0 B4R0.1 C=CC(N)=O DY822472 [0,0,0,0,0,0|3,0,1]=4 1 B4R0.1 CC(=O)CBr DY20986 [0,0,0,0,0,0|2,0,2]=4 2 B4R0.1 CC(=O)CN NO10921 [0,0,0,0,0,0|2,0,2]=4 3 B4R0.1 CC(=O)CO NO11467 [0,0,0,0,0,0|1,0,3]=4 4 B4R0.1 CC(=O)NN NO10881 [0,0,0,0,0,0|3,0,1]=4 5 B4R0.1 CC(=O)NO NO14961 [0,0,0,0,0,0|2,0,2]=4 6 B4R0.1 CC(C)=NO NO10884 [0,0,0,0,0,0|1,0,2]=3 7 B4R0.1 CC(C)CO DY740701 [0,0,0,0,0,0|0,0,2]=2 8 B4R0.1 CC(C)NN NO11525 [0,0,0,0,0,0|2,0,0]=2 9 B4R0.1 CC(C)ON NO13668 [0,0,0,0,0,0|2,0,0]=2 10 B4R0.1 CC(Cl)CCl DY822285 [0,0,0,0,0,0|2,0,1]=3 11 B4R0.1 CC(N)C#N DY568905 [0,0,0,0,0,0|2,0,1]=3 12 B4R0.1 CC(N)C#N DY741121 [0,0,0,0,0,0|2,0,1]=3 13 B4R0.1 CC(N)CO NO21310 [0,0,0,0,0,0|1,0,2]=3 14 B4R0.1 CC(O)CCl DY586846 [0,0,0,0,0,0|2,0,1]=3 15 B4R0.1 CCC(C)I DY740911 [0,0,0,0,0,0|2,0,1]=3 16 B4R0.1 C[C@@H](Cl)CO NO20251 [0,0,0,0,0,0|1,0,2]=3 17 B4R0.1 C[C@@H](N)CN DY10147 [0,0,0,0,0,0|2,0,1]=3 18 B4R0.1 C[C@@H](N)CO NO14182 [0,0,0,0,0,0|1,0,2]=3 19 B4R0.1 C[C@@H](O)CCl DY20696 [0,0,0,0,0,0|2,0,1]=3 20 B4R0.1 C[C@@H](O)CO DY20330 [0,0,0,0,0,0|1,0,2]=3 21 B4R0.1 C[C@H](N)CN NO20323 [0,0,0,0,0,0|2,0,1]=3 22 B4R0.1 C[C@H](N)CO DY624919 [0,0,0,0,0,0|1,0,2]=3 23 B4R0.1 C[C@H](N)CO NO19476 [0,0,0,0,0,0|1,0,2]=3 24 B4R0.1 C[C@H](O)C#N DY822232 [0,0,0,0,0,0|2,0,1]=3 25 B4R0.1 C[C@H](O)CCl DY20697 [0,0,0,0,0,0|2,0,1]=3 26 B4R0.1 C[C@H](O)CN NO14075 [0,0,0,0,0,0|2,0,1]=3 27 B4R0.1 C\C(N)=N\O NO10879 [0,0,0,0,0,0|2,0,2]=4 28 B4R0.1 C\C=C(/C)Br DY10255 [0,0,0,0,0,0|2,0,1]=3 29 B4R0.1 C\N=[N+](/C)[O-] DY544839 [0,0,0,0,0,0|4,0,0]=4 30 B4R0.1 FC(F)=CCl DY794691 [0,0,0,0,0,0|3,0,1]=4 31 B4R0.1 N#CC(F)Br DY799305 [0,0,0,0,0,0|3,0,1]=4 32 B4R0.1 OCC(F)F NO20974 [0,0,0,0,0,0|2,0,2]=4 33 B3R0.1 C#CC=O DY743011 [1,0,0,0,0,0|0,0,2]=3 34 B3R0.1 C=CCBr DY41858 [1,0,0,0,0,0|2,0,0]=3 35 B3R0.1 C=CCN DY500409 [1,0,0,0,0,0|2,0,0]=3 36 B3R0.1 CCNC DY822410 [1,0,0,0,0,0|2,0,0]=3 37 B3R0.1 CCNN DY563997 [1,0,0,0,0,0|2,0,0]=3 38 B3R0.1 CNC=O DY513177 [1,0,0,0,0,0|1,0,0]=2 39 B3R0.1 CNOC NO13986 [1,0,0,0,0,0|3,0,0]=4 40 B3R0.1 CSCCl DY584302 [1,0,0,0,0,0|2,0,1]=4 41 B3R0.1 NCCBr NO14044 [1,0,0,0,0,0|2,0,1]=4 42 B3R0.1 NCCCl NO16188 [1,0,0,0,0,0|2,0,1]=4 43 B3R0.1 NCCF NO21564 [1,0,0,0,0,0|2,0,1]=4 44 B3R0.1 NCCN DY521541 [1,0,0,0,0,0|2,0,1]=4 45 B3R0.1 NCCN DY561063 [1,0,0,0,0,0|2,0,1]=4 46 B3R0.1 NCCN DY567273 [1,0,0,0,0,0|2,0,1]=4 47 B3R0.1 NCCS DY460548 [1,0,0,0,0,0|1,1,1]=4 48 B3R0.1 O=CC=O DY562899 [1,0,0,0,0,0|1,0,1]=3 49 B3R0.1 OCCF DY822289 [1,0,0,0,0,0|1,0,2]=4 50 B3R0.1 SCCS DY20652 [1,0,0,0,0,0|1,1,1]=4 51 B3R0.2 CB(O)O DY508688 [1,0,0,0,0,0|2,0,1]=4 52 B3R0.2 CC(=O)O DY562245 [1,0,0,0,0,0|1,0,1]=3 53 B3R0.2 CC(=O)[O-] DY564465 [1,0,0,0,0,0|1,0,1]=3 54 B3R0.2 CC(=O)[O-] DY822453 [1,0,0,0,0,0|1,0,1]=3 55 B3R0.2 CC(=O)[O-] DY822777 [1,0,0,0,0,0|1,0,1]=3 56 B3R0.2 CC(=O)[O-] DY822867 [1,0,0,0,0,0|1,0,1]=3 57 B3R0.2 CC(=O)[O-] DY822906 [1,0,0,0,0,0|1,0,1]=3 58 B3R0.2 CC(=O)[O-] DY822959 [1,0,0,0,0,0|1,0,1]=3 59 B3R0.2 CC(=O)[O-] DY822960 [1,0,0,0,0,0|1,0,1]=3 60 B3R0.2 CC(=O)[O-] NO11168 [1,0,0,0,0,0|1,0,1]=3 61 B3R0.2 CC(=O)[O-] NO11832 [1,0,0,0,0,0|1,0,1]=3 62 B3R0.2 CC(C)Br DY41864 [1,0,0,0,0,0|1,0,0]=2 63 B3R0.2 CC(C)I DY742309 [1,0,0,0,0,0|1,0,0]=2 64 B3R0.2 CC(C)[O-] DY822961 [1,0,0,0,0,0|0,0,1]=2 65 B3R0.2 CN(C)C