0 B3R0.1 C#CCN P39910 [0,0,0,0,0,0|1,0,1]=2 1 B3R0.1 C#C[Zn]Cl E7775 [0,0,0,0,0,0|3,0,1]=4 2 B3R0.1 CCCN P62456 [0,0,0,0,0,0|1,0,0]=1 3 B3R0.1 CCNC M39932 [0,0,0,0,0,0|3,0,0]=3 4 B3R0.1 CCON E60797 [0,0,0,0,0,0|2,0,0]=2 5 B3R0.1 FCCI F39767 [0,0,0,0,0,0|2,0,0]=2 6 B3R0.1 N#CCI K39764 [0,0,0,0,0,0|1,0,2]=3 7 B3R0.1 N#CCN A68631 [0,0,0,0,0,0|1,0,1]=2 8 B3R0.1 NCCBr B68074 [0,0,0,0,0,0|1,0,0]=1 9 B3R0.1 NCCCl C68611 [0,0,0,0,0,0|1,0,0]=1 10 B3R0.1 NCCF F39796 [0,0,0,0,0,0|1,0,0]=1 11 B2R0.1 Br[Ni]Br N62631 [1,0,0,0,0,0|3,0,0]=4 12 B2R0.1 Br[Pd]Br P61170 [1,0,0,0,0,0|3,0,0]=4 13 B2R0.1 CNN M39755 [1,0,0,0,0,0|1,0,0]=2 14 B2R0.1 CNO M67840 [1,0,0,0,0,0|1,0,0]=2 15 B2R0.1 CON H69345 [1,0,0,0,0,0|1,0,0]=2 16 B2R0.1 CSC C60754 [1,0,0,0,0,0|2,0,0]=3 17 B2R0.1 Cl[Pt]Cl P61330 [1,0,0,0,0,0|3,0,0]=4 18 B2R0.1 N=CN F67909 [1,0,0,0,0,0|1,0,1]=3 19 B4R0.1 C#CC(N)=O P39827 [0,1,0,0,0,0|1,0,2]=4 20 B4R0.1 C#C[C@@H](C)O B62970 [0,1,0,0,0,0|1,0,1]=3 21 B4R0.1 C#C[C@H](C)N B32316 [0,1,0,0,0,0|1,0,1]=3 22 B4R0.1 C#C[C@H](C)O B40212 [0,1,0,0,0,0|1,0,1]=3 23 B4R0.1 C=C(Br)CO B39863 [0,1,0,0,0,0|1,0,1]=3 24 B4R0.1 C=C(I)CO I9998 [0,1,0,0,0,0|1,0,1]=3 25 B4R0.1 CC(=N)NN A38897 [0,1,0,0,0,0|2,0,1]=4 26 B4R0.1 CC(=O)CN A38843 [0,1,0,0,0,0|0,0,2]=3 27 B4R0.1 CC(=O)CO H60801 [0,1,0,0,0,0|1,0,1]=3 28 B4R0.1 CC(=O)NN A64932 [0,1,0,0,0,0|1,0,2]=4 29 B4R0.1 CC(C)NN P67395 [0,1,0,0,0,0|2,0,0]=3 30 B4R0.1 CC(C)NO P39934 [0,1,0,0,0,0|2,0,0]=3 31 B4R0.1 CC(C)ON P39935 [0,1,0,0,0,0|2,0,0]=3 32 B4R0.1 CC(N)=NO H37897 [0,1,0,0,0,0|1,0,1]=3 33 B4R0.1 CCB(O)O E3108 [0,1,0,0,0,0|2,0,0]=3 34 B4R0.1 CCC(=N)N P39882 [0,1,0,0,0,0|1,0,1]=3 35 B4R0.1 CCC(=N)N P39927 [0,1,0,0,0,0|1,0,1]=3 36 B4R0.1 CCC(N)=O P68920 [0,1,0,0,0,0|1,0,1]=3 37 B4R0.1 CC[C@H](C)N B62608 [0,1,0,0,0,0|1,0,0]=2 