0 B4R1.2 BrC1CC1 CS19063 [0,0,0,0,0,0|2,0,0]=2 1 B4R1.2 CC1=CC1 MC20873 [0,0,0,0,0,0|1,0,1]=2 2 B4R1.2 CC1CO1 MC428272 [0,0,0,0,0,0|0,0,0]=0 3 B4R1.2 OC1CC1 MC443565 [0,0,0,0,0,0|2,0,0]=2 4 B5R1.3 BrCC1CC1 MC10481 [0,1,0,0,0,0|1,0,0]=2 5 B5R1.3 Br[Zn]C1CC1 MC121325 [0,1,0,0,0,0|2,0,0]=3 6 B5R1.3 C=CC1CO1 MC428261 [0,1,0,0,0,0|0,0,1]=2 7 B5R1.3 CCC1CO1 MC20699 [0,1,0,0,0,0|0,0,0]=1 8 B5R1.3 CCC1CO1 MC428314 [0,1,0,0,0,0|0,0,0]=1 9 B5R1.3 CNC1CC1 CS13160 [0,1,0,0,0,0|1,0,0]=2 10 B5R1.3 ClCC1CC1 CS19956 [0,1,0,0,0,0|1,0,0]=2 11 B5R1.3 ClCC1CO1 MC20322 [0,1,0,0,0,0|0,0,0]=1 12 B5R1.3 ClCC1CO1 MC41680 [0,1,0,0,0,0|0,0,0]=1 13 B5R1.3 ICC1CO1 MC102795 [0,1,0,0,0,0|0,0,0]=1 14 B5R1.3 N#CC1CC1 MC41837 [0,1,0,0,0,0|1,0,1]=3 15 B5R1.3 NCC1CC1 CS18907 [0,1,0,0,0,0|1,0,0]=2 16 B5R1.3 NNC1CC1 CS15677 [0,1,0,0,0,0|2,0,0]=3 17 B5R1.3 NNC1CC1 CS18095 [0,1,0,0,0,0|2,0,0]=3 18 B5R1.3 O=CC1CC1 MC428327 [0,1,0,0,0,0|1,0,1]=3 19 B5R1.3 OCC1CC1 CS19620 [0,1,0,0,0,0|1,0,0]=2 20 B5R1.4 FC1CC1Br MC102831 [0,1,0,0,0,0|2,0,0]=3 21 B5R1.4 NC1CC1F MC102833 [0,1,0,0,0,0|2,0,0]=3 22 B5R1.4 NC1CC1F MC425321 [0,1,0,0,0,0|2,0,0]=3 23 B5R1.5 CC1(C)CO1 MC41673 [0,1,0,0,0,0|0,0,0]=1 24 B5R1.5 CC1(N)CC1 CS15074 [0,1,0,0,0,0|1,0,0]=2 25 B3R0.1 BrCCBr MC41884 [0,0,1,0,0,0|2,0,0]=3 26 B3R0.1 C=CCBr MC41858 [0,0,1,0,0,0|1,0,2]=4 27 B3R0.1 CCC#N MC41959 [0,0,1,0,0,0|1,0,1]=3 28 B3R0.1 CCON CS11314 [0,0,1,0,0,0|1,0,0]=2 29 B3R0.1 CC[Zn]Br MC116063 [0,0,1,0,0,0|2,0,0]=3 30 B3R0.1 CNOC CS13986 [0,0,1,0,0,0|1,0,0]=2 31 B3R0.1 COCCl MC41874 [0,0,1,0,0,0|1,0,0]=2 32 B3R0.1 C\C=C\C MC428373 [0,0,1,0,0,0|1,0,1]=3 33 B3R0.1 FCCBr MC429448 [0,0,1,0,0,0|2,0,0]=3 34 B3R0.1 N#CCCl MC41870 [0,0,1,0,0,0|2,0,1]=4 35 B3R0.1 N#CCN CS19759 [0,0,1,0,0,0|2,0,1]=4 36 B3R0.1 NCCBr CS14044 [0,0,1,0,0,0|2,0,0]=3 37 B3R0.1 NCCCl CS16188 [0,0,1,0,0,0|2,0,0]=3 38 B3R0.1 NCCF CS21564 [0,0,1,0,0,0|2,0,0]=3 39 B3R0.1 SCCS MC20652 [0,0,1,0,0,0|1,1,0]=3 40 B3R0.2 C=C(C)Br MC440274 [0,0,1,0,0,0|1,0,2]=4 41 B3R0.2 CC(=O)Cl MC40433 [0,0,1,0,0,0|1,0,2]=4 42 B3R0.2 CC(=O)O CS19761 [0,0,1,0,0,0|1,0,1]=3 43 B3R0.2 CC(=O)[O-] CS11168 [0,0,1,0,0,0|1,0,2]=4 44 B3R0.2 CC(=O)[O-] CS11832 [0,0,1,0,0,0|1,0,2]=4 45 B3R0.2 CC(=O)[O-] MC41921 [0,0,1,0,0,0|1,0,2]=4 46 B3R0.2 CC(C)Br MC41864 [0,0,1,0,0,0|1,0,0]=2 47 B3R0.2 CC(N)=O MC40849 [0,0,1,0,0,0|1,0,2]=4 48 B3R0.2 CC(O)=S MC434055 [0,0,1,0,0,0|1,0,1]=3 49 