0 B4R0.1 C#CC(C)N SY022798 [0,0,0,0,0,0|3,0,1]=4 1 B4R0.1 C#CC(N)=O SY060790 [0,0,0,0,0,0|3,0,0]=3 2 B4R0.1 C=C(Br)CN SY122662 [0,0,0,0,0,0|3,0,1]=4 3 B4R0.1 C=C(Br)CN SY264242 [0,0,0,0,0,0|3,0,1]=4 4 B4R0.1 C=C(Br)CO SY043202 [0,0,0,0,0,0|2,0,1]=3 5 B4R0.1 C=C(C)CN SY018445 [0,0,0,0,0,0|3,0,0]=3 6 B4R0.1 C=C[C@H](C)N SY245785 [0,0,0,0,0,0|3,0,1]=4 7 B4R0.1 CC(=N)NN SY188423 [0,0,0,0,0,0|3,0,0]=3 8 B4R0.1 CC(=O)CN SY018511 [0,0,0,0,0,0|2,0,0]=2 9 B4R0.1 CC(C)NN SY008422 [0,0,0,0,0,0|3,0,1]=4 10 B4R0.1 CC(C)NO SY059927 [0,0,0,0,0,0|2,0,1]=3 11 B4R0.1 CC(C)ON SY019006 [0,0,0,0,0,0|2,0,1]=3 12 B4R0.1 CC(N)CBr SY268996 [0,0,0,0,0,0|3,0,1]=4 13 B4R0.1 CC(N)CF SY045872 [0,0,0,0,0,0|3,0,1]=4 14 B4R0.1 CC(S)CO SY195125 [0,0,0,0,0,0|1,1,1]=3 15 B4R0.1 CCC(=N)N SY018521 [0,0,0,0,0,0|4,0,0]=4 16 B4R0.1 CCC(N)=O SY048276 [0,0,0,0,0,0|3,0,0]=3 17 B4R0.1 CCS(=O)[O-] SY005659 [0,0,0,0,0,0|4,0,0]=4 18 B4R0.1 CC[C@H](C)N SY059203 [0,0,0,0,0,0|3,0,1]=4 19 B4R0.1 CNC(N)=O SY018863 [0,0,0,0,0,0|3,0,0]=3 20 B4R0.1 COC(=N)N SY021749 [0,0,0,0,0,0|3,0,0]=3 21 B4R0.1 COC(=N)N SY023512 [0,0,0,0,0,0|3,0,0]=3 22 B4R0.1 CSC(=N)N SY001378 [0,0,0,0,0,0|3,1,0]=4 23 B4R0.1 C[C@@H](Cl)CO SY240135 [0,0,0,0,0,0|2,0,1]=3 24 B4R0.1 C[C@@H](N)CF SY044783 [0,0,0,0,0,0|3,0,1]=4 25 B4R0.1 C[C@@H](O)CN SY002691 [0,0,0,0,0,0|2,0,2]=4 26 B4R0.1 C[C@@H](O)CO SY003769 [0,0,0,0,0,0|1,0,2]=3 27 B4R0.1 C[C@H](N)CF SY044781 [0,0,0,0,0,0|3,0,1]=4 28 B4R0.1 C[C@H](O)CO SY003770 [0,0,0,0,0,0|1,0,2]=3 29 B4R0.1 C\C(Cl)=N\O SY307714 [0,0,0,0,0,0|2,0,0]=2 30 B4R0.1 C\C(N)=N\O SY011082 [0,0,0,0,0,0|2,0,0]=2 31 B4R0.1 N=C(N)CCl SY116175 [0,0,0,0,0,0|4,0,0]=4 32 B4R0.1 N=C(N)NN SY057364 [0,0,0,0,0,0|4,0,0]=4 33 B4R0.1 NC(=S)CF SY153543 [0,0,0,0,0,0|3,1,0]=4 34 B4R0.1 NCC(N)=O SY003860 [0,0,0,0,0,0|3,0,0]=3 35 B4R0.1 NCC(N)=O SY104505 [0,0,0,0,0,0|3,0,0]=3 36 B4R0.1 NNC(N)=S SY001634 [0,0,0,0,0,0|3,1,0]=4 37 B4R0.1 O=C([O-])CI SY066613 [0,0,0,0,0,0|3,0,0]=3 38 B4R0.1 ON=C(Br)Br SY007120 [0,0,0,0,0,0|3,0,0]=3 39 B3R0.1 CCON SY009566 [1,0,0,0,0,0|1,0,1]=3 40 B3R0.1 CNOC SY001763 [1,0,0,0,0,0|2,0,0]=3 41 B3R0.1 COCBr SY029084 [1,0,0,0,0,0|2,0,1]=4 42 B3R0.1 C[Se][Se]C SY048201 [1,0,0,0,0,0|2,1,0]=4 43 B3R0.1 N\C=N\O SY086195 [1,0,0,0,0,0|2,0,0]=3 44 B3R0.2 CB(O)O SY001105 [1,0,0,0,0,0|1,0,1]=3 45 B3R0.2 CC(=O)O SY001386 [1,0,0,0,0,0|0,0,0]=1 46 B3R0.2 CC(=O)O SY004125 [1,0,0,0,0,0|0,0,0]=1 47 B3R0.2 CC(=O)[O-] SY001322 [1,0,0,0,0,0|0,0,1]=2 48 B3R0.2 CC(=O)[O-] SY010327 [1,0,0,0,0,0|0,0,1]=2 49 B3R0.2 CC(=O)[O-] SY011498 [1,0,0,0,0,0|0,0,1]=2 50 B3R0.2 CC(=O)[O-] SY011745 [1,0,0,0,0,0|0,0,1]=2 51 B3R0.2 CC(=O)[O-] SY011809 [1,0,0,0,0,0|0,0,1]=2 52 B3R0.2 CC(=O)[O-] SY011846 [1,0,0,0,0,0|0,0,1]=2 53 B3R0.2 CC(=O)[O-] SY013501 [1,0,0,0,0,0|0,0,1]=2 54 B3R0.2 CC(=O)[O-] SY027391 [1,0,0,0,0,0|0,0,1]=2 55 B3R0.2 CC(=O)[O-] SY045651 [1,0,0,0,0,0|0,0,1]=2 56 B3R0.2 CC(=O)[O-] SY067119 [1,0,0,0,0,0|0,0,1]=2 57 B3R0.2 CC(=O)[O-] SY256925 [1,0,0,0,0,0|0,0,1]=2 58 B3R0.2 CC(=O)[O-] SY257453 [1,0,0,0,0,0|0,0,1]=2 59 B3R0.2 CC(C)N SY107348 [1,0,0,0,0,0|2,0,1]=4 60 B3R0.2 CN(C)C SY010907 [1,0,0,0,0,0|3,0,0]=4 61 B3R0.2 CS(=O)[O-] SY002584 [1,0,0,0,0,0|1,0,1]=3 62 B3R0.2 C[S+](C)C SY011509 [1,0,0,0,0,0|3,0,0]=4 63 B3R0.2 C[S+](C)C SY019516 [1,0,0,0,0,0|3,0,0]=4 64 B3R0.2 N=C(N)Cl SY009310 [1,0,0,0,0,0|3,0,0]=4 65 B3R0.2 N=C(N)N SY003172 [1,0,0,0,0,0|3,0,0]=4 66 B3R0.2 O=C([O-])[O-] SY001250 [1,0,0,0,0,0|1,0,1]=3 67 B3R0.2 O=C([O-])[O-] SY009169 [1,0,0,0,0,0|1,0,1]=3 68 B3R0.2 O=C([O-])[O-] SY011697 [1,0,0,0,0,0|1,0,1]=3 69 B3R0.2 O=C([O-])[O-] SY011713 [1,0,0,0,0,0|1,0,1]=3 70 B3R0.2 O=C([O-])[O-] SY011779 [1,0,0,0,0,0|1,0,1]=3 71 B3R0.2 O=C([O-])[O-] SY011799 [1,0,0,0,0,0|1,0,1]=3 72 B3R0.2 O=C([O-])[O-] SY011844 [1,0,0,0,0,0|1,0,1]=3 73 B3R0.2 O=C([O-])[O-] SY066643 [1,0,0,0,0,0|1,0,1]=3 74 B3R0.2 O=C([O-])[O-] SY076666 [1,0,0,0,0,0|1,0,1]=3 75 B3R0.2 O=C([O-])[O-] SY274515 [1,0,0,0,0,0|1,0,1]=3 76 B3R0.2 O=C([O-])[O-] SY288394 [1,0,0,0,0,0|1,0,1]=3 77 B3R0.2 O=[N+]([O-])[O-] SY061250 [1,0,0,0,0,0|2,0,1]=4 78 B3R0.2 O=[N+]([O-])[O-] SY061261 [1,0,0,0,0,0|2,0,1]=4 79 B3R0.2 O=[Ti]([O-])[O-] SY061132 [1,0,0,0,0,0|2,0,1]=4 80 B3R0.2 O=[Ti]([O-])[O-] SY284367 [1,0,0,0,0,0|2,0,1]=4 81 B3R0.2 O=[Ti]([O-])[O-] SY284368 [1,0,0,0,0,0|2,0,1]=4 82 B3R0.2 O=[V](=O)[O-] SY106462 [1,0,0,0,0,0|2,0,1]=4 83 B3R0.2 P(C)(C)=O SY009874 [1,0,0,0,0,0|2,0,0]=3 84 B3R0.2 P(C)(C)=O SY237149 [1,0,0,0,0,0|2,0,0]=3 85 B5R0.1 C#CCC(=O)O SY040154 [0,1,0,0,0,0|3,0,0]=4 86 B5R0.1 C=CNC(N)=O SY159600 [0,1,0,0,0,0|3,0,0]=4 87 B5R0.1 CC#CC(C)=O SY262884 [0,1,0,0,0,0|2,0,0]=3 88 B5R0.1 CC(=O)CCN SY263173 [0,1,0,0,0,0|2,0,0]=3 89 B5R0.1 CC(=O)CCO SY002849 [0,1,0,0,0,0|1,0,0]=2 90 B5R0.1 CC(=O)NCO SY047960 [0,1,0,0,0,0|1,0,0]=2 91 B5R0.1 CC(=O)OCBr SY051438 [0,1,0,0,0,0|1,0,0]=2 92 B5R0.1 CC(=O)\C=N/O SY112549 [0,1,0,0,0,0|1,0,0]=2 93 B5R0.1 CC(C)CON SY013358 [0,1,0,0,0,0|2,0,1]=4 94 B5R0.1 CC(I)=CCI SY237855 [0,1,0,0,0,0|3,0,0]=4 95 B5R0.1 CC(N)CCO SY030187 [0,1,0,0,0,0|2,0,1]=4 96 B5R0.1 CCNC(C)=O SY016499 [0,1,0,0,0,0|2,0,0]=3 97 B5R0.1 CNCC(=O)O SY001630 [0,1,0,0,0,0|3,0,0]=4 98 B5R0.1 CNCC(N)=O SY059741 [0,1,0,0,0,0|3,0,0]=4 99 B5R0.1 COCC(=N)N SY019943 [0,1,0,0,0,0|3,0,0]=4 100 B5R0.1 COCC(C)Br SY074290 [0,1,0,0,0,0|2,0,1]=4 101 B5R0.1 COC[C@@H](C)N SY034826 [0,1,0,0,0,0|2,0,1]=4 102 B5R0.1 COC[C@@H](C)N SY056838 [0,1,0,0,0,0|2,0,1]=4 103 B5R0.1 CSCC(N)=O SY040648 [0,1,0,0,0,0|2,1,0]=4 104 B5R0.1 CSCS(C)=O SY049552 [0,1,0,0,0,0|2,1,0]=4 105 B5R0.1 C[C@@H](O)CCO SY049450 [0,1,0,0,0,0|1,0,2]=4 106 B5R0.1 C[C@H](N)CCO SY022986 [0,1,0,0,0,0|2,0,1]=4 107 B5R0.1 C\C(I)=C/CI SY237856 [0,1,0,0,0,0|3,0,0]=4 108 B5R0.1 C\C(I)=C\CI SY237854 [0,1,0,0,0,0|3,0,0]=4 109 B5R0.1 C\C(I)=C\CO SY246995 [0,1,0,0,0,0|2,0,0]=3 110 B5R0.1 C\C(I)=C\CO SY252919 [0,1,0,0,0,0|2,0,0]=3 111 B5R0.1 NC(=O)CCBr SY014886 [0,1,0,0,0,0|3,0,0]=4 112 B5R0.1 NCCC(N)=O SY024863 [0,1,0,0,0,0|3,0,0]=4 113 B5R0.1 NCCC(N)=O SY101590 [0,1,0,0,0,0|3,0,0]=4 114 B5R0.1 O=C(O)CCF SY008508 [0,1,0,0,0,0|3,0,0]=4 115 B5R0.1 O=C(O)CCO SY003982 [0,1,0,0,0,0|2,0,0]=3 116 B5R0.1 O=C(O)\C=C\Br SY026854 [0,1,0,0,0,0|3,0,0]=4 117 B5R0.1 O=[N+]([O-])CCO SY008757 [0,1,0,0,0,0|3,0,0]=4 118 B5R0.3 C#C[C@H](C)OC SY282343 [0,1,0,0,0,0|2,0,1]=4 119 B5R0.3 C=C(CI)CI SY280389 [0,1,0,0,0,0|3,0,0]=4 120 B5R0.3 C=C(CO)CO SY009429 [0,1,0,0,0,0|2,0,0]=3 121 B5R0.3 C=C(OC)OC SY274566 [0,1,0,0,0,0|2,0,0]=3 122 B5R0.3 C=CC(=O)NC SY057550 [0,1,0,0,0,0|2,0,0]=3 123 B5R0.3 C=CC(C)ON SY039116 [0,1,0,0,0,0|2,0,1]=4 124 B5R0.3 CC(=CI)CI SY271392 [0,1,0,0,0,0|3,0,0]=4 125 B5R0.3 CC[C@@H](N)CO SY049464 [0,1,0,0,0,0|2,0,1]=4 126 B5R0.3 CNC(=N)NC SY270827 [0,1,0,0,0,0|3,0,0]=4 127 B5R0.3 CNC(=O)CBr SY106596 [0,1,0,0,0,0|2,0,0]=3 128 B5R0.3 CNC(=O)CCl SY003250 [0,1,0,0,0,0|2,0,0]=3 129 B5R0.3 CNC(=O)CN SY024913 [0,1,0,0,0,0|2,0,0]=3 130 B5R0.3 CNC(=O)CN SY066423 [0,1,0,0,0,0|2,0,0]=3 131 B5R0.3 CNC(=O)NC SY004507 [0,1,0,0,0,0|2,0,0]=3 132 B5R0.3 CNC(C)CO SY082195 [0,1,0,0,0,0|2,0,1]=4 133 B5R0.3 COC(=O)CN SY001589 [0,1,0,0,0,0|1,0,0]=2 134 B5R0.3 COC(=O)CO SY003097 [0,1,0,0,0,0|1,0,0]=2 135 B5R0.3 COC(C)CBr SY298794 [0,1,0,0,0,0|2,0,1]=4 136 B5R0.3 CO[C@@H](C)CN SY114788 [0,1,0,0,0,0|2,0,1]=4 137 B5R0.3 CSC(=N)NN SY023604 [0,1,0,0,0,0|3,0,0]=4 138 B5R0.3 C\C(=C/I)CO SY270524 [0,1,0,0,0,0|2,0,0]=3 139 B5R0.3 C\C(=C\I)CI SY248780 [0,1,0,0,0,0|3,0,0]=4 140 B5R0.3 NCC(F)CO SY260924 [0,1,0,0,0,0|2,0,1]=4 141 B5R0.3 NC[C@@H](O)CO SY008127 [0,1,0,0,0,0|1,0,2]=4 142 B5R0.3 NNC(=O)CO SY059283 [0,1,0,0,0,0|2,0,0]=3 143 B5R0.3 O=C(CO)CO SY038299 [0,1,0,0,0,0|1,0,0]=2 144 B5R0.4 CC(C)(C)NO SY036171 [0,1,0,0,0,0|2,0,1]=4 145 B5R0.4 CC(C)(C)ON SY025901 [0,1,0,0,0,0|2,0,1]=4 146 B5R0.4 CC(C)(F)CO SY029466 [0,1,0,0,0,0|2,0,1]=4 147 B5R0.4 CC(C)(O)CO SY107922 [0,1,0,0,0,0|1,0,2]=4 148 B5R0.4 CC(F)(F)CO SY029658 [0,1,0,0,0,0|2,0,1]=4 149 B5R0.4 CNS(C)(=O)=O SY004768 [0,1,0,0,0,0|3,0,0]=4 150 B5R0.4 CO[Si](C)(C)Cl SY249087 [0,1,0,0,0,0|2,1,0]=4 151 B5R0.5 C=C(C)C(C)O SY145959 [0,1,0,0,0,0|2,0,0]=3 152 B5R0.5 C=C(C)C(N)=O SY010261 [0,1,0,0,0,0|2,0,1]=4 153 B5R0.5 C=C(F)C(=O)Cl SY039966 [0,1,0,0,0,0|3,0,0]=4 154 B5R0.5 C=C(F)C(=O)O SY021247 [0,1,0,0,0,0|2,0,1]=4 155 B5R0.5 CC(=O)C(F)F SY013768 [0,1,0,0,0,0|2,0,0]=3 156 B5R0.5 CC(Br)C(N)=O SY106825 [0,1,0,0,0,0|3,0,0]=4 157 B5R0.5 CC(C)B(O)O SY006229 [0,1,0,0,0,0|2,0,1]=4 158 B5R0.5 CC(C)C(N)=O SY015332 [0,1,0,0,0,0|3,0,0]=4 159 B5R0.5 CC(N)C(=O)O SY005245 [0,1,0,0,0,0|2,0,1]=4 160 B5R0.5 CC(N)C(N)=O SY012823 [0,1,0,0,0,0|3,0,0]=4 