(C)S(=O)O[Na] CS-M3052 [0,2,0,0,0,0|2,0,0]=4 553 B6R0.3 CC(CBr)C(=O)O CS-W016048 [0,2,0,0,0,0|2,0,0]=4 554 B6R0.3 CC(CN)C(=O)O CS-W013690 [0,2,0,0,0,0|2,0,0]=4 555 B6R0.3 CC(O)C(=O)O[Na] CS-0030973 [0,2,0,0,0,0|1,0,0]=3 556 B6R0.3 CCC(=O)C(=O)O CS-W007926 [0,2,0,0,0,0|1,0,1]=4 557 B6R0.3 CCC(=O)C(C)=O CS-W013714 [0,2,0,0,0,0|1,0,0]=3 558 B6R0.3 CCC(=O)N(C)C CS-W001248 [0,2,0,0,0,0|1,0,0]=3 559 B6R0.3 CCC(=S)N(C)C CS-0160405 [0,2,0,0,0,0|1,1,0]=4 560 B6R0.3 CCC(Br)C(N)=O CS-0152635 [0,2,0,0,0,0|2,0,0]=4 561 B6R0.3 CCC(N)C(=O)O CS-W011306 [0,2,0,0,0,0|2,0,0]=4 562 B6R0.3 CCC(N)C(N)=O CS-0197483 [0,2,0,0,0,0|2,0,0]=4 563 B6R0.3 CCC(O)C(N)=O CS-0232591 [0,2,0,0,0,0|2,0,0]=4 564 B6R0.3 CC[C@@H](Br)C(=O)O CS-0142640 [0,2,0,0,0,0|2,0,0]=4 565 B6R0.3 CC[C@@H](C)C(=O)O CS-0130653 [0,2,0,0,0,0|1,0,1]=4 566 B6R0.3 CC[C@@H](N)C(=O)O CS-D1130 [0,2,0,0,0,0|2,0,0]=4 567 B6R0.3 CC[C@@H](N)C(N)=O CS-0011806 [0,2,0,0,0,0|2,0,0]=4 568 B6R0.3 CC[C@@H](O)C(=O)O CS-0107851 [0,2,0,0,0,0|2,0,0]=4 569 B6R0.3 CC[C@H](Br)C(=O)O CS-0188297 [0,2,0,0,0,0|2,0,0]=4 570 B6R0.3 CC[C@H](C)C(=O)O CS-0120626 [0,2,0,0,0,0|1,0,1]=4 571 B6R0.3 CC[C@H](N)C(=O)O CS-0044026 [0,2,0,0,0,0|2,0,0]=4 572 B6R0.3 CC[C@H](N)C(N)=O CS-0011803 [0,2,0,0,0,0|2,0,0]=4 573 B6R0.3 CC[C@H](N)C(N)=O CS-B0864 [0,2,0,0,0,0|2,0,0]=4 574 B6R0.3 CC[C@H](O)C(=O)O CS-W019285 [0,2,0,0,0,0|2,0,0]=4 575 B6R0.3 CN(C)C(=O)CBr CS-W017882 [0,2,0,0,0,0|1,0,0]=3 576 B6R0.3 CN(C)C(=O)CCl CS-0008654 [0,2,0,0,0,0|1,0,0]=3 577 B6R0.3 CN(C)C(=O)CI CS-0239613 [0,2,0,0,0,0|1,0,0]=3 578 B6R0.3 CN(C)C(=O)CN CS-0041045 [0,2,0,0,0,0|1,0,0]=3 579 B6R0.3 CN(C)C(=O)CN CS-B0440 [0,2,0,0,0,0|1,0,0]=3 580 B6R0.3 CN(C)C(=O)CN CS-W003959 [0,2,0,0,0,0|1,0,0]=3 581 B6R0.3 CN(C)C(=O)CO CS-0077250 [0,2,0,0,0,0|1,0,0]=3 582 B6R0.3 CNC(=O)C(=O)O CS-0113142 [0,2,0,0,0,0|1,0,1]=4 583 B6R0.3 CNC(=O)C(C)N CS-0154032 [0,2,0,0,0,0|1,0,0]=3 584 B6R0.3 CNC(=O)[C@@H](C)N CS-0169315 [0,2,0,0,0,0|1,0,0]=3 585 B6R0.3 CNC(=O)[C@H](C)N CS-0169314 [0,2,0,0,0,0|1,0,0]=3 586 B6R0.3 CNC(C)C(=O)O CS-W011307 [0,2,0,0,0,0|1,0,1]=4 587 B6R0.3 CN[C@H](C)C(=O)O CS-0094542 [0,2,0,0,0,0|1,0,1]=4 588 B6R0.3 COC(=O)C(=N)N CS-0038769 [0,2,0,0,0,0|0,0,1]=3 589 B6R0.3 COC(=O)C(C)=O CS-W013701 [0,2,0,0,0,0|0,0,0]=2 590 B6R0.3 COC(=O)C(C)Br CS-0154978 [0,2,0,0,0,0|0,0,0]=2 591 B6R0.3 COC(=O)C(C)N CS-W011040 [0,2,0,0,0,0|0,0,0]=2 592 B6R0.3 COC(=O)[C@H](C)N CS-W008772 [0,2,0,0,0,0|0,0,0]=2 593 B6R0.3 COC(=O)[C@H](C)O CS-WAA0219 [0,2,0,0,0,0|0,0,0]=2 594 B6R0.3 COC(C)C(=O)O CS-W004806 [0,2,0,0,0,0|0,0,1]=3 595 B6R0.3 CON(C)C(C)=O CS-W001095 [0,2,0,0,0,0|0,0,0]=2 596 B6R0.3 CO[C@@H](C)C(=O)O CS-D0537 [0,2,0,0,0,0|0,0,1]=3 597 B6R0.3 C[C@@H](CN)C(=O)O CS-0059829 [0,2,0,0,0,0|2,0,0]=4 598 B6R0.3 C[C@@H](CN)C(=O)O CS-0062338 [0,2,0,0,0,0|2,0,0]=4 599 B6R0.3 C[C@H](CN)C(=O)O CS-0059837 [0,2,0,0,0,0|2,0,0]=4 600 B6R0.3 C[C@H](CN)C(=O)O CS-0444634 [0,2,0,0,0,0|2,0,0]=4 601 B6R0.3 C[C@H](O)C(=O)O[Na] CS-0895775 [0,2,0,0,0,0|1,0,0]=3 602 B6R0.3 C[C@H](O)C(=O)O[Na] CS-0897268 [0,2,0,0,0,0|1,0,0]=3 603 B6R0.3 C[C@H](O)C(=O)O[Na] CS-W020973 [0,2,0,0,0,0|1,0,0]=3 604 B6R0.3 C\C=C(/C)C(=O)O CS-0356606 [0,2,0,0,0,0|1,0,0]=3 605 B6R0.3 C\C=C(/C)C(=O)O CS-W013715 [0,2,0,0,0,0|1,0,0]=3 606 B6R0.3 NC(=O)C(=O)O[Na] CS-0109107 [0,2,0,0,0,0|1,0,1]=4 607 B6R0.3 NC(=O)C(Br)CBr CS-0013982 [0,2,0,0,0,0|2,0,0]=4 608 B6R0.3 NC(=O)[C@@H](N)CO CS-W008254 [0,2,0,0,0,0|2,0,0]=4 609 B6R0.3 NC(=O)[C@H](N)CO CS-0158516 [0,2,0,0,0,0|2,0,0]=4 610 B6R0.3 NC(CO)C(=O)O CS-0015292 [0,2,0,0,0,0|2,0,0]=4 611 B6R0.3 NC(CS)C(=O)O CS-0201576 [0,2,0,0,0,0|2,0,0]=4 612 B6R0.3 NC(CS)C(=O)O CS-W013566 [0,2,0,0,0,0|2,0,0]=4 613 B6R0.3 NC(CS)C(=O)O CS-W014367 [0,2,0,0,0,0|2,0,0]=4 614 B6R0.3 NC(CS)C(=O)O CS-W017432 [0,2,0,0,0,0|2,0,0]=4 615 B6R0.3 NCC(F)C(=O)O CS-W011291 [0,2,0,0,0,0|2,0,0]=4 616 B6R0.3 NCC(N)C(=O)O CS-0130703 [0,2,0,0,0,0|2,0,0]=4 617 B6R0.3 NCC(N)C(=O)O CS-W014390 [0,2,0,0,0,0|2,0,0]=4 618 B6R0.3 NCC(O)C(=O)O CS-W013682 [0,2,0,0,0,0|2,0,0]=4 619 B6R0.3 NC[C@@H](N)C(=O)O CS-0311806 [0,2,0,0,0,0|2,0,0]=4 620 B6R0.3 NC[C@@H](N)C(=O)O CS-W011028 [0,2,0,0,0,0|2,0,0]=4 621 B6R0.3 NC[C@@H](O)C(=O)O CS-0105320 [0,2,0,0,0,0|2,0,0]=4 622 B6R0.3 NC[C@H](N)C(=O)O CS-W014389 [0,2,0,0,0,0|2,0,0]=4 623 B6R0.3 NNC(=O)C(F)F CS-0523673 [0,2,0,0,0,0|2,0,0]=4 624 B6R0.3 N[C@@H](CCl)C(=O)O CS-7792 [0,2,0,0,0,0|2,0,0]=4 625 B6R0.3 N[C@@H](CO)C(=O)O CS-0201873 [0,2,0,0,0,0|2,0,0]=4 626 B6R0.3 N[C@@H](CO)C(=O)O CS-W020136 [0,2,0,0,0,0|2,0,0]=4 627 B6R0.3 N[C@@H](CS)C(=O)O CS-W009027 [0,2,0,0,0,0|2,0,0]=4 628 B6R0.3 N[C@@H](CS)C(=O)O CS-W017431 [0,2,0,0,0,0|2,0,0]=4 629 B6R0.3 N[C@@H](CS)C(=O)O CS-W018517 [0,2,0,0,0,0|2,0,0]=4 630 B6R0.3 N[C@H](CCl)C(=O)O CS-0100201 [0,2,0,0,0,0|2,0,0]=4 631 B6R0.3 N[C@H](CCl)C(=O)O CS-W016173 [0,2,0,0,0,0|2,0,0]=4 632 B6R0.3 N[C@H](CO)C(=O)O CS-D1751 [0,2,0,0,0,0|2,0,0]=4 633 B6R0.3 N[C@H](CS)C(=O)O CS-W002074 [0,2,0,0,0,0|2,0,0]=4 634 B6R0.3 N[C@H](CS)C(=O)O CS-W019341 [0,2,0,0,0,0|2,0,0]=4 635 B6R0.3 O=C(O)C(=O)CBr CS-5517 [0,2,0,0,0,0|2,0,0]=4 636 B6R0.3 O=C(O)C(=O)O[K] CS-0198035 [0,2,0,0,0,0|1,0,1]=4 637 B6R0.3 O=C(O)C(O)CCl CS-0186802 [0,2,0,0,0,0|2,0,0]=4 638 B6R0.3 O=C(O)C(O)CO CS-W018821 [0,2,0,0,0,0|2,0,0]=4 639 B6R0.3 O=S(O[Na])C(F)F CS-0121058 [0,2,0,0,0,0|2,0,0]=4 640 B6R0.3 [C@@H](C)(Cl)C(=O)OC CS-W011191 [0,2,0,0,0,0|0,0,0]=2 641 B6R0.3 [C@@H](C)(NC)C(=O)O CS-W016642 [0,2,0,0,0,0|1,0,1]=4 642 B6R0.3 [C@H](C)(N)C(=O)OC CS-W007986 [0,2,0,0,0,0|0,0,0]=2 643 B6R0.3 [C@H](C)(OC)C(=O)O CS-0044100 [0,2,0,0,0,0|0,0,1]=3 644 B6R0.3 [C@H](N)(CC)C(=O)O CS-W011305 [0,2,0,0,0,0|2,0,0]=4 645 B6R0.3 [C@H](O)(CN)C(=O)O