38 B4R0.1 CC[S@](=O)[O-] S39781 [0,1,0,0,0,0|2,0,1]=4 39 B4R0.1 CNC(=N)N M38407 [0,1,0,0,0,0|2,0,1]=4 40 B4R0.1 COC(=N)N M69240 [0,1,0,0,0,0|2,0,1]=4 41 B4R0.1 CSC(=N)N M60715 [0,1,0,0,0,0|2,0,1]=4 42 B4R0.1 C[C@@H](Cl)CO C39879 [0,1,0,0,0,0|1,0,0]=2 43 B4R0.1 C[C@@H](N)CN D39937 [0,1,0,0,0,0|1,0,0]=2 44 B4R0.1 C[C@@H](N)CO A13415 [0,1,0,0,0,0|0,0,0]=1 45 B4R0.1 C[C@@H](O)CCl C67728 [0,1,0,0,0,0|1,0,0]=2 46 B4R0.1 C[C@@H](O)CN A67482 [0,1,0,0,0,0|0,0,0]=1 47 B4R0.1 C[C@H](Br)CN B39885 [0,1,0,0,0,0|1,0,0]=2 48 B4R0.1 C[C@H](Cl)CO C39880 [0,1,0,0,0,0|1,0,0]=2 49 B4R0.1 C[C@H](N)CF F62811 [0,1,0,0,0,0|1,0,0]=2 50 B4R0.1 C[C@H](N)CN P39936 [0,1,0,0,0,0|1,0,0]=2 51 B4R0.1 C[C@H](N)CO A13416 [0,1,0,0,0,0|0,0,0]=1 52 B4R0.1 C[C@H](N)CO A69136 [0,1,0,0,0,0|0,0,0]=1 53 B4R0.1 C[C@H](O)CN A69178 [0,1,0,0,0,0|0,0,0]=1 54 B4R0.1 C[C@H](O)CO P60705 [0,1,0,0,0,0|1,0,0]=2 55 B4R0.1 N=C(N)CCl C39776 [0,1,0,0,0,0|1,0,1]=3 56 B4R0.1 N=C(N)CO H39795 [0,1,0,0,0,0|0,0,1]=2 57 B4R0.1 NC(=O)CBr B39771 [0,1,0,0,0,0|1,0,1]=3 58 B4R0.1 NC(=O)CI K60849 [0,1,0,0,0,0|1,0,1]=3 59 B4R0.1 NC(=O)CO H68919 [0,1,0,0,0,0|0,0,1]=2 60 B4R0.1 NC(=S)CF F6787 [0,1,0,0,0,0|1,0,1]=3 61 B4R0.1 NCC(N)=O G69255 [0,1,0,0,0,0|0,0,2]=3 62 B4R0.1 NNC(N)=O S69135 [0,1,0,0,0,0|1,0,2]=4 63 B4R0.1 NNC(N)=S T60590 [0,1,0,0,0,0|1,1,1]=4 64 B4R0.1 ON=C(Br)Br D2176 [0,1,0,0,0,0|2,0,1]=4 65 B4R0.2 BrCCCBr D69412 [0,1,0,0,0,0|2,0,0]=3 66 B4R0.2 C#CCCN B40327 [0,1,0,0,0,0|1,0,0]=2 67 B4R0.2 C#CCCO B26554 [0,1,0,0,0,0|1,0,0]=2 68 B4R0.2 C#CCNC M60803 [0,1,0,0,0,0|1,0,1]=3 69 B4R0.2 C#CCON P6115 [0,1,0,0,0,0|1,0,1]=3 70 B4R0.2 C=CCCN B21913 [0,1,0,0,0,0|1,0,0]=2 71 B4R0.2 C=CCCO B40252 [0,1,0,0,0,0|1,0,0]=2 72 B4R0.2 C=CCON A39923 [0,1,0,0,0,0|1,0,1]=3 73 B4R0.2 CC#CCO H64582 [0,1,0,0,0,0|1,0,1]=3 74 B4R0.2 CCCNN P39906 [0,1,0,0,0,0|1,0,0]=2 75 B4R0.2 CNCC#N M39141 [0,1,0,0,0,0|1,0,1]=3 76 B4R0.2 CNCCBr B38473 [0,1,0,0,0,0|1,0,0]=2 77 B4R0.2 CNCCCl C39886 [0,1,0,0,0,0|1,0,0]=2 78 B4R0.2 COCCBr B39138 [0,1,0,0,0,0|1,0,0]=2 79 B4R0.2 COCCI K39881 [0,1,0,0,0,0|1,0,0]=2 80 B4R0.2 CSCCN M62136 [0,1,0,0,0,0|0,1,0]=2 81 B4R0.2 ClCCCI C1367 [0,1,0,0,0,0|2,0,0]=3 82 B4R0.2 ICCCI D39865 [0,1,0,0,0,0|2,0,0]=3 83 B4R0.2 N#CCCN C64951 [0,1,0,0,0,0|1,0,0]=2 84 B4R0.2 N#CCCO H67414 [0,1,0,0,0,0|0,0,1]=2 85 B4R0.2 N#CCCS M39860 [0,1,0,0,0,0|0,1,1]=3 86 B4R0.2 NCCCCl C37835 [0,1,0,0,0,0|1,0,0]=2 87 B4R0.2 NCCCO A69322 [0,1,0,0,0,0|0,0,0]=1 88 B4R0.2 NOCCO A39786 [0,1,0,0,0,0|0,0,0]=1 89 B4R0.2 OCC#CI I9917 [0,1,0,0,0,0|1,0,1]=3 90 B4R0.2 OCCCBr B39137 [0,1,0,0,0,0|1,0,0]=2 91 B4R0.2 OCCCO P69117 [0,1,0,0,0,0|1,0,0]=2 92 B4R1.1 C1CNC1 A1584 [0,0,0,1,0,0|1,0,0]=2 93 B4R1.1 C1CNC1 A31833 [0,0,0,1,0,0|1,0,0]=2 94 B4R1.2 BrC1CC1 B23669 [0,0,0,1,0,0|2,0,0]=3 95 B4R1.2 C[C@@H]1CN1 M6947 [0,0,0,1,0,0|1,0,0]=2 96 B4R1.2 C[C@H]1CN1 M6944 [0,0,0,1,0,0|1,0,0]=2 97 B4R1.2 OC1CC1 C21681 [0,0,0,1,0,0|1,0,0]=2 98 B1R0.1 NN H69268 [2,0,0,0,0,0|1,0,0]=3 99 B1R0.1 S=[Ca] C64763 [2,0,0,0,0,0|1,1,0]=4 100 B3R0.2 C=C(C)[Mg+] K5651 [1,1,0,0,0,0|1,0,1]=4 101 B3R0.2 CC(=O)O F69263 [1,1,0,0,0,0|0,0,1]=3 102 B3R0.2 CC(=O)[O-] C69398 [1,1,0,0,0,0|0,0,2]=4 103 B3R0.2 CC(=O)[O-] M67642 [1,1,0,0,0,0|0,0,2]=4 104 B3R0.2 CC(=O)[O-] N62590 [1,1,0,0,0,0|0,0,2]=4 105 B3R0.2 CC(=O)[O-] P67455 [1,1,0,0,0,0|0,0,2]=4 106 B3R0.2 CC(=O)[O-] R62611 [1,1,0,0,0,0|0,0,2]=4 107 B3R0.2 CC(=O)[O-] S62515 [1,1,0,0,0,0|0,0,2]=4 108 B3R0.2 CC(C)N P39142 [1,1,0,0,0,0|0,0,0]=2 109 B3R0.2 C[S+](C)C T68118 [1,1,0,0,0,0|2,0,0]=4 110 B3R0.2 C[S@](=O)[O-] S60840 [1,1,0,0,0,0|1,0,1]=4 