161 B5R0.5 CC(N)C(N)=O SY027188 [0,1,0,0,0,0|3,0,0]=4 162 B5R0.5 C[C@@H](Br)C(=O)O SY102226 [0,1,0,0,0,0|2,0,1]=4 163 B5R0.5 C[C@@H](N)C(=O)O SY002277 [0,1,0,0,0,0|2,0,1]=4 164 B5R0.5 C[C@@H](N)C(N)=O SY030965 [0,1,0,0,0,0|3,0,0]=4 165 B5R0.5 C[C@@H](N)C(N)=O SY111070 [0,1,0,0,0,0|3,0,0]=4 166 B5R0.5 C[C@@H](O)C(N)=O SY022608 [0,1,0,0,0,0|2,0,0]=3 167 B5R0.5 C[C@@H](O)[C@@H](C)O SY047189 [0,1,0,0,0,0|1,0,2]=4 168 B5R0.5 C[C@H](Cl)C(=O)O SY018972 [0,1,0,0,0,0|2,0,1]=4 169 B5R0.5 C[C@H](N)C(N)=O SY031439 [0,1,0,0,0,0|3,0,0]=4 170 B5R0.5 C[C@H](O)[C@H](C)O SY057405 [0,1,0,0,0,0|1,0,2]=4 171 B5R0.5 O=C(O)C(F)Br SY040308 [0,1,0,0,0,0|3,0,0]=4 172 B5R0.5 O=C(O)C(F)Cl SY275169 [0,1,0,0,0,0|3,0,0]=4 173 B5R0.5 O=C(O)[C@@H](F)Cl SY276751 [0,1,0,0,0,0|3,0,0]=4 174 B5R0.5 O=C(O)[C@H](F)Cl SY276752 [0,1,0,0,0,0|3,0,0]=4 175 B5R1.2 ClC1COC1 SY059296 [0,0,0,1,0,0|2,0,1]=4 176 B5R1.2 IC1COC1 SY009160 [0,0,0,1,0,0|2,0,1]=4 177 B5R1.2 NC1COC1 SY009105 [0,0,0,1,0,0|2,0,1]=4 178 B5R1.2 O=C1CNC1 SY027144 [0,0,0,1,0,0|2,0,0]=3 179 B5R1.2 O=C1COC1 SY003915 [0,0,0,1,0,0|1,0,0]=2 180 B5R1.2 OC1COC1 SY002910 [0,0,0,1,0,0|1,0,2]=4 181 B5R1.3 OC[C@@H]1CO1 SY013955 [0,0,0,1,0,0|1,0,2]=4 182 B5R1.3 OC[C@H]1CO1 SY031944 [0,0,0,1,0,0|1,0,2]=4 183 B2R0.1 C=NO SY022552 [2,0,0,0,0,0|1,0,0]=3 184 B2R0.1 CC#N SY009905 [2,0,0,0,0,0|1,0,1]=4 185 B2R0.1 CNN SY114943 [2,0,0,0,0,0|2,0,0]=4 186 B2R0.1 CNO SY013476 [2,0,0,0,0,0|1,0,0]=3 187 B2R0.1 N=CN SY007749 [2,0,0,0,0,0|2,0,0]=4 188 B2R0.1 O=C[O-] SY027875 [2,0,0,0,0,0|0,0,1]=3 189 B2R0.1 O=N[O-] SY010058 [2,0,0,0,0,0|1,0,1]=4 190 B2R0.1 O=[Ru]=O SY009293 [2,0,0,0,0,0|1,0,1]=4 191 B2R0.1 O=[Ru]=O SY010110 [2,0,0,0,0,0|1,0,1]=4 192 B2R0.1 O[Pd]O SY001180 [2,0,0,0,0,0|1,0,1]=4 193 B4R0.2 C=CCON SY029026 [1,1,0,0,0,0|1,0,1]=4 194 B4R0.2 CC=CC[Pd+2] SY070788 [1,1,0,0,0,0|2,0,0]=4 195 B4R0.2 CCCON SY096737 [1,1,0,0,0,0|1,0,1]=4 196 B4R0.2 CCOC=N SY041120 [1,1,0,0,0,0|1,0,1]=4 197 B4R0.2 COCCI SY248715 [1,1,0,0,0,0|1,0,1]=4 198 B4R0.2 NOCCO SY007135 [1,1,0,0,0,0|1,0,1]=4 199 B4R0.2 O=[Ho]O[Ho]=O SY010030 [1,1,0,0,0,0|1,0,1]=4 200 B4R0.2 O=[In]O[In]=O SY061096 [1,1,0,0,0,0|1,0,1]=4 201 B4R0.2 O=[Sc]O[Sc]=O SY003090 [1,1,0,0,0,0|1,0,1]=4 202 B4R0.2 OCCCBr SY001898 [1,1,0,0,0,0|1,0,1]=4 203 B4R0.2 OCCCF SY033053 [1,1,0,0,0,0|1,0,1]=4 204 B4R0.2 OCCCI SY016401 [1,1,0,0,0,0|1,0,1]=4 205 B4R0.3 CS(=O)(=O)[O-] SY003606 [1,1,0,0,0,0|1,0,1]=4 206 B4R0.3 CS(C)(=N)=O SY037343 [1,1,0,0,0,0|2,0,0]=4 207 B4R0.3 CS(N)(=O)=O SY001366 [1,1,0,0,0,0|1,0,1]=4 208 B4R0.3 C[S+](C)(C)=O SY002188 [1,1,0,0,0,0|2,0,0]=4 209 B4R0.3 C[S+](C)(C)=O SY036350 [1,1,0,0,0,0|2,0,0]=4 210 B4R0.3 C[S+](C)(C)=O SY039178 [1,1,0,0,0,0|2,0,0]=4 211 B4R0.3 O=P([O-])([O-])O SY010082 [1,1,0,0,0,0|2,0,0]=4 212 B6R0.1 C=CCC(=O)OC SY025883 [0,2,0,0,0,0|1,0,0]=3 213 B6R0.1 CC#CC(=O)OC SY012646 [0,2,0,0,0,0|1,0,0]=3 214 B6R0.1 CCC(=O)CC#N SY004535 [0,2,0,0,0,0|2,0,0]=4 215 B6R0.1 CCC(=O)COC SY190908 [0,2,0,0,0,0|1,0,0]=3 216 B6R0.1 CCCC(=O)NN SY060413 [0,2,0,0,0,0|2,0,0]=4 217 B6R0.1 CCNC(=O)CCl SY024489 [0,2,0,0,0,0|2,0,0]=4 218 B6R0.1 CCOC(=N)CCl SY026914 [0,2,0,0,0,0|2,0,0]=4 219 B6R0.1 CCOC(=O)CN SY002226 [0,2,0,0,0,0|1,0,0]=3 220 B6R0.1 CCOC(=O)CO SY002762 [0,2,0,0,0,0|1,0,0]=3 221 B6R0.1 CCOC(=S)SC SY261921 [0,2,0,0,0,0|1,1,0]=4 222 B6R0.1 CN(C=O)CCO SY038247 [0,2,0,0,0,0|2,0,0]=4 223 B6R0.1 CNC(=O)CC#N SY032593 [0,2,0,0,0,0|2,0,0]=4 224 B6R0.1 CNC(=O)CCO SY083761 [0,2,0,0,0,0|1,0,0]=3 225 B6R0.1 COC(=N)CC#N SY257805 [0,2,0,0,0,0|2,0,0]=4 226 B6R0.1 COC(=O)C#CBr SY039726 [0,2,0,0,0,0|1,0,1]=4 227 B6R0.1 COC(=O)C=CI SY264761 [0,2,0,0,0,0|1,0,1]=4 228 B6R0.1 COC(=O)CCBr SY002337 [0,2,0,0,0,0|1,0,0]=3 229 B6R0.1 COC(=O)CCN SY004831 [0,2,0,0,0,0|1,0,0]=3 230 B6R0.1 COC(=O)CCO SY008913 [0,2,0,0,0,0|1,0,0]=3 231 B6R0.1 COC(=O)OCCl SY047554 [0,2,0,0,0,0|1,0,0]=3 232 B6R0.1 COC(=O)\C=C/I SY257888 [0,2,0,0,0,0|1,0,1]=4 233 B6R0.1 COCC(=O)NN SY109583 [0,2,0,0,0,0|2,0,0]=4 234 B6R0.1 O=C(CCCl)NO SY159080 [0,2,0,0,0,0|1,0,0]=3 235 B6R0.2 CC(=O)C[N+](=O)[O-] SY285532 [0,2,0,0,0,0|1,0,1]=4 236 B6R0.2 CC(=O)NC(C)C SY107538 [0,2,0,0,0,0|2,0,0]=4 237 B6R0.2 CC(=O)OC(C)Br SY067153 [0,2,0,0,0,0|1,0,0]=3 238 B6R0.2 CC(=O)\C=C(\C)[O-] SY008855 [0,2,0,0,0,0|1,0,1]=4 239 B6R0.2 CC(=O)\C=C(\C)[O-] SY010105 [0,2,0,0,0,0|1,0,1]=4 240 B6R0.2 CC(=O)\C=C(\C)[O-] SY010217 [0,2,0,0,0,0|1,0,1]=4 241 B6R0.2 CC(=O)\C=C(\C)[O-] SY010282 [0,2,0,0,0,0|1,0,1]=4 242 B6R0.2 CC(=O)\C=C(\C)[O-] SY011804 [0,2,0,0,0,0|1,0,1]=4 243 B6R0.2 CC(=O)\C=C(\C)[O-] SY072898 [0,2,0,0,0,0|1,0,1]=4 244 B6R0.2 CC(=O)\C=C(\C)[O-] SY107884 [0,2,0,0,0,0|1,0,1]=4 245 B6R0.2 CC(C)=CB(O)O SY064246 [0,2,0,0,0,0|2,0,0]=4 246 B6R0.2 C[C@@H](O)CC(=O)[O-] SY107283 [0,2,0,0,0,0|2,0,0]=4 247 B6R0.2 O=C(O)CC(=O)O SY001875 [0,2,0,0,0,0|2,0,0]=4 248 B6R0.3 C=C(F)C(=O)OC SY044794 [0,2,0,0,0,0|1,0,1]=4 249 B6R0.3 C=CC(=O)C(=O)O SY253275 [0,2,0,0,0,0|1,0,1]=4 250 B6R0.3 CC(C)C(=N)NO SY010510 [0,2,0,0,0,0|2,0,0]=4 251 B6R0.3 CC(C)C(=N)NO SY129127 [0,2,0,0,0,0|2,0,0]=4 252 B6R0.3 CC(C)C(=O)CN SY186390 [0,2,0,0,0,0|2,0,0]=4 253 B6R0.3 CC(C)C(=O)NN SY041947 [0,2,0,0,0,0|2,0,0]=4 254 B6R0.3 CCC(=O)C(=O)O SY011034 [0,2,0,0,0,0|1,0,0]=3 255 B6R0.3 CCC(=O)N(C)C SY036870 [0,2,0,0,0,0|2,0,0]=4 256 B6R0.3 CC[C@H](O)C(=O)O SY066872 [0,2,0,0,0,0|2,0,0]=4 257 B6R0.3 CN(C)C(=O)CBr SY031848 [0,2,0,0,0,0|2,0,0]=4 258 B6R0.3 CN(C)C(=O)CCl SY004159 [0,2,0,0,0,0|2,0,0]=4 259 B6R0.3 CN(C)C(=O)CN SY109935 [0,2,0,0,0,0|2,0,0]=4 260 B6R0.3 COC(=N)C(C)C SY274570 [0,2,0,0,0,0|2,0,0]=4 261 B6R0.3 COC(=O)C(=N)N SY123997 [0,2,0,0,0,0|1,0,1]=4 262 B6R0.3 COC(=O)C(Br)Br SY264751 [0,2,0,0,0,0|1,0,0]=3 263 B6R0.3 COC(=O)C(C)N SY008132 [0,2,0,0,0,0|1,0,0]=3 264 B6R0.3 COC(=O)[C@@H](C)N SY008138 [0,2,0,0,0,0|1,0,0]=3 265 B6R0.3 COC(=O)[C@H](C)N SY005420 [0,2,0,0,0,0|1,0,0]=3 266 B6R0.3 COC(C)C(=O)O SY034306 [0,2,0,0,0,0|1,0,1]=4 267 B6R0.3 CON(C)C(C)=O SY004033 [0,2,0,0,0,0|1,0,0]=3 268 B6R0.3 CO[C@@H](C)C(=O)O SY028415 [0,2,0,0,0,0|1,0,1]=4 269 B6R0.3 C[C@@H](ON)C(=O)O SY286465 [0,2,0,0,0,0|1,0,1]=4 270 B6R0.3 C[C@H](ON)C(=O)O SY286489 [0,2,0,0,0,0|1,0,1]=4 271 B6R0.3 C\C=C(\C)C(=O)O SY053021 [0,2,0,0,0,0|2,0,0]=4 272 B6R0.3 NC(=O)[C@@H](N)CO SY034139 [0,2,0,0,0,0|2,0,0]=4 273 B6R0.3 NC(CO)C(=O)O SY003812 [0,2,0,0,0,0|2,0,0]=4 274 B6R0.3 NCC(O)C(=O)O SY007745 [0,2,0,0,0,0|2,0,0]=4 275 B6R0.3 NC[C@H](O)C(=O)O SY013665 [0,2,0,0,0,0|2,0,0]=4 276 B6R0.3 