CS-W013683 [0,2,0,0,0,0|2,0,0]=4 646 B6R0.3 [Li]OC(=O)C(C)O CS-W011341 [0,2,0,0,0,0|1,0,0]=3 647 B6R0.3 [Li]OC(=O)[C@H](C)O CS-0015207 [0,2,0,0,0,0|1,0,0]=3 648 B6R0.4 C#CCCC(=O)O CS-W008784 [0,2,0,0,0,0|2,0,0]=4 649 B6R0.4 C#CCNC(C)=O CS-0434175 [0,2,0,0,0,0|1,0,0]=3 650 B6R0.4 C#CCNC(N)=O CS-0042340 [0,2,0,0,0,0|2,0,0]=4 651 B6R0.4 C#CCOC(C)=O CS-0158541 [0,2,0,0,0,0|0,0,0]=2 652 B6R0.4 C=CCCC(=O)O CS-W009138 [0,2,0,0,0,0|2,0,0]=4 653 B6R0.4 C=CCNC(N)=O CS-0197283 [0,2,0,0,0,0|2,0,0]=4 654 B6R0.4 CC(=O)CCCCl CS-W013569 [0,2,0,0,0,0|1,0,0]=3 655 B6R0.4 CC(=O)CCCO CS-0020001 [0,2,0,0,0,0|1,0,0]=3 656 B6R0.4 CC(=O)NCCO CS-W013689 [0,2,0,0,0,0|1,0,0]=3 657 B6R0.4 CC(=O)OCCBr CS-W007598 [0,2,0,0,0,0|0,0,0]=2 658 B6R0.4 CC(=O)OCCN CS-0657679 [0,2,0,0,0,0|0,0,0]=2 659 B6R0.4 CC(=O)OCCO CS-0154995 [0,2,0,0,0,0|0,0,0]=2 660 B6R0.4 CC(C)=CCCBr CS-0155165 [0,2,0,0,0,0|2,0,0]=4 661 B6R0.4 CC(C)OCCBr CS-W018660 [0,2,0,0,0,0|1,0,1]=4 662 B6R0.4 CCC#CC(=O)O CS-W013726 [0,2,0,0,0,0|2,0,0]=4 663 B6R0.4 CCCNC(C)=O CS-0246738 [0,2,0,0,0,0|1,0,0]=3 664 B6R0.4 CCCOC(N)=O CS-W019060 [0,2,0,0,0,0|1,0,0]=3 665 B6R0.4 CCNCC(=O)O CS-0201673 [0,2,0,0,0,0|2,0,0]=4 666 B6R0.4 CCOCC(=O)O CS-0071579 [0,2,0,0,0,0|1,0,0]=3 667 B6R0.4 CCSCC(=O)O CS-0197336 [0,2,0,0,0,0|1,1,0]=4 668 B6R0.4 CC\C=C\C(=O)O CS-0053528 [0,2,0,0,0,0|2,0,0]=4 669 B6R0.4 CNCCC(=O)O CS-0112815 [0,2,0,0,0,0|2,0,0]=4 670 B6R0.4 CNCCC(=O)O CS-0169148 [0,2,0,0,0,0|2,0,0]=4 671 B6R0.4 CNCCC(N)=O CS-0214971 [0,2,0,0,0,0|2,0,0]=4 672 B6R0.4 COCCC(=O)O CS-W009112 [0,2,0,0,0,0|1,0,0]=3 673 B6R0.4 CO\C=C\C(=O)O CS-0201343 [0,2,0,0,0,0|1,0,0]=3 674 B6R0.4 CO\C=C\C(C)=O CS-0145411 [0,2,0,0,0,0|0,0,0]=2 675 B6R0.4 CO\C=C\C(C)=O CS-W013712 [0,2,0,0,0,0|0,0,0]=2 676 B6R0.4 CS(=O)CCCN CS-0286765 [0,2,0,0,0,0|2,0,0]=4 677 B6R0.4 CSCCC(=O)O CS-6296 [0,2,0,0,0,0|1,1,0]=4 678 B6R0.4 CSCCC(C)=O