111 B3R0.2 N=C(N)Cl C39757 [1,1,0,0,0,0|1,0,1]=4 112 B3R0.2 NC(=S)S A39756 [1,1,0,0,0,0|0,1,1]=4 113 B3R0.2 O[11B](O)O B5112 [1,1,0,0,0,0|2,0,0]=4 114 B5R0.1 C#CCC(=O)O B38084 [0,2,0,0,0,0|1,0,1]=4 115 B5R0.1 C=C(C)CON M40345 [0,2,0,0,0,0|1,0,1]=4 116 B5R0.1 C=CC[C@H](C)O P62507 [0,2,0,0,0,0|1,0,0]=3 117 B5R0.1 CC#C[C@H](C)O B1790 [0,2,0,0,0,0|1,0,1]=4 118 B5R0.1 CC(=O)CCCl C69539 [0,2,0,0,0,0|1,0,1]=4 119 B5R0.1 CC(C)CNN B40316 [0,2,0,0,0,0|1,0,0]=3 120 B5R0.1 CC(C)\C=N\O I2624 [0,2,0,0,0,0|1,0,1]=4 121 B5R0.1 CCCB(O)O P5056 [0,2,0,0,0,0|1,0,0]=3 122 B5R0.1 CCC[C@@H](C)N P16023 [0,2,0,0,0,0|1,0,0]=3 123 B5R0.1 CCC[C@H](C)N P22363 [0,2,0,0,0,0|1,0,0]=3 124 B5R0.1 CCOC(=N)N E36845 [0,2,0,0,0,0|1,0,1]=4 125 B5R0.1 CN(C)CC=O D39943 [0,2,0,0,0,0|0,0,2]=4 126 B5R0.1 CN(C)CCBr B39953 [0,2,0,0,0,0|1,0,0]=3 127 B5R0.1 CNCC(=O)O M68590 [0,2,0,0,0,0|0,0,1]=3 128 B5R0.1 CNCC(N)=O M68358 [0,2,0,0,0,0|0,0,2]=4 129 B5R0.1 COCC(=N)N M39928 [0,2,0,0,0,0|0,0,1]=3 130 B5R0.1 COCC(=O)O M69331 [0,2,0,0,0,0|1,0,1]=4 131 B5R0.1 COC[C@@H](C)N M40311 [0,2,0,0,0,0|0,0,0]=2 132 B5R0.1 COC[C@@H](C)O M39959 [0,2,0,0,0,0|1,0,0]=3 133 B5R0.1 COC[C@H](C)O M61064 [0,2,0,0,0,0|1,0,0]=3 134 B5R0.1 C[C@@H](N)CCO A10772 [0,2,0,0,0,0|0,0,0]=2 135 B5R0.1 C[C@H](N)CCO A10771 [0,2,0,0,0,0|0,0,0]=2 136 B5R0.1 C[C@H](N)CCO A39964 [0,2,0,0,0,0|0,0,0]=2 137 B5R0.1 C[C@H](O)CCO B68917 [0,2,0,0,0,0|1,0,0]=3 138 B5R0.1 N#CCC(N)=O C60562 [0,2,0,0,0,0|1,0,1]=4 139 B5R0.1 NCCC(N)=O A67869 [0,2,0,0,0,0|0,0,1]=3 140 B5R0.1 NCC[P@H](=O)O A39788 [0,2,0,0,0,0|0,0,0]=2 141 B5R0.1 NOCC(=O)O C40302 [0,2,0,0,0,0|0,0,1]=3 142 B5R0.1 O=[N+]([O-])CCO N39779 [0,2,0,0,0,0|0,0,1]=3 143 B5R0.1 OCCC(F)F D60407 [0,2,0,0,0,0|1,0,0]=3 144 B5R0.3 C=C(CBr)CBr B36829 [0,2,0,0,0,0|2,0,0]=4 145 B5R0.3 