DY460488 [1,0,0,0,0,0|1,0,1]=3 66 B3R0.2 CP(Cl)Cl DY566721 [1,0,0,0,0,0|3,0,0]=4 67 B3R0.2 CS(=O)[O-] DY434050 [1,0,0,0,0,0|2,0,0]=3 68 B3R0.2 CS(C)=O DY506586 [1,0,0,0,0,0|1,0,0]=2 69 B3R0.2 C[13C](=O)O DY454749 [1,0,0,0,0,0|1,0,1]=3 70 B3R0.2 C[PH](C)=O DY21075 [1,0,0,0,0,0|1,0,0]=2 71 B3R0.2 C[S+](C)C DY794205 [1,0,0,0,0,0|1,0,1]=3 72 B3R0.2 C[SiH](C)Cl DY822313 [1,0,0,0,0,0|1,1,0]=3 73 B3R0.2 ClC(Cl)Br DY570171 [1,0,0,0,0,0|3,0,0]=4 74 B3R0.2 N[13C](N)=O DY454839 [1,0,0,0,0,0|2,0,1]=4 75 B3R0.2 O=C([O-])O DY822972 [1,0,0,0,0,0|2,0,1]=4 76 B3R0.2 O=C([O-])[O-] DY557709 [1,0,0,0,0,0|2,0,1]=4 77 B3R0.2 O=C([O-])[O-] DY822905 [1,0,0,0,0,0|2,0,1]=4 78 B3R0.2 O=C([O-])[O-] DY822921 [1,0,0,0,0,0|2,0,1]=4 79 B3R0.2 O=C([O-])[O-] NO11119 [1,0,0,0,0,0|2,0,1]=4 80 B3R0.2 O=I(=O)[O-] DY527079 [1,0,0,0,0,0|3,0,0]=4 81 B3R0.2 O=I(=O)[O-] DY822422 [1,0,0,0,0,0|3,0,0]=4 82 B3R0.2 O=I(=O)[O-] DY822423 [1,0,0,0,0,0|3,0,0]=4 83 B3R0.2 O=I(=O)[O-] DY822563 [1,0,0,0,0,0|3,0,0]=4 84 B3R0.2 O=P(=O)[O-] DY822651 [1,0,0,0,0,0|3,0,0]=4 85 B3R0.2 O=P(=O)[O-] DY822964 [1,0,0,0,0,0|3,0,0]=4 86 B3R0.2 O=S([O-])O DY445110 [1,0,0,0,0,0|3,0,0]=4 87 B3R0.2 O=[N+]([O-])[O-] DY500463 [1,0,0,0,0,0|3,0,0]=4 88 B3R0.2 O=[N+]([O-])[O-] DY822419 [1,0,0,0,0,0|3,0,0]=4 89 B3R0.2 O=[N+]([O-])[O-] DY822420 [1,0,0,0,0,0|3,0,0]=4 90 B3R0.2 O=[N+]([O-])[O-] DY822440 [1,0,0,0,0,0|3,0,0]=4 91 B3R0.2 O=[N+]([O-])[O-] DY822892 [1,0,0,0,0,0|3,0,0]=4 92 B3R0.2 O=[N+]([O-])[O-] DY822908 [1,0,0,0,0,0|3,0,0]=4 93 B3R0.2 O=[N+]([O-])[O-] DY822910 [1,0,0,0,0,0|3,0,0]=4 94 B3R0.2 O=[N+]([O-])[O-] DY822925 [1,0,0,0,0,0|3,0,0]=4 95 B3R0.2 O=[N+]([O-])[O-] DY822931 [1,0,0,0,0,0|3,0,0]=4 96 B3R0.2 O=[N+]([O-])[O-] DY822973 [1,0,0,0,0,0|3,0,0]=4 97 B3R0.2 O=[Se](O)O DY822562 [1,0,0,0,0,0|3,0,0]=4 98 B3R0.2 O=[Se]([O-])[O-] DY822560 [1,0,0,0,0,0|3,0,0]=4 99 B3R0.2 O=[Se]([O-])[O-] DY822561 [1,0,0,0,0,0|3,0,0]=4 100 B3R0.2 O=[Sn]([O-])[O-] DY21161 [1,0,0,0,0,0|3,0,0]=4 101 B3R0.2 O=[Sn]([O-])[O-] DY822883 [1,0,0,0,0,0|3,0,0]=4 102 B3R0.2 O=[Te](=O)=O DY822902 [1,0,0,0,0,0|3,0,0]=4 103 B3R0.2 O=[Te]([O-])[O-] DY822923 [1,0,0,0,0,0|3,0,0]=4 104 B3R0.2 O=[Ti]([O-])[O-] DY822897 [1,0,0,0,0,0|3,0,0]=4 105 B3R0.2 O=[V](=O)[O-] DY822896 [1,0,0,0,0,0|3,0,0]=4 106 B3R0.2 O=[V](=O)[O-] DY822898 [1,0,0,0,0,0|3,0,0]=4 107 B3R0.2 O=[Zr]([O-])[O-] DY822872 [1,0,0,0,0,0|3,0,0]=4 108 B3R0.2 O=[Zr]([O-])[O-] DY822890 [1,0,0,0,0,0|3,0,0]=4 109 B3R0.2 O=[Zr]([O-])[O-] DY822895 [1,0,0,0,0,0|3,0,0]=4 110 B3R0.2 O=[Zr]([O-])[O-] DY822900 [1,0,0,0,0,0|3,0,0]=4 111 B5R0.1 CC(=O)\C=N\O NO11520 [0,1,0,0,0,0|1,0,2]=4 112 B5R0.1 CC(=O)\C=N\O NO18968 [0,1,0,0,0,0|1,0,2]=4 113 B5R0.1 CC(C)=CCBr DY41900 [0,1,0,0,0,0|1,0,1]=3 114 B5R0.1 CC(C)=CCCl DY460578 [0,1,0,0,0,0|1,0,1]=3 115 B5R0.1 CC(C)=C[SiH2]Cl DY822351 [0,1,0,0,0,0|1,0,1]=3 116 B5R0.1 CC(C)CC=O NO11530 [0,1,0,0,0,0|0,0,0]=1 117 B5R0.1 CC(C)CCBr DY460632 [0,1,0,0,0,0|1,0,1]=3 118 B5R0.1 CC(N)CCO NO22096 [0,1,0,0,0,0|1,0,2]=4 119 B5R0.1 CC(O)CON NO17735 [0,1,0,0,0,0|1,0,2]=4 120 B5R0.1 CCCC(C)O DY741013 [0,1,0,0,0,0|2,0,1]=4 121 B5R0.1 CN(C)CC=O DY558327 [0,1,0,0,0,0|1,0,0]=2 122 B5R0.1 CN(C)CC=O NO17734 [0,1,0,0,0,0|1,0,0]=2 123 B5R0.1 CN(C)CCBr NO10949 [0,1,0,0,0,0|2,0,1]=4 124 B5R0.1 CN(C)CCCl NO14471 [0,1,0,0,0,0|2,0,1]=4 125 B5R0.1 CN(C)CCN NO18603 [0,1,0,0,0,0|2,0,1]=4 126 B5R0.1 CN(C)CCO NO11733 [0,1,0,0,0,0|1,0,2]=4 127 B5R0.1 COCC(C)O NO20741 [0,1,0,0,0,0|1,0,2]=4 128 B5R0.1 COC[C@@H](C)O NO20249 [0,1,0,0,0,0|1,0,2]=4 129 B5R0.1 COC[C@H](C)N DY623421 [0,1,0,0,0,0|1,0,2]=4 130 B5R0.1 COC[C@H](C)O NO20309 [0,1,0,0,0,0|1,0,2]=4 131 B5R0.1 C[C@@H](N)CCO NO14355 [0,1,0,0,0,0|1,0,2]=4 132 B5R0.1 C[C@H](N)CCO DY625189 [0,1,0,0,0,0|1,0,2]=4 133 B5R0.1 C[C@H](N)CCO NO14356 [0,1,0,0,0,0|1,0,2]=4 134 B5R0.1 C[C@H](O)CC#N DY625225 [0,1,0,0,0,0|2,0,1]=4 135 B5R0.1 C\C(N)=C/C#N DY506903 [0,1,0,0,0,0|2,0,1]=4 136 B5R0.1 C\C=C\[C@H](C)O DY791877 [0,1,0,0,0,0|2,0,0]=3 137 B5R0.3 C=CC(Cl)CCl DY740791 [0,1,0,0,0,0|2,0,0]=3 138 B5R0.3 C=CC(N)CO DY579231 [0,1,0,0,0,0|2,0,0]=3 139 B5R0.3 C=C[C@H](O)CO DY625759 [0,1,0,0,0,0|2,0,0]=3 140 B5R0.3 CCC(Br)C#N DY789951 [0,1,0,0,0,0|2,0,1]=4 141 B5R0.3 CCC(N)CO DY20718 [0,1,0,0,0,0|1,0,2]=4 142 B5R0.3 CCC(N)CO DY741331 [0,1,0,0,0,0|1,0,2]=4 143 B5R0.3 CCC(O)CN DY519471 [0,1,0,0,0,0|2,0,1]=4 144 B5R0.3 CCC(O)CO DY822703 [0,1,0,0,0,0|1,0,2]=4 145 B5R0.3 CC[C@@H](N)CO NO15119 [0,1,0,0,0,0|1,0,2]=4 146 B5R0.3 CC[C@H](C)C#N DY822231 [0,1,0,0,0,0|1,0,1]=3 147 B5R0.3 CC[C@H](N)CO DY10528 [0,1,0,0,0,0|1,0,2]=4 148 B5R0.3 CC[C@H](O)CO NO15622 [0,1,0,0,0,0|1,0,2]=4 149 B5R0.3 CO[C@H](C)CN DY622119 [0,1,0,0,0,0|1,0,1]=3 150 B5R0.3 CO[C@H](C)CN NO17733 [0,1,0,0,0,0|1,0,1]=3 151 B5R0.3 CO[C@H](C)CO NO12306 [0,1,0,0,0,0|0,0,2]=3 152 B5R0.3 NC(CO)CO NO18352 [0,1,0,0,0,0|1,0,2]=4 153 B5R0.3 NCC(O)CN NO14232 [0,1,0,0,0,0|2,0,1]=4 154 B5R0.3 NCC(O)CO NO18397 [0,1,0,0,0,0|1,0,2]=4 155 B5R0.3 NC[C@@H](O)CO NO14832 [0,1,0,0,0,0|1,0,2]=4 156 B5R0.3 NC[C@H](O)CCl DY427329 [0,1,0,0,0,0|2,0,1]=4 157 B5R0.3 NC[C@H](O)CO DY20311 [0,1,0,0,0,0|1,0,2]=4 158 B5R0.3 O=CC(Br)C=O NO18151 [0,1,0,0,0,0|1,0,1]=3 159 B5R0.3 OC[C@@H](O)CCl NO15061 [0,1,0,0,0,0|1,0,2]=4 160 B5R0.3 OC[C@H](O)CCl DY20314 [0,1,0,0,0,0|1,0,2]=4 161 B5R0.4 C#CC(C)(C)Cl DY460572 [0,1,0,0,0,0|1,0,1]=3 162 B5R0.4 C=CC(C)(C)Br DY575625 [0,1,0,0,0,0|1,0,0]=2 163 B5R0.4 C=CC(C)(C)C DY822271 [0,1,0,0,0,0|1,0,0]=2 164 B5R0.4 C=C[Si](C)(C)C DY570321 [0,1,0,0,0,0|1,1,0]=3 165 B5R0.4 CC(C)(Br)CBr DY796695 [0,1,0,0,0,0|1,0,1]=3 166 B5R0.4 CC(C)(C)C#N DY10368 [0,1,0,0,0,0|1,0,1]=3 167 B5R0.4 CC(C)(C)CN NO11775 [0,1,0,0,0,0|1,0,1]=3 168 B5R0.4 CC(C)(C)N=O DY822750 [0,1,0,0,0,0|1,0,0]=2 169 B5R0.4 CC(C)(C)OO DY741391 [0,1,0,0,0,0|1,0,1]=3 170 B5R0.4 CC(C)(C)[Mg]Cl DY566799 [0,1,0,0,0,0|2,0,0]=3 171 B5R0.4 CC(C)(N)C#N DY536241 [0,1,0,0,0,0|1,0,1]=3 172 B5R0.4 CC(C)(N)C#N NO15395 [0,1,0,0,0,0|1,0,1]=3 173 B5R0.4 CC(C)(O)CN NO20593 [0,1,0,0,0,0|1,0,1]=3 174 B5R0.4 CCC(C)(C)[O-] DY822652 [0,1,0,0,0,0|1,0,1]=3 175 B5R0.4 CCC(C)(C)[O-] DY822653 [0,1,0,0,0,0|1,0,1]=3 176 B5R0.4 O=CC(Br)(Br)Br DY822347 [0,1,0,0,0,0|2,0,0]=3 177 B5R0.5 C=C(C)C(=O)O DY740707 [0,1,0,0,0,0|0,0,2]=3 178 B5R0.5 CC(=O)C(C)C DY740329 [0,1,0,0,0,0|0,0,0]=1 179 B5R0.5 CC(=O)C(C)Cl DY740749 [0,1,0,0,0,0|1,0,0]=2 180 B5R0.5 CC(C)B(O)O DY454222 [0,1,0,0,0,0|1,0,1]=3 181 B5R0.5 CC(C)C(N)=O NO21696 [0,1,0,0,0,0|0,0,0]=1 182 B5R0.5 CC(O)C(N)=O DY538347 [0,1,0,0,0,0|1,0,0]=2 183 B5R0.5 CN(C)C(=S)[S-] DY822456 [0,1,0,0,0,0|1,1,0]=3 184 B5R0.5 C[C@@H](Br)C(=O)O DY788601 [0,1,0,0,0,0|1,0,0]=2 185 B5R0.5 C[C@@H](N)C(N)=O NO15732 [0,1,0,0,0,0|1,0,0]=2 186 B5R0.5 C[C@@H](O)C(=O)[O-] DY580071 [0,1,0,0,0,0|1,0,0]=2 187 B5R0.5 C[C@H](Br)C(=O)O DY20444 [0,1,0,0,0,0|1,0,0]=2 188 B5R0.5 C[C@H](Cl)C(=O)O DY20315 [0,1,0,0,0,0|1,0,0]=2 189 B5R0.5 C[C@H](N)C(=O)O NO19143 [0,1,0,0,0,0|1,0,0]=2 190 B5R0.5 C[C@H](N)C(=O)S DY572427 [0,1,0,0,0,0|1,0,0]=2 191 B5R0.5 C[C@H](N)C(N)=O NO22529 [0,1,0,0,0,0|1,0,0]=2 192 B5R0.5 C[C@H](O)C(N)=O DY624997 [0,1,0,0,0,0|1,0,0]=2 193 B5R0.5 NC(=O)C(N)=O DY20822 [0,1,0,0,0,0|2,0,1]=4 194 B5R0.5 O=C(Cl)C(F)Cl DY794697 [0,1,0,0,0,0|2,0,0]=3 195 B5R0.5 O=C(O)C(=O)O DY563517 [0,1,0,0,0,0|2,0,1]=4 196 B5R0.5 O=C(O)C(=O)O DY822364 [0,1,0,0,0,0|2,0,1]=4 197 B5R0.5 O=C(O)C(=O)O NO11387 [0,1,0,0,0,0|2,0,1]=4 198 B5R0.5 O=C(O)C(Cl)Cl DY740833 [0,1,0,0,0,0|2,0,0]=3 199 B5R0.5 O=C([O-])C(=O)O DY822607 [0,1,0,0,0,0|2,0,1]=4 200 B5R0.5 O=C([O-])C(=O)[O-] DY114602 [0,1,0,0,0,0|2,0,1]=4 201 B5R0.5 O=C([O-])C(=O)[O-] DY506772 [0,1,0,0,0,0|2,0,1]=4 202 B5R0.5 O=C([O-])C(=O)[O-] DY822276 [0,1,0,0,0,0|2,0,1]=4 203 B5R0.5 O=C([O-])C(=O)[O-] DY822362 [0,1,0,0,0,0|2,0,1]=4 204 B5R0.5 O=C([O-])C(=O)[O-] DY822363 [0,1,0,0,0,0|2,0,1]=4 205 B5R0.5 O=C([O-])C(=O)[O-] DY822365 [0,1,0,0,0,0|2,0,1]=4 206 B5R0.5 O=C([O-])C(=O)[O-] DY822603 [0,1,0,0,0,0|2,0,1]=4 207 B5R0.5 O=C([O-])C(=O)[O-] DY822604 [0,1,0,0,0,0|2,0,1]=4 208 B5R0.5 O=C([O-])C(=O)[O-] DY822608 [0,1,0,0,0,0|2,0,1]=4 209 B5R0.5 O=C([O-])C(=O)[O-] DY822919 [0,1,0,0,0,0|2,0,1]=4 210 B5R0.5 O=C([O-])C(Cl)Cl DY21032 [0,1,0,0,0,0|2,0,0]=3 211 B5R0.5 [13CH3]C(N)C(=O)O DY454719 [0,1,0,0,0,0|1,0,0]=2 212 B5R1.2 BrC1COC1 DY425330 [0,0,0,1,0,0|1,0,2]=4 213 B5R1.2 CC1CNC1 NO13089 [0,0,0,1,0,0|1,0,1]=3 214 B5R1.2 C[C@H]1CCN1 DY625021 [0,0,0,1,0,0|2,0,0]=3 215 B5R1.2 ClC1CCC1 DY756391 [0,0,0,1,0,0|2,0,1]=4 216 B5R1.2 ClC1CNC1 DY586642 [0,0,0,1,0,0|2,0,1]=4 217 B5R1.2 FC1CNC1 NO22297 [0,0,0,1,0,0|2,0,1]=4 218 B5R1.2 IC1CNC1 DY444286 [0,0,0,1,0,0|2,0,1]=4 219 B5R1.2 IC1COC1 DY10503 [0,0,0,1,0,0|1,0,2]=4 220 B5R1.2 NC1COC1 NO22388 [0,0,0,1,0,0|1,0,2]=4 221 B5R1.2 OC1CCC1 NO11176 [0,0,0,1,0,0|2,0,1]=4 222 B5R1.2 OC1CNC1 NO14687 [0,0,0,1,0,0|2,0,1]=4 223 B5R1.2 OC1COC1 NO19329 [0,0,0,1,0,0|1,0,2]=4 224 B5R1.3 BrCC1CC1 DY10481 [0,0,0,1,0,0|1,0,1]=3 225 B5R1.3 BrCC1CO1 DY822350 [0,0,0,1,0,0|2,0,1]=4 226 B5R1.3 BrC[C@H]1CO1 DY822260 [0,0,0,1,0,0|2,0,1]=4 227 B5R1.3 CC[C@H]1CO1 DY20699 [0,0,0,1,0,0|2,0,1]=4 228 B5R1.3 CNC1CC1 NO13160 [0,0,0,1,0,0|2,0,0]=3 229 B5R1.3 ClCC1CC1 NO19956 [0,0,0,1,0,0|1,0,1]=3 230 B5R1.3 ClC[C@@H]1CO1 DY20322 [0,0,0,1,0,0|2,0,1]=4 231 B5R1.3 ClC[C@H]1CO1 DY557877 [0,0,0,1,0,0|2,0,1]=4 232 B5R1.3 NCC1CC1 NO18907 [0,0,0,1,0,0|1,0,1]=3 233 B5R1.3 NNC1CC1 NO15677 [0,0,0,1,0,0|2,0,0]=3 234 B5R1.3 NNC1CC1 NO18095 [0,0,0,1,0,0|2,0,0]=3 235 B5R1.3 OCC1CC1 NO19620 [0,0,0,1,0,0|0,0,2]=3 236 B5R1.4 N[C@@H]1C[C@@H]1F DY620136 [0,0,0,1,0,0|2,0,1]=4 237 B5R1.4 N[C@@H]1C[C@H]1N DY586552 [0,0,0,1,0,0|2,0,1]=4 238 B5R1.4 N[C@H]1C[C@@H]1F DY758461 [0,0,0,1,0,0|2,0,1]=4 239 B5R1.4 N[C@H]1C[C@@H]1N DY586558 [0,0,0,1,0,0|2,0,1]=4 240 B5R1.4 N[C@H]1C[C@H]1N DY586550 [0,0,0,1,0,0|2,0,1]=4 241 B5R1.5 CC1(N)CC1 NO15074 [0,0,0,1,0,0|2,0,1]=4 242 B2R0.1 CC#N NO13723 [2,0,0,0,0,0|1,0,1]=4 243 B2R0.1 CC[O-] DY741049 [2,0,0,0,0,0|0,0,1]=3 244 B2R0.1 CNC NO11262 [2,0,0,0,0,0|1,0,0]=3 245 B2R0.1 CNN DY740389 [2,0,0,0,0,0|2,0,0]=4 246 B2R0.1 CNO NO21748 [2,0,0,0,0,0|1,0,1]=4 247 B2R0.1 CON NO19173 [2,0,0,0,0,0|2,0,0]=4 248 B2R0.1 C[Mg]Br DY10193 [2,0,0,0,0,0|2,0,0]=4 249 B2R0.1 C[Zn]Br DY116062 [2,0,0,0,0,0|2,0,0]=4 250 B2R0.1 O=CO DY559317 [2,0,0,0,0,0|1,0,0]=3 251 B2R0.1 O=C[O-] DY822958 [2,0,0,0,0,0|1,0,0]=3 252 B2R0.1 O=C[O-] DY822974 [2,0,0,0,0,0|1,0,0]=3 253 B2R0.1 O=N[O-] DY523299 [2,0,0,0,0,0|2,0,0]=4 254 B2R0.1 O=[Mn]=O DY822891 [2,0,0,0,0,0|2,0,0]=4 255 B2R0.1 O=[Mo]=O DY822434 [2,0,0,0,0,0|2,0,0]=4 256 B2R0.1 O=[PH2][O-] DY20648 [2,0,0,0,0,0|2,0,0]=4 257 B2R0.1 O=[Pt]=O NO10895 [2,0,0,0,0,0|2,0,0]=4 258 B4R0.2 BrCCCBr DY459264 [1,1,0,0,0,0|1,0,1]=4 259 B4R0.2 C#CCCI DY554547 [1,1,0,0,0,0|1,0,1]=4 260 B4R0.2 C#CCCO DY580491 [1,1,0,0,0,0|1,0,1]=4 261 B4R0.2 C#C\C=C\C DY822380 [1,1,0,0,0,0|1,0,1]=4 262 B4R0.2 C=CCCN DY740341 [1,1,0,0,0,0|1,0,0]=3 263 B4R0.2 CCCCBr DY460620 [1,1,0,0,0,0|1,0,1]=4 264 B4R0.2 CCNCC NO11240 [1,1,0,0,0,0|1,0,1]=4 265 B4R0.2 CNCC#N NO19888 [1,1,0,0,0,0|1,0,1]=4 266 B4R0.2 CNCCBr DY584482 [1,1,0,0,0,0|1,0,1]=4 267 B4R0.2 CNCCO NO20910 [1,1,0,0,0,0|0,0,2]=4 268 B4R0.2 COCC=O DY740317 [1,1,0,0,0,0|0,0,0]=2 269 B4R0.2 COCCBr DY578823 [1,1,0,0,0,0|1,0,1]=4 270 B4R0.2 COCCN DY822486 [1,1,0,0,0,0|1,0,1]=4 271 B4R0.2 COCCO DY457570 [1,1,0,0,0,0|0,0,2]=4 272 B4R0.2 CSCSC DY528795 [1,1,0,0,0,0|2,0,0]=4 273 B4R0.2 FCCCF DY822298 [1,1,0,0,0,0|1,0,1]=4 274 B4R0.2 ICCCI DY564171 [1,1,0,0,0,0|1,0,1]=4 275 B4R0.2 N#CCCBr NO22188 [1,1,0,0,0,0|1,0,1]=4 276 B4R0.2 N#CCCN DY526113 [1,1,0,0,0,0|1,0,1]=4 277 B4R0.2 NCCCBr NO22190 [1,1,0,0,0,0|1,0,1]=4 278 B4R0.2 OCCCF DY822290 [1,1,0,0,0,0|0,0,2]=4 279 B4R0.2 SCCCS DY740347 [1,1,0,0,0,0|0,1,1]=4 280 B4R0.2 [Li]CCCC DY790335 [1,1,0,0,0,0|1,0,1]=4 281 B4R0.3 CC(C)(C)N DY822615 [1,1,0,0,0,0|0,0,1]=3 282 B4R0.3 CC(C)(C)[O-] DY21066 [1,1,0,0,0,0|0,0,1]=3 283 B4R0.3 CS(=O)([O-])=S DY536553 [1,1,0,0,0,0|2,0,0]=4 284 B4R0.3 CS(N)(=O)=O NO19901 [1,1,0,0,0,0|2,0,0]=4 285 B4R0.3 C[As](C)(=O)[O-] DY822397 [1,1,0,0,0,0|1,0,0]=3 286 B4R0.3 C[N+](C)(C)C DY551763 [1,1,0,0,0,0|1,0,1]=4 287 B4R0.3 C[N+](C)(C)C DY822810 [1,1,0,0,0,0|1,0,1]=4 288 B4R0.3 C[N+](C)(C)C DY822819 [1,1,0,0,0,0|1,0,1]=4 289 B4R0.3 C[N+](C)(C)C NO12014 [1,1,0,0,0,0|1,0,1]=4 290 B4R0.3 C[N+](C)(C)C NO12015 [1,1,0,0,0,0|1,0,1]=4 291 B4R0.3 C[S+](C)(C)=O DY822545 [1,1,0,0,0,0|1,0,0]=3 292 B4R0.3 C[S+](C)(C)=O NO12054 [1,1,0,0,0,0|1,0,0]=3 293 B6R0.1 C=CC(O)CC#N DY562983 [0,2,0,0,0,0|2,0,0]=4 294 B6R0.1 C=CC(O)CCN DY787899 [0,2,0,0,0,0|2,0,0]=4 295 B6R0.1 CC(CN)CCN DY791871 [0,2,0,0,0,0|1,0,1]=4 296 B6R0.1 CCCC(C)CBr DY112368 [0,2,0,0,0,0|1,0,1]=4 297 B6R0.1 COC(=O)CC=O DY740485 [0,2,0,0,0,0|1,0,1]=4 298 B6R0.2 CC(=O)NC(C)C DY461094 [0,2,0,0,0,0|0,0,0]=2 299 B6R0.2 CC(C)=CC(=O)O NO14947 [0,2,0,0,0,0|0,0,1]=3 300 B6R0.2 CC(C)=CC(N)=O DY795567 [0,2,0,0,0,0|0,0,1]=3 301 B6R0.2 CC(C)CB(O)O NO22276 [0,2,0,0,0,0|0,0,2]=4 302 B6R0.2 CC(C)CC(C)N DY822361 [0,2,0,0,0,0|1,0,1]=4 303 B6R0.2 CC(O)CC(=O)[O-] DY460020 [0,2,0,0,0,0|1,0,0]=3 304 B6R0.2 CN(C)CC(=O)O NO13413 [0,2,0,0,0,0|1,0,0]=3 305 B6R0.2 C[C@@H](N)CC(=O)O NO19028 [0,2,0,0,0,0|1,0,0]=3 306 B6R0.2 C[C@@H](O)CC(=O)[O-] NO20253 [0,2,0,0,0,0|1,0,0]=3 307 B6R0.2 C[C@H](N)CC(=O)O NO20346 [0,2,0,0,0,0|1,0,0]=3 308 B6R0.2 C[C@H](O)CC(=O)O DY426021 [0,2,0,0,0,0|1,0,0]=3 309 B6R0.2 C[C@H](O)CC(=O)[O-] DY791133 [0,2,0,0,0,0|1,0,0]=3 310 B6R0.3 C=CC(=O)N(C)C DY545499 [0,2,0,0,0,0|1,0,0]=3 311 B6R0.3 C=CC(C)C(=O)O DY559155 [0,2,0,0,0,0|0,0,1]=3 312 B6R0.3 C=CC(O)C(=O)O DY586439 [0,2,0,0,0,0|1,0,1]=4 313 B6R0.3 C=C[C@H](N)C(=O)O DY21080 [0,2,0,0,0,0|1,0,1]=4 314 B6R0.3 CC(=O)C(C)C=O DY459582 [0,2,0,0,0,0|0,0,0]=2 315 B6R0.3 CC(C)C(=O)CCl DY740659 [0,2,0,0,0,0|0,0,0]=2 316 B6R0.3 CC(C)[C@@H](N)CO NO22659 [0,2,0,0,0,0|0,0,2]=4 317 B6R0.3 CC(C)[C@H](N)CO NO17224 [0,2,0,0,0,0|0,0,2]=4 318 B6R0.3 CC(C)\C(N)=N\O DY574395 [0,2,0,0,0,0|0,0,1]=3 319 B6R0.3 CC(O)C(=O)O[Ag] DY527883 [0,2,0,0,0,0|1,0,0]=3 320 B6R0.3 CCC(=O)C(=O)O NO21626 [0,2,0,0,0,0|1,0,1]=4 321 B6R0.3 CCC(N)C(=O)O NO14084 [0,2,0,0,0,0|1,0,0]=3 322 B6R0.3 CCC(O)C(=O)O DY562593 [0,2,0,0,0,0|1,0,0]=3 323 B6R0.3 CCC(O)C(=O)[O-] DY557445 [0,2,0,0,0,0|1,0,0]=3 324 B6R0.3 CC[C@@H](N)C(=O)O NO14054 [0,2,0,0,0,0|1,0,0]=3 325 B6R0.3 CC[C@@H](N)C(N)=O DY503559 [0,2,0,0,0,0|1,0,0]=3 326 B6R0.3 CC[C@H](Br)C(=O)O DY624931 [0,2,0,0,0,0|1,0,0]=3 327 B6R0.3 CC[C@H](N)C(=O)O NO13661 [0,2,0,0,0,0|1,0,0]=3 328 B6R0.3 CC[C@H](N)C(N)=O DY436006 [0,2,0,0,0,0|1,0,0]=3 329 B6R0.3 CC[C@H](N)C(N)=O NO15891 [0,2,0,0,0,0|1,0,0]=3 330 B6R0.3 CN(C)C(=O)CBr NO14025 [0,2,0,0,0,0|1,0,0]=3 331 B6R0.3 CN(C)C(=O)CCl DY545469 [0,2,0,0,0,0|1,0,0]=3 332 B6R0.3 CN(C)C(=O)CN NO21306 [0,2,0,0,0,0|1,0,0]=3 333 B6R0.3 CNC(=O)[C@@H](C)N DY608176 [0,2,0,0,0,0|1,0,0]=3 334 B6R0.3 CNC(=O)[C@H](C)N DY436151 [0,2,0,0,0,0|1,0,0]=3 335 B6R0.3 CN[C@@H](C)C(=O)O DY628947 [0,2,0,0,0,0|0,0,0]=2 336 B6R0.3 CN[C@@H](C)C(N)=O DY608441 [0,2,0,0,0,0|0,0,0]=2 337 B6R0.3 COC(=O)C(C)Br NO14958 [0,2,0,0,0,0|1,0,0]=3 338 B6R0.3 COC(=O)C(C)C DY41931 [0,2,0,0,0,0|0,0,0]=2 339 B6R0.3 COC(=O)C(C)N NO22242 [0,2,0,0,0,0|1,0,0]=3 340 B6R0.3 COC(=O)[C@@H](C)N NO16663 [0,2,0,0,0,0|1,0,0]=3 341 B6R0.3 COC(=O)[C@H](C)Cl NO15798 [0,2,0,0,0,0|1,0,0]=3 342 B6R0.3 COC(=O)[C@H](C)N DY500966 [0,2,0,0,0,0|1,0,0]=3 343 B6R0.3 COC(C)C(=O)O NO14024 [0,2,0,0,0,0|0,0,0]=2 344 B6R0.3 CON(C)C(C)=O NO11789 [0,2,0,0,0,0|1,0,0]=3 345 B6R0.3 C[C@@H](CO)C(=O)O DY538785 [0,2,0,0,0,0|0,0,0]=2 346 B6R0.3 NC(=O)C(N)CO DY544785 [0,2,0,0,0,0|1,0,0]=3 347 B6R0.3 NC(=O)[C@@H](N)CO DY438160 [0,2,0,0,0,0|1,0,0]=3 348 B6R0.3 NC(=O)[C@H](N)CO DY504027 [0,2,0,0,0,0|1,0,0]=3 349 B6R0.3 NC(CO)C(=O)O NO18949 [0,2,0,0,0,0|1,0,0]=3 350 B6R0.3 NC(CS)C(=O)O NO19655 [0,2,0,0,0,0|1,0,0]=3 351 B6R0.3 NCC(N)C(=O)O DY702709 [0,2,0,0,0,0|1,0,0]=3 352 B6R0.3 NCC(N)C(=O)O DY703093 [0,2,0,0,0,0|1,0,0]=3 353 B6R0.3 NCC(N)C(=O)O NO19624 [0,2,0,0,0,0|1,0,0]=3 354 B6R0.3 NC[C@@H](N)C(=O)O NO19672 [0,2,0,0,0,0|1,0,0]=3 355 B6R0.3 NC[C@@H](O)C(=O)O NO20294 [0,2,0,0,0,0|1,0,0]=3 356 B6R0.3 NC[C@H](N)C(=O)O NO14756 [0,2,0,0,0,0|1,0,0]=3 357 B6R0.3 N[C@@H](CCl)C(=O)O DY436850 [0,2,0,0,0,0|1,0,0]=3 358 B6R0.3 N[C@@H](CO)C(=O)O NO19144 [0,2,0,0,0,0|1,0,0]=3 359 B6R0.3 N[C@@H](CS)C(=O)O DY436887 [0,2,0,0,0,0|1,0,0]=3 360 B6R0.3 N[C@@H](CS)C(=O)O DY529455 [0,2,0,0,0,0|1,0,0]=3 361 B6R0.3 N[C@@H](CS)C(=O)O NO19113 [0,2,0,0,0,0|1,0,0]=3 362 B6R0.3 N[C@@H](CS)S(=O)O DY538851 [0,2,0,0,0,0|2,0,0]=4 363 B6R0.3 