CS-0206726 [0,2,0,0,0,0|0,1,0]=3 679 B6R0.4 C\C=C\CC(=O)O CS-0129103 [0,2,0,0,0,0|2,0,0]=4 680 B6R0.4 N#CCCC(=O)O CS-W018565 [0,2,0,0,0,0|2,0,0]=4 681 B6R0.4 NC(=O)NCCCl CS-0317452 [0,2,0,0,0,0|2,0,0]=4 682 B6R0.4 NCCCC(=O)O CS-W020704 [0,2,0,0,0,0|2,0,0]=4 683 B6R0.4 NCCCC(N)=O CS-0103894 [0,2,0,0,0,0|2,0,0]=4 684 B6R0.4 NCCNC(N)=O CS-0139236 [0,2,0,0,0,0|2,0,0]=4 685 B6R0.4 O=C(O)C#CCO CS-0005249 [0,2,0,0,0,0|2,0,0]=4 686 B6R0.4 O=C(O)CCCBr CS-W016047 [0,2,0,0,0,0|2,0,0]=4 687 B6R0.4 O=C(O)CCCCl CS-W013545 [0,2,0,0,0,0|2,0,0]=4 688 B6R0.4 O=C(O)\C=C\CBr CS-0020044 [0,2,0,0,0,0|2,0,0]=4 689 B6R0.4 O=C(O)\C=C\CCl CS-0139553 [0,2,0,0,0,0|2,0,0]=4 690 B6R0.5 CCOS(C)(=O)=O CS-W016570 [0,2,0,0,0,0|1,0,0]=3 691 B6R0.5 COCC(C)(C)O CS-0186349 [0,2,0,0,0,0|0,0,2]=4 692 B6R0.5 CS(=O)(=O)CCBr CS-0084612 [0,2,0,0,0,0|2,0,0]=4 693 B6R0.5 CS(=O)(=O)CCN CS-0139140 [0,2,0,0,0,0|2,0,0]=4 694 B6R0.5 CS(=O)(=O)CCN CS-W003121 [0,2,0,0,0,0|2,0,0]=4 695 B6R0.5 CS(=O)(=O)CCO CS-0059238 [0,2,0,0,0,0|2,0,0]=4 696 B6R0.8 CCS(=O)(=O)CC CS-0376644 [0,2,0,0,0,0|2,0,0]=4 697 B6R0.8 CCS(=O)(=O)OC CS-W011183 [0,2,0,0,0,0|1,0,0]=3 698 B6R0.8 COC(C)(C)CO CS-0146594 [0,2,0,0,0,0|0,0,2]=4 699 B6R0.8 COS(=O)(=O)O[Na] CS-0204494 [0,2,0,0,0,0|2,0,0]=4 700 B6R0.9 CCN(C=O)CC CS-W009551 [0,2,0,0,0,0|2,0,0]=4 701 B6R0.9 CCN(CC)N=O CS-0128799 [0,2,0,0,0,0|2,0,0]=4 702 B6R0.9 COC(CBr)OC CS-W018536 [0,2,0,0,0,0|0,0,2]=4 703 B6R0.9 COC(CN)OC CS-0015304 [0,2,0,0,0,0|0,0,2]=4 704 B6R0.9 COC(CO)OC CS-W011294 [0,2,0,0,0,0|0,0,2]=4 705 B6R0.7 CC(=O)C(C)(C)Br CS-0197854 [0,2,0,0,0,0|1,0,0]=3 706 B6R0.7 CC(=O)C(C)(C)O CS-W016644 [0,2,0,0,0,0|1,0,0]=3 707 B6R0.7 CC(C)(Br)C(=O)Br CS-0008515 [0,2,0,0,0,0|2,0,0]=4 708 B6R0.7 CC(C)(Br)C(=O)O CS-W017850 [0,2,0,0,0,0|2,0,0]=4 709 B6R0.7 CC(C)(Br)C(N)=O CS-W004757 [0,2,0,0,0,0|2,0,0]=4 710 B6R0.7 CC(C)(C)C(=O)O CS-D1464 [0,2,0,0,0,0|2,0,0]=4 