C=C(CCl)CCl C10867 [0,2,0,0,0,0|2,0,0]=4 146 B5R0.3 C=C(CO)CO M5145 [0,2,0,0,0,0|1,0,0]=3 147 B5R0.3 C=C[C@H](C)ON B40346 [0,2,0,0,0,0|1,0,1]=4 148 B5R0.3 C=C[C@H](N)CO A40343 [0,2,0,0,0,0|0,0,0]=2 149 B5R0.3 CC(CBr)CBr D40238 [0,2,0,0,0,0|2,0,0]=4 150 B5R0.3 CC(CO)CO M60880 [0,2,0,0,0,0|1,0,0]=3 151 B5R0.3 CCC(=N)NO H39883 [0,2,0,0,0,0|1,0,1]=4 152 B5R0.3 CCC(=O)CN A32390 [0,2,0,0,0,0|1,0,0]=3 153 B5R0.3 CCC(=O)CO H36713 [0,2,0,0,0,0|1,0,0]=3 154 B5R0.3 CCC(N)CC P40440 [0,2,0,0,0,0|1,0,0]=3 155 B5R0.3 CC[C@@H](N)CO A39144 [0,2,0,0,0,0|0,0,0]=2 156 B5R0.3 CC[C@@H](O)CO B39955 [0,2,0,0,0,0|1,0,0]=3 157 B5R0.3 CC[C@H](N)CO A39145 [0,2,0,0,0,0|0,0,0]=2 158 B5R0.3 CC[C@H](O)CO B39956 [0,2,0,0,0,0|1,0,0]=3 159 B5R0.3 CNC(=O)CBr B60913 [0,2,0,0,0,0|1,0,1]=4 160 B5R0.3 CNC(=O)CCl C67921 [0,2,0,0,0,0|1,0,1]=4 161 B5R0.3 COC(=O)CN M69126 [0,2,0,0,0,0|0,0,1]=3 162 B5R0.3 COC(=O)CO M67586 [0,2,0,0,0,0|1,0,1]=4 163 B5R0.3 CO[C@@H](C)CN M40313 [0,2,0,0,0,0|0,0,0]=2 164 B5R0.3 CO[C@@H](C)CO M68380 [0,2,0,0,0,0|1,0,0]=3 165 B5R0.3 CO[C@H](C)CN M40312 [0,2,0,0,0,0|0,0,0]=2 166 B5R0.3 CO[C@H](C)CO M68381 [0,2,0,0,0,0|1,0,0]=3 167 B5R0.3 NCC(O)CN D38498 [0,2,0,0,0,0|0,0,0]=2 168 B5R0.3 NC[C@@H](O)CCl A39888 [0,2,0,0,0,0|0,0,0]=2 169 B5R0.3 NC[C@@H](O)CO A67523 [0,2,0,0,0,0|0,0,0]=2 170 B5R0.3 NC[C@H](Br)CBr D9273 [0,2,0,0,0,0|1,0,0]=3 171 B5R0.3 NC[C@H](O)CCl A36622 [0,2,0,0,0,0|0,0,0]=2 172 B5R0.3 NC[C@H](O)CCl A39887 [0,2,0,0,0,0|0,0,0]=2 173 B5R0.3 NC[C@H](O)CF A28629 [0,2,0,0,0,0|0,0,0]=2 174 B5R0.3 NC[C@H](O)CO A38562 [0,2,0,0,0,0|0,0,0]=2 175 B5R0.3 NC[C@H](O)CO A67451 [0,2,0,0,0,0|0,0,0]=2 176 B5R0.3 NNC(=O)CO H32091 [0,2,0,0,0,0|0,0,1]=3 177 B5R0.3 O=C(CCl)CCl D4849 [0,2,0,0,0,0|2,0,0]=4 178 B5R0.3 O=C[C@H](O)CO D39873 [0,2,0,0,0,0|1,0,0]=3 