N[C@H](CO)C(=O)O NO14731 [0,2,0,0,0,0|1,0,0]=3 364 B6R0.3 N[C@H](CS)C(=O)O DY439001 [0,2,0,0,0,0|1,0,0]=3 365 B6R0.3 N[C@H](CS)C(=O)O NO19417 [0,2,0,0,0,0|1,0,0]=3 366 B6R0.3 O=C(O)C(Br)CBr NO15215 [0,2,0,0,0,0|1,0,0]=3 367 B6R0.3 O=C(O)C(Br)CF DY741307 [0,2,0,0,0,0|1,0,0]=3 368 B6R0.3 O=C(O)C(O)CCl DY10790 [0,2,0,0,0,0|1,0,0]=3 369 B6R0.3 O=C(O)[C@H](O)CS DY740539 [0,2,0,0,0,0|1,0,0]=3 370 B6R0.4 C=COCC(C)C DY822723 [0,2,0,0,0,0|1,0,0]=3 371 B6R0.4 CC(C)=CC[Zn]Cl DY116080 [0,2,0,0,0,0|1,0,1]=4 372 B6R0.4 CC(C)CCCBr DY740443 [0,2,0,0,0,0|1,0,1]=4 373 B6R0.4 CC(C)NCCN DY20461 [0,2,0,0,0,0|1,0,1]=4 374 B6R0.4 CCNCC(C)C DY564723 [0,2,0,0,0,0|1,0,1]=4 375 B6R0.4 CNCCC(C)C DY543681 [0,2,0,0,0,0|1,0,1]=4 376 B6R0.4 CNCCC(C)C DY553713 [0,2,0,0,0,0|1,0,1]=4 377 B6R0.5 CC(C)(C)CC=O DY20142 [0,2,0,0,0,0|0,0,0]=2 378 B6R0.5 CC(C)(C)CCO NO21905 [0,2,0,0,0,0|0,0,2]=4 379 B6R0.5 CC(C)(O)CCBr NO15788 [0,2,0,0,0,0|1,0,1]=4 380 B6R0.8 C=CC(C)(N)CO DY500685 [0,2,0,0,0,0|1,0,0]=3 381 B6R0.8 CC(C)(C#N)C#N DY569361 [0,2,0,0,0,0|1,0,1]=4 382 B6R0.8 CC(C)(C#N)CO NO13572 [0,2,0,0,0,0|0,0,2]=4 383 B6R0.8 CC(C)(C=O)CO DY21089 [0,2,0,0,0,0|0,0,0]=2 384 B6R0.8 CC(C)(CBr)CBr NO20516 [0,2,0,0,0,0|1,0,1]=4 385 B6R0.8 CC(C)(CN)CO NO22037 [0,2,0,0,0,0|0,0,2]=4 386 B6R0.8 CC(C)(CO)CO DY514971 [0,2,0,0,0,0|0,0,2]=4 387 B6R0.8 CC(N)(C#N)CO DY512793 [0,2,0,0,0,0|1,0,1]=4 388 B6R0.8 CCC(C)(N)C#N NO17000 [0,2,0,0,0,0|1,0,1]=4 389 B6R0.8 COC(C)(C)ON DY503427 [0,2,0,0,0,0|2,0,0]=4 390 B6R0.9 C=CC(CC)CO DY822489 [0,2,0,0,0,0|1,0,0]=3 391 B6R0.9 CCC(CN)OC DY610294 [0,2,0,0,0,0|1,0,1]=4 392 B6R0.9 COC(C=O)OC DY822359 [0,2,0,0,0,0|0,0,0]=2 393 B6R0.7 CC(=O)C(C)(C)Cl DY741007 [0,2,0,0,0,0|0,0,0]=2 394 B6R0.7 CC(C)(Br)C(=O)O NO21332 [0,2,0,0,0,0|0,0,0]=2 395 B6R0.7 CC(C)(C)C(=O)O NO11866 [0,2,0,0,0,0|0,0,0]=2 396 B6R0.7 CC(C)(C)C(=O)[O-] DY504753 [0,2,0,0,0,0|0,0,0]=2 397 B6R0.7 CC(C)(C)P(Cl)Cl DY544929 [0,2,0,0,0,0|2,0,0]=4 398 B6R0.7 CC(C)(C)[S@@](N)=O NO22549 [0,2,0,0,0,0|1,0,0]=3 399 B6R0.7 CC(C)(C)[S@](N)=O NO13893 [0,2,0,0,0,0|1,0,0]=3 400 B6R0.7 CC(C)(N)C(=O)O NO15358 [0,2,0,0,0,0|0,0,0]=2 401 B6R0.7 CC(C)(N)C(N)=O DY609020 [0,2,0,0,0,0|0,0,0]=2 402 B6R0.7 CC(C)(O)C(N)=S DY740299 [0,2,0,0,0,0|0,1,0]=3 403 B6R0.7 CC(C)S(=O)(=O)[O-] DY547479 [0,2,0,0,0,0|1,0,0]=3 404 B6R0.7 CC(C)S(C)(=O)=O DY740869 [0,2,0,0,0,0|1,0,0]=3 405 B6R0.7 CC(C)S(N)(=O)=O NO15962 [0,2,0,0,0,0|1,0,0]=3 406 B6R0.7 CC(C)[Si](C)(Cl)Cl DY792465 [0,2,0,0,0,0|1,1,0]=4 407 B6R0.7 CC(N)C(C)(C)C DY552417 [0,2,0,0,0,0|1,0,1]=4 408 B6R0.7 CN(C)S(N)(=O)=O NO11736 [0,2,0,0,0,0|2,0,0]=4 409 B6R0.7 NC(=O)C(F)(F)F NO20935 [0,2,0,0,0,0|2,0,0]=4 410 B6R0.7 O=C(Cl)C(Cl)(Cl)Cl DY40501 [0,2,0,0,0,0|2,0,0]=4 411 B6R0.7 O=C(O)C(Br)(Br)Br DY822346 [0,2,0,0,0,0|2,0,0]=4 412 B6R0.7 O=C(O)C(Cl)(Cl)Cl DY565503 [0,2,0,0,0,0|2,0,0]=4 413 B6R0.7 O=C(O)C(F)(F)F DY684994 [0,2,0,0,0,0|2,0,0]=4 414 B6R0.7 O=C([O-])C(F)(F)F DY541353 [0,2,0,0,0,0|2,0,0]=4 415 B6R0.7 O=C([O-])C(F)(F)F DY551343 [0,2,0,0,0,0|2,0,0]=4 416 B6R0.7 [2H]C(C)(N)C(=O)O DY454695 [0,2,0,0,0,0|1,0,0]=3 417 B4R1.1 C1CNC1 NO14211 [1,0,0,1,0,0|1,0,1]=4 418 B4R1.2 BrC1CC1 NO19063 [1,0,0,1,0,0|1,0,1]=4 419 B6R1.2 CC1CCCN1 NO21699 [0,1,0,1,0,0|1,0,1]=4 420 B6R1.2 CC1CCCN1 NO21700 [0,1,0,1,0,0|1,0,1]=4 421 B6R1.2 