711 B6R0.7 CC(C)(C)C(=O)[O-] CS-0035148 [0,2,0,0,0,0|2,0,0]=4 712 B6R0.7 CC(C)(C)C(=O)[O-] CS-0198961 [0,2,0,0,0,0|2,0,0]=4 713 B6R0.7 CC(C)(F)C(=O)O CS-0022383 [0,2,0,0,0,0|2,0,0]=4 714 B6R0.7 CC(C)(N)C(=O)O CS-B0930 [0,2,0,0,0,0|2,0,0]=4 715 B6R0.7 CC(C)(N)C(N)=O CS-0205637 [0,2,0,0,0,0|2,0,0]=4 716 B6R0.7 CC(C)(O)C(=O)O CS-W016640 [0,2,0,0,0,0|2,0,0]=4 717 B6R0.7 CC(C)(O)C(N)=O CS-0154975 [0,2,0,0,0,0|2,0,0]=4 718 B6R0.7 CC(C)S(C)(=N)=O CS-0620992 [0,2,0,0,0,0|2,0,0]=4 719 B6R0.7 CC(F)(F)C(N)=O CS-0243269 [0,2,0,0,0,0|2,0,0]=4 720 B4R1.1 C1CNC1 CS-W011344 [1,0,0,1,0,0|1,0,1]=4 721 B6R1.2 BrC1CCOC1 CS-W004035 [0,1,0,1,0,0|1,0,1]=4 722 B6R1.2 CC1=CC=NO1 CS-0085310 [0,1,0,1,0,0|1,0,1]=4 723 B6R1.2 CC1=COC=N1 CS-0028372 [0,1,0,1,0,0|1,0,1]=4 724 B6R1.2 CC1=NC=CO1 CS-0312016 [0,1,0,1,0,0|1,0,1]=4 725 B6R1.2 CC1=NN=CO1 CS-W018813 [0,1,0,1,0,0|1,0,1]=4 726 B6R1.2 CC1=NON=C1 CS-0063186 [0,1,0,1,0,0|2,0,0]=4 727 B6R1.2 IC1CCOC1 CS-W004266 [0,1,0,1,0,0|1,0,1]=4 728 B6R1.2 I[C@@H]1CCOC1 CS-0055199 [0,1,0,1,0,0|1,0,1]=4 729 B6R1.2 I[C@H]1CCOC1 CS-0053265 [0,1,0,1,0,0|1,0,1]=4 730 B6R1.2 N=C1CCCS1 CS-W016514 [0,1,0,1,0,0|1,1,0]=4 731 B6R1.2 NC1=NCCC1 CS-B0123 [0,1,0,1,0,0|2,0,0]=4 732 B6R1.2 NC1=NCCS1 CS-0074129 [0,1,0,1,0,0|1,1,0]=4 733 B6R1.2 NC1CCOC1 CS-D1564 [0,1,0,1,0,0|1,0,1]=4 734 B6R1.2 NC1CCOC1 CS-W011353 [0,1,0,1,0,0|1,0,1]=4 735 B6R1.2 N[C@@H]1CCOC1 CS-W019413 [0,1,0,1,0,0|1,0,1]=4 736 B6R1.2 N[C@H]1CCOC1 CS-W019697 [0,1,0,1,0,0|1,0,1]=4 737 B6R1.2 O=C1C=CCC1 CS-W011359 [0,1,0,1,0,0|1,0,0]=3 738 B6R1.2 O=C1C=CCO1 CS-W008270 [0,1,0,1,0,0|0,0,1]=3 739 B6R1.2 O=C1C=CCS1 CS-0348812 [0,1,0,1,0,0|0,1,1]=4 740 B6R1.2 O=C1CC=NN1 CS-W004408 [0,1,0,1,0,0|1,0,1]=4 741 B6R1.2 O=C1CCCN1 CS-0197058 [0,1,0,1,0,0|1,0,0]=3 742 B6R1.2 O=C1CCNC1 CS-W005267 [0,1,0,1,0,0|1,0,0]=3 743 B6R1.2 O=C1CCNN1 CS-W001151 [0,1,0,1,0,0|1,0,0]=3 744 