179 B5R0.3 OC[C@@H](O)CCl C69122 [0,2,0,0,0,0|1,0,0]=3 180 B5R0.3 OC[C@@H](O)CF F60905 [0,2,0,0,0,0|1,0,0]=3 181 B5R0.3 OC[C@H](O)CCl C68371 [0,2,0,0,0,0|1,0,0]=3 182 B5R0.3 OC[C@H](O)CF F60904 [0,2,0,0,0,0|1,0,0]=3 183 B5R0.4 CC(C)(C)CN D41344 [0,2,0,0,0,0|1,0,0]=3 184 B5R0.4 CC(C)(C)C[Mg+] D31702 [0,2,0,0,0,0|2,0,0]=4 185 B5R0.4 CC(C)(C)NO B41419 [0,2,0,0,0,0|2,0,0]=4 186 B5R0.4 CC(C)(C)ON B40314 [0,2,0,0,0,0|2,0,0]=4 187 B5R0.4 CC(C)(F)CO F64897 [0,2,0,0,0,0|1,0,0]=3 188 B5R0.4 CC(C)(N)C#N A39161 [0,2,0,0,0,0|1,0,1]=4 189 B5R0.4 CC(C)(N)CN M25502 [0,2,0,0,0,0|1,0,0]=3 190 B5R0.4 CC(C)(N)CO A68632 [0,2,0,0,0,0|0,0,0]=2 191 B5R0.4 CC(C)(O)CCl C40272 [0,2,0,0,0,0|1,0,0]=3 192 B5R0.4 CC(C)(O)CN A10987 [0,2,0,0,0,0|0,0,0]=2 193 B5R0.4 CC(C)(O)CO M37968 [0,2,0,0,0,0|1,0,0]=3 194 B5R0.4 CC(C)(S)CN A40315 [0,2,0,0,0,0|0,1,0]=3 195 B5R0.4 CC(F)(F)CN D38838 [0,2,0,0,0,0|1,0,0]=3 196 B5R0.4 CCS(N)(=O)=O E39787 [0,2,0,0,0,0|2,0,0]=4 197 B5R0.4 FC(F)(F)CI T64972 [0,2,0,0,0,0|2,0,0]=4 198 B5R0.4 NCC(F)(F)F T28223 [0,2,0,0,0,0|1,0,0]=3 199 B5R0.4 OCC(Cl)(Cl)Cl T60737 [0,2,0,0,0,0|1,0,0]=3 200 B5R0.5 CC(C)B(O)O P39893 [0,2,0,0,0,0|2,0,0]=4 201 B5R0.5 CC(C)C(=N)N B40303 [0,2,0,0,0,0|1,0,1]=4 202 B5R0.5 CC(C)C(N)=O I4848 [0,2,0,0,0,0|1,0,1]=4 203 B5R0.5 CC(C)C(N)=S M3101 [0,2,0,0,0,0|1,0,1]=4 204 B5R0.5 CC(O)C(=O)[O-] C60888 [0,2,0,0,0,0|1,0,1]=4 205 B5R0.5 C[C@@H](Cl)C(=O)O C60901 [0,2,0,0,0,0|1,0,1]=4 206 B5R0.5 C[C@@H](N)C(N)=O A69602 [0,2,0,0,0,0|0,0,2]=4 207 B5R0.5 C[C@@H](O)C(N)=O H68918 [0,2,0,0,0,0|0,0,1]=3 208 B5R0.5 C[C@@H](O)[C@@H](C)O B39957 [0,2,0,0,0,0|1,0,0]=3 209 B5R0.5 C[C@H](N)C(=O)O A39925 [0,2,0,0,0,0|0,0,1]=3 210 B5R0.5 C[C@H](N)C(=O)O A60902 [0,2,0,0,0,0|0,0,1]=3 211 B5R0.5 C[C@H](O)[C@H](C)O B39958 [0,2,0,0,0,0|1,0,0]=3 