N[C@@H](CO)C(=O)O SY002847 [0,2,0,0,0,0|2,0,0]=4 277 B6R0.3 N[C@H](CO)C(=O)O SY005114 [0,2,0,0,0,0|2,0,0]=4 278 B6R0.3 O=C(CBr)C(F)F SY248032 [0,2,0,0,0,0|2,0,0]=4 279 B6R0.3 O=C(O)C(Br)CO SY261671 [0,2,0,0,0,0|2,0,0]=4 280 B6R0.3 O=C(O)[C@@H](Br)CO SY261670 [0,2,0,0,0,0|2,0,0]=4 281 B6R0.4 CC(=O)CCCO SY002852 [0,2,0,0,0,0|1,0,0]=3 282 B6R0.4 CC(=O)NCCN SY313725 [0,2,0,0,0,0|2,0,0]=4 283 B6R0.4 CCCOC(N)=O SY114484 [0,2,0,0,0,0|2,0,0]=4 284 B6R0.4 COCCC(=O)O SY028921 [0,2,0,0,0,0|2,0,0]=4 285 B6R0.4 CO\C=C\C(C)=O SY029615 [0,2,0,0,0,0|1,0,0]=3 286 B6R0.4 NC(=O)NCCO SY038945 [0,2,0,0,0,0|2,0,0]=4 287 B6R0.4 O=C(O)C#CCO SY046324 [0,2,0,0,0,0|2,0,0]=4 288 B6R0.4 O=C(O)\C=C\CO SY032954 [0,2,0,0,0,0|2,0,0]=4 289 B6R0.5 CS(=O)(=O)CCO SY049666 [0,2,0,0,0,0|2,0,0]=4 290 B6R0.8 CC(C)(C=O)CO SY107563 [0,2,0,0,0,0|1,0,1]=4 291 B6R0.8 COP(=O)([O-])OC SY285858 [0,2,0,0,0,0|2,0,0]=4 292 B6R0.9 C\C=C(\C=O)CC SY265075 [0,2,0,0,0,0|2,0,0]=4 293 B6R0.7 CC(C)(O)C(=O)O SY001526 [0,2,0,0,0,0|2,0,0]=4 294 B6R0.7 CC(C)(O)C(N)=O SY035592 [0,2,0,0,0,0|2,0,0]=4 295 B4R1.2 O=C1CC1 SY037762 [1,0,0,1,0,0|2,0,0]=4 296 B4R1.2 OC1CC1 SY028267 [1,0,0,1,0,0|1,0,1]=4 297 B6R1.2 CC1=CC=NO1 SY038700 [0,1,0,1,0,0|2,0,0]=4 298 B6R1.2 CC1=COC=N1 SY046619 [0,1,0,1,0,0|2,0,0]=4 299 B6R1.2 O=C1C=CCN1 SY032773 [0,1,0,1,0,0|2,0,0]=4 300 B6R1.2 O=C1C=CCO1 SY017893 [0,1,0,1,0,0|1,0,1]=4 301 B6R1.2 O=C1CC=NN1 SY211686 [0,1,0,1,0,0|2,0,0]=4 302 B6R1.2 O=C1CCNC1 SY019727 [0,1,0,1,0,0|2,0,0]=4 303 B6R1.2 O=C1CCNN1 SY073624 [0,1,0,1,0,0|2,0,0]=4 304 B6R1.2 O=C1CCOC1 SY003100 [0,1,0,1,0,0|1,0,0]=3 305 B6R1.2 O=C1NCCO1 SY003480 [0,1,0,1,0,0|1,0,0]=3 306 B6R1.2 O=C1NCCS1 SY037960 [0,1,0,1,0,0|1,1,0]=4 307 B6R1.2 O=C1OC=CO1 SY001314 [0,1,0,1,0,0|1,0,1]=4 308 B6R1.2 O=S1OCCO1 SY036937 [0,1,0,1,0,0|2,0,0]=4 309 B6R1.5 NC1CC(=O)C1 SY022838 [0,1,0,1,0,0|2,0,0]=4 310 B6R1.5 O=C1CC(Br)C1 SY029031 [0,1,0,1,0,0|2,0,0]=4 311 B6R1.11 O=C(O)[C@H]1CO1 SY289468 [0,1,0,1,0,0|2,0,0]=4 312 B6R1.4 O=C1CCC1Br SY234041 [0,1,0,1,0,0|2,0,0]=4 313 B6R1.6 O=CC1COC1 SY097875 [0,1,0,1,0,0|1,0,1]=4 314 B6R1.6 ON=C1CCC1 SY185260 [0,1,0,1,0,0|2,0,0]=4