B6R1.2 O=C1CCOC1 CS-D1574 [0,1,0,1,0,0|0,0,0]=2 745 B6R1.2 O=C1CCSC1 CS-W011310 [0,1,0,1,0,0|0,1,0]=3 746 B6R1.2 O=C1NCCN1 CS-0075560 [0,1,0,1,0,0|1,0,0]=3 747 B6R1.2 O=C1NCCO1 CS-W007548 [0,1,0,1,0,0|0,0,0]=2 748 B6R1.2 O=C1NCCS1 CS-W023026 [0,1,0,1,0,0|0,1,0]=3 749 B6R1.2 O=C1OC=CO1 CS-W013752 [0,1,0,1,0,0|0,0,2]=4 750 B6R1.2 O=S1CCCC1 CS-0207394 [0,1,0,1,0,0|2,0,0]=4 751 B6R1.2 O=S1OCCO1 CS-W013675 [0,1,0,1,0,0|1,0,0]=3 752 B6R1.2 OC1CCOC1 CS-M0786 [0,1,0,1,0,0|0,0,2]=4 753 B6R1.2 O[C@@H]1CCOC1 CS-W002310 [0,1,0,1,0,0|0,0,2]=4 754 B6R1.2 O[C@H]1CCOC1 CS-D0600 [0,1,0,1,0,0|0,0,2]=4 755 B6R1.2 S=C1NCCO1 CS-0097403 [0,1,0,1,0,0|0,1,0]=3 756 B6R1.2 S=C1NCCS1 CS-0008464 [0,1,0,1,0,0|0,2,0]=4 757 B6R1.2 S=C1SCCS1 CS-0317149 [0,1,0,1,0,0|0,2,0]=4 758 B6R1.2 SC1=NCCC1 CS-W013703 [0,1,0,1,0,0|1,1,0]=4 759 B6R1.2 SC1=NCCN1 CS-W011309 [0,1,0,1,0,0|1,1,0]=4 760 B6R1.3 COC[C@H]1CO1 CS-0165613 [0,1,0,1,0,0|0,0,2]=4 761 B6R1.5 CN1CC(=O)C1 CS-0052428 [0,1,0,1,0,0|1,0,0]=3 762 B6R1.5 NC1CC(=O)C1 CS-W005321 [0,1,0,1,0,0|1,0,0]=3 763 B6R1.5 O=C1CC(O)C1 CS-0051337 [0,1,0,1,0,0|1,0,0]=3 764 B6R1.8 C=C1CC1CO CS-0054284 [0,1,0,1,0,0|2,0,0]=4 765 B6R1.10 CC1(N)COC1 CS-0045507 [0,1,0,1,0,0|1,0,1]=4 766 B6R1.10 CC1(O)COC1 CS-W005276 [0,1,0,1,0,0|0,0,2]=4 767 B6R1.11 NC(=O)C1CC1 CS-W011356 [0,1,0,1,0,0|2,0,0]=4 768 B6R1.11 NC(=O)C1CO1 CS-0067053 [0,1,0,1,0,0|1,0,0]=3 769 B6R1.11 O=C(O)C1CC1 CS-W018339 [0,1,0,1,0,0|2,0,0]=4 770 B6R1.4 CC1OCC1=O CS-0051833 [0,1,0,1,0,0|0,0,1]=3 771 B6R1.4 O=C1CCC1Br CS-0147268 [0,1,0,1,0,0|1,0,0]=3 772 B6R1.6 COC1CNC1 CS-W008894 [0,1,0,1,0,0|1,0,1]=4 773 B6R1.6 ICC1CCO1 CS-0052227 [0,1,0,1,0,0|1,0,1]=4 774 B6R1.6 NCC1CCO1 CS-0048767 [0,1,0,1,0,0|1,0,1]=4 775 B6R1.6 NC[C@@H]1CCO1 CS-0100100 [0,1,0,1,0,0|1,0,1]=4 776 B6R1.6 OCC1CCO1 CS-W019194 [0,1,0,1,0,0|0,0,2]=4 777 B6R1.7 CC1(CCl)CO1 CS-0089843 [0,1,0,1,0,0|1,0,1]=4