212 B5R0.5 NC(=S)C(F)F D6794 [0,2,0,0,0,0|1,0,1]=4 213 B5R0.2 BrCCCCBr D69410 [0,2,0,0,0,0|2,0,0]=4 214 B5R0.2 BrC\C=C\CBr D60806 [0,2,0,0,0,0|2,0,0]=4 215 B5R0.2 C#CCCCCl C68183 [0,2,0,0,0,0|2,0,0]=4 216 B5R0.2 C#CCCCI I8474 [0,2,0,0,0,0|2,0,0]=4 217 B5R0.2 C#CCCCN P41368 [0,2,0,0,0,0|1,0,0]=3 218 B5R0.2 C#CCCCO P68382 [0,2,0,0,0,0|1,0,0]=3 219 B5R0.2 C=CCCCBr B41237 [0,2,0,0,0,0|2,0,0]=4 220 B5R0.2 C=CCCCCl C41238 [0,2,0,0,0,0|2,0,0]=4 221 B5R0.2 C=CCCCO P36921 [0,2,0,0,0,0|1,0,0]=3 222 B5R0.2 CCCCON B40310 [0,2,0,0,0,0|1,0,0]=3 223 B5R0.2 CNCCCCl C39954 [0,2,0,0,0,0|1,0,0]=3 224 B5R0.2 CNCCCO M36844 [0,2,0,0,0,0|0,0,0]=2 225 B5R0.2 CNCCOC M23409 [0,2,0,0,0,0|0,0,0]=2 226 B5R0.2 COCCC#N M39153 [0,2,0,0,0,0|0,0,1]=3 227 B5R0.2 COCCCBr B68335 [0,2,0,0,0,0|1,0,0]=3 228 B5R0.2 COCCCO M69411 [0,2,0,0,0,0|1,0,0]=3 229 B5R0.2 ClCC#CCCl D40070 [0,2,0,0,0,0|2,0,0]=4 230 B5R0.2 ClCCCCI C40239 [0,2,0,0,0,0|2,0,0]=4 231 B5R0.2 ICCCCI D37834 [0,2,0,0,0,0|2,0,0]=4 232 B5R0.2 N#CCCCBr B67593 [0,2,0,0,0,0|1,0,1]=4 233 B5R0.2 N#CCCCCl C64907 [0,2,0,0,0,0|1,0,1]=4 234 B5R0.2 NCCCCBr B39952 [0,2,0,0,0,0|1,0,0]=3 235 B5R0.2 NCCCCN D39162 [0,2,0,0,0,0|1,0,0]=3 236 B5R0.2 NC\C=C/CCl C65470 [0,2,0,0,0,0|1,0,0]=3 237 B5R0.2 NC\C=C/CN B69714 [0,2,0,0,0,0|1,0,0]=3 238 B5R0.2 NOCC=CCl C39871 [0,2,0,0,0,0|1,0,1]=4 239 B5R0.2 NOCCON E62368 [0,2,0,0,0,0|0,0,0]=2 240 B5R0.2 OCCCCBr B67330 [0,2,0,0,0,0|1,0,0]=3 241 B5R0.2 OC\C=C\CO B64254 [0,2,0,0,0,0|1,0,0]=3 242 B5R1.2 BrC1CCC1 B23687 [0,1,0,1,0,0|2,0,0]=4 243 B5R1.2 BrC1CNC1 B13326 [0,1,0,1,0,0|1,0,0]=3 244 B5R1.2 BrC1COC1 B5688 [0,1,0,1,0,0|1,0,0]=3 245 B5R1.2 CC1CNC1 M1321 [0,1,0,1,0,0|1,0,0]=3 246 B5R1.2 C[C@H]1CCN1 M29512 [0,1,0,1,0,0|1,0,0]=3 247 B5R1.2 ClC1CNC1 C1323 [0,1,0,1,0,0|1,0,0]=3 248 B5R1.2 