CC1CCCO1 DY20580 [0,1,0,1,0,0|1,0,1]=4 422 B6R1.2 CC1CCNC1 DY667237 [0,1,0,1,0,0|1,0,1]=4 423 B6R1.2 C[C@@H]1CCCN1 NO18299 [0,1,0,1,0,0|1,0,1]=4 424 B6R1.2 C[C@H]1CCCN1 NO18800 [0,1,0,1,0,0|1,0,1]=4 425 B6R1.2 C[C@H]1CCCN1 NO19735 [0,1,0,1,0,0|1,0,1]=4 426 B6R1.2 NC1CC=CC1 NO19415 [0,1,0,1,0,0|2,0,0]=4 427 B6R1.2 OC1CC=CC1 DY10342 [0,1,0,1,0,0|2,0,0]=4 428 B6R1.3 ICCC1CC1 DY549405 [0,1,0,1,0,0|1,0,1]=4 429 B6R1.3 N#CCC1CC1 DY433947 [0,1,0,1,0,0|1,0,1]=4 430 B6R1.3 NNCC1CC1 DY509474 [0,1,0,1,0,0|1,0,1]=4 431 B6R1.3 NNCC1CC1 DY586553 [0,1,0,1,0,0|1,0,1]=4 432 B6R1.5 C=C1CC(=O)O1 DY732691 [0,1,0,1,0,0|0,0,2]=4 433 B6R1.5 CC1CC(N)C1 DY105778 [0,1,0,1,0,0|1,0,1]=4 434 B6R1.5 CC1CC(O)C1 DY539301 [0,1,0,1,0,0|0,0,2]=4 435 B6R1.5 CN1CC(=O)C1 DY533589 [0,1,0,1,0,0|1,0,0]=3 436 B6R1.5 NC1CC(=O)C1 DY444232 [0,1,0,1,0,0|1,0,0]=3 437 B6R1.5 NC1CC(=O)C1 DY756175 [0,1,0,1,0,0|1,0,0]=3 438 B6R1.8 COC1CC1N DY503985 [0,1,0,1,0,0|1,0,1]=4 439 B6R1.8 N[C@@H]1C[C@H]1CO DY757435 [0,1,0,1,0,0|0,0,2]=4 440 B6R1.8 OCC1C[C@@H]1F DY102848 [0,1,0,1,0,0|0,0,2]=4 441 B6R1.10 CC1(N)COC1 DY444292 [0,1,0,1,0,0|0,0,2]=4 442 B6R1.10 CC1(N)COC1 NO14859 [0,1,0,1,0,0|0,0,2]=4 443 B6R1.10 CC1(N)CSC1 DY113158 [0,1,0,1,0,0|0,1,1]=4 444 B6R1.10 CC1(O)CNC1 NO15502 [0,1,0,1,0,0|1,0,1]=4 445 B6R1.11 CC(C)C1CO1 DY791517 [0,1,0,1,0,0|0,0,2]=4 446 B6R1.11 CC(N)C1CC1 DY528885 [0,1,0,1,0,0|1,0,1]=4 447 B6R1.11 CC(O)C1CC1 DY757429 [0,1,0,1,0,0|0,0,2]=4 448 B6R1.11 C[C@H](N)C1CC1 DY623903 [0,1,0,1,0,0|1,0,1]=4 449 B6R1.11 N=C(N)C1CC1 DY559371 [0,1,0,1,0,0|1,0,0]=3 450 B6R1.11 N=C(N)C1CC1 NO16535 [0,1,0,1,0,0|1,0,0]=3 451 B6R1.11 NC(=O)C1CC1 NO16456 [0,1,0,1,0,0|0,0,0]=2 452 B6R1.11 NC(=S)C1CC1 DY21067 [0,1,0,1,0,0|0,1,0]=3 453 B6R1.11 O=C(O)C1CC1 NO13839 [0,1,0,1,0,0|0,0,0]=2 454 B6R1.11 O=C([O-])C1CO1 NO17514 [0,1,0,1,0,0|1,0,0]=3 455 B6R1.11 O=C([O-])[C@@H]1CO1 DY627493 [0,1,0,1,0,0|1,0,0]=3 456 B6R1.11 O=S(O)C1CC1 DY586549 [0,1,0,1,0,0|1,0,0]=3 457 B6R1.11 OB(O)C1CC1 DY20194 [0,1,0,1,0,0|1,0,1]=4 458 B6R1.4 CC1OCC1N DY732961 [0,1,0,1,0,0|1,0,1]=4 459 B6R1.4 C[C@@H]1NC[C@H]1O DY519399 [0,1,0,1,0,0|0,0,2]=4 460 B6R1.4 C[C@@H]1OC[C@H]1O DY515625 [0,1,0,1,0,0|0,0,2]=4 461 B6R1.4 NN1CCC1=O DY585858 [0,1,0,1,0,0|2,0,0]=4 462 B6R1.6 BrCC1CCC1 DY10470 [0,1,0,1,0,0|1,0,1]=4 463 B6R1.6 C=CC1CNC1 DY586611 [0,1,0,1,0,0|1,0,0]=3 464 B6R1.6 COC1CNC1 NO17370 [0,1,0,1,0,0|1,0,1]=4 465 B6R1.6 N#CC1CNC1 NO10942 [0,1,0,1,0,0|1,0,1]=4 466 B6R1.6 NCC1CCC1 DY554907 [0,1,0,1,0,0|1,0,1]=4 467 B6R1.6 NCC1CCC1 NO11178 [0,1,0,1,0,0|1,0,1]=4 468 B6R1.6 NCC1CCS1 DY585795 [0,1,0,1,0,0|1,0,1]=4 469 B6R1.6 NCC1CNC1 DY508838 [0,1,0,1,0,0|1,0,1]=4 470 B6R1.6 NCC1COC1 DY10517 [0,1,0,1,0,0|0,0,2]=4 471 B6R1.6 NNC1CCC1 DY527943 [0,1,0,1,0,0|2,0,0]=4 472 B6R1.6 OCC1CCO1 NO15009 [0,1,0,1,0,0|0,0,2]=4 473 B6R1.6 OCC1CNC1 NO12891 [0,1,0,1,0,0|0,0,2]=4 474 B6R1.6 OCC1COC1 NO14670 [0,1,0,1,0,0|0,0,2]=4 475 B6R1.6 OC[C@@H]1CCN1 NO15230 [0,1,0,1,0,0|0,0,2]=4 476 B6R1.7 C#CC1(N)CC1 DY21061 [0,1,0,1,0,0|1,0,1]=4 477 B6R1.7 CCC1(N)CC1 DY586551 [0,1,0,1,0,0|1,0,1]=4 478 B6R1.7 C[C@@]1(CO)CO1 DY575949 [0,1,0,1,0,0|0,0,2]=4 479 B6R1.7 N#CC1(N)CC1 NO13582 [0,1,0,1,0,0|1,0,1]=4 480 B6R1.7 NC1(CO)CC1 NO13349 [0,1,0,1,0,0|0,0,2]=4 481 B6R1.7 NCC1(O)CC1 NO20441 [0,1,0,1,0,0|1,0,1]=4