ClC1COC1 C8470 [0,1,0,1,0,0|1,0,0]=3 249 B5R1.2 FC1CNC1 F5255 [0,1,0,1,0,0|1,0,0]=3 250 B5R1.2 IC1CCC1 I23424 [0,1,0,1,0,0|2,0,0]=4 251 B5R1.2 IC1CNC1 I13327 [0,1,0,1,0,0|1,0,0]=3 252 B5R1.2 IC1COC1 I5689 [0,1,0,1,0,0|1,0,0]=3 253 B5R1.2 NC1CCC1 C60561 [0,1,0,1,0,0|1,0,0]=3 254 B5R1.2 NC1CNC1 A5482 [0,1,0,1,0,0|1,0,0]=3 255 B5R1.2 NC1COC1 O5613 [0,1,0,1,0,0|0,0,0]=2 256 B5R1.2 NC1CSC1 T6025 [0,1,0,1,0,0|0,1,0]=3 257 B5R1.2 O=C1CCC1 C8674 [0,1,0,1,0,0|1,0,1]=4 258 B5R1.2 O=C1CNC1 A1318 [0,1,0,1,0,0|0,0,2]=4 259 B5R1.2 O=C1COC1 O4015 [0,1,0,1,0,0|1,0,1]=4 260 B5R1.2 OC1CNC1 H2864 [0,1,0,1,0,0|0,0,0]=2 261 B5R1.2 OC1COC1 O5686 [0,1,0,1,0,0|1,0,0]=3 262 B5R1.2 SC1CNC1 A11453 [0,1,0,1,0,0|0,1,0]=3 263 B5R1.2 SC1COC1 O8471 [0,1,0,1,0,0|1,0,0]=3 264 B5R1.2 [Mg+]C1CCC1 P5028 [0,1,0,1,0,0|2,0,0]=4 265 B5R1.3 BrCC1CC1 C2498 [0,1,0,1,0,0|2,0,0]=4 266 B5R1.3 CNC1CC1 M1319 [0,1,0,1,0,0|1,0,0]=3 267 B5R1.3 CNC1CC1 M14718 [0,1,0,1,0,0|1,0,0]=3 268 B5R1.3 ClC[C@@H]1CO1 E10841 [0,1,0,1,0,0|1,0,0]=3 269 B5R1.3 ClC[C@H]1CO1 E10840 [0,1,0,1,0,0|1,0,0]=3 270 B5R1.3 NNC1CC1 C19179 [0,1,0,1,0,0|1,0,0]=3 271 B5R1.3 NNC1CC1 C32080 [0,1,0,1,0,0|1,0,0]=3 272 B5R1.3 O=CC1CC1 C20058 [0,1,0,1,0,0|1,0,1]=4 273 B5R1.3 OC[C@@H]1CO1 X39872 [0,1,0,1,0,0|1,0,0]=3 274 B5R1.3 OC[C@H]1CO1 X60516 [0,1,0,1,0,0|1,0,0]=3 275 B5R1.4 C[C@@H]1C[C@H]1N M40340 [0,1,0,1,0,0|1,0,0]=3 276 B5R1.4 N[C@@H]1C[C@H]1F F32136 [0,1,0,1,0,0|1,0,0]=3 277 B5R1.5 CC1(Br)CC1 B29865 [0,1,0,1,0,0|2,0,0]=4 278 B5R1.5 CC1(N)CC1 M13330 [0,1,0,1,0,0|1,0,0]=3 279 B5R1.5 CC1(O)CC1 M22890 [0,1,0,1,0,0|1,0,0]=3 280 B5R1.1 C1=CCNC1 D40328 [0,1,0,1,0,0|1,0,1]=4 281 B5R1.1 C1CNNC1 P39938 [0,1,0,1,0,0|1,0,0]=3 282 B5R1.1 C1CSCN1 T38217 [0,1,0,1,0,0|0,1,0]=3 283 B5R1.1 C1CSCN1 T60563 [0,1,0,1,0,0|0,1,0]=3