B3R0.2 CS(=O)[O-] MC434050 [0,0,1,0,0,0|2,0,1]=4 50 B3R0.2 C[N+](=O)[O-] MC41935 [0,0,1,0,0,0|2,0,1]=4 51 B3R0.2 C[PH](C)=O MC21075 [0,0,1,0,0,0|1,0,1]=3 52 B3R0.2 O=S([O-])O MC445110 [0,0,1,0,0,0|3,0,0]=4 53 B3R0.2 O=S([O-])O MC445111 [0,0,1,0,0,0|3,0,0]=4 54 B3R0.2 O=[PH](O)O MC34534 [0,0,1,0,0,0|3,0,0]=4 55 B5R1.2 BrC1CNC1 MC444255 [0,0,0,0,0,1|2,0,0]=3 56 B5R1.2 BrC1COC1 MC425330 [0,0,0,0,0,1|1,0,0]=2 57 B5R1.2 CC1CNC1 CS13089 [0,0,0,0,0,1|1,0,0]=2 58 B5R1.2 ClC1CNC1 MC444320 [0,0,0,0,0,1|2,0,0]=3 59 B5R1.2 FC1CNC1 CS22297 [0,0,0,0,0,1|2,0,0]=3 60 B5R1.2 FC1COC1 MC113065 [0,0,0,0,0,1|1,0,0]=2 61 B5R1.2 IC1CNC1 MC444286 [0,0,0,0,0,1|2,0,0]=3 62 B5R1.2 IC1COC1 MC10503 [0,0,0,0,0,1|1,0,0]=2 63 B5R1.2 NC1COC1 CS22388 [0,0,0,0,0,1|1,0,0]=2 64 B5R1.2 NC1COC1 MC425332 [0,0,0,0,0,1|1,0,0]=2 65 B5R1.2 NC1CSC1 MC102176 [0,0,0,0,0,1|1,1,0]=3 66 B5R1.2 NC1CSC1 MC115657 [0,0,0,0,0,1|1,1,0]=3 67 B5R1.2 O=C1CCC1 MC10479 [0,0,0,0,0,1|2,0,1]=4 68 B5R1.2 O=C1CCN1 MC31231 [0,0,0,0,0,1|2,0,1]=4 69 B5R1.2 O=C1CNC1 MC444241 [0,0,0,0,0,1|2,0,1]=4 70 B5R1.2 O=C1COC1 CS22391 [0,0,0,0,0,1|1,0,1]=3 71 B5R1.2 O=C1CSC1 CS13345 [0,0,0,0,0,1|1,1,1]=4 72 B5R1.2 OC1CCC1 CS11176 [0,0,0,0,0,1|2,0,0]=3 73 B5R1.2 OC1CNC1 CS14687 [0,0,0,0,0,1|2,0,0]=3 74 B5R1.2 OC1COC1 CS19329 [0,0,0,0,0,1|1,0,0]=2 75 B5R1.2 SC1COC1 MC101966 [0,0,0,0,0,1|1,0,0]=2 76 B2R0.1 CC#N CS13723 [1,0,1,0,0,0|1,0,1]=4 77 B2R0.1 CC[O-] MC10763 [1,0,1,0,0,0|0,0,1]=3 78 B2R0.1 CNC CS11262 [1,0,1,0,0,0|1,0,0]=3 79 B2R0.1 CNC MC20856 [1,0,1,0,0,0|1,0,0]=3 80 B2R0.1 CNC MC41898 [1,0,1,0,0,0|1,0,0]=3 81 B2R0.1 CNO CS21748 [1,0,1,0,0,0|1,0,0]=3 82 B2R0.1 CON CS19173 [1,0,1,0,0,0|1,0,0]=3 83 B2R0.1 C[Mg]Br MC10193 [1,0,1,0,0,0|2,0,0]=4 84 B2R0.1 C[Zn]Br MC116062 [1,0,1,0,0,0|2,0,0]=4 85 B2R0.1 OBO MC440284 [1,0,1,0,0,0|2,0,0]=4 86 B4R0.1 C#CC(C)O MC427719 [0,1,1,0,0,0|0,0,2]=4 87 B4R0.1 CC(=O)CBr MC20986 [0,1,1,0,0,0|1,0,1]=4 88 B4R0.1 CC(=O)CN CS10921 [0,1,1,0,0,0|1,0,1]=4 89 B4R0.1 CC(=O)CO CS11467 [0,1,1,0,0,0|0,0,1]=3 90 B4R0.1 CC(=O)NO CS14961 [0,1,1,0,0,0|1,0,1]=4 91 B4R0.1 CC(C)=NO CS10884 [0,1,1,0,0,0|1,0,1]=4 92 B4R0.1 CC(C)C#N MC41920 [0,1,1,0,0,0|1,0,1]=4 93 B4R0.1 CC(C)NN CS11525 [0,1,1,0,0,0|2,0,0]=4 94 B4R0.1 CC(C)ON CS13668 [0,1,1,0,0,0|1,0,0]=3 95 B4R0.1 CC(C)[Zn]Br MC121350 [0,1,1,0,0,0|2,0,0]=4 96 B4R0.1 CC(Cl)CO CS20251 [0,1,1,0,0,0|0,0,0]=2 97 B4R0.1 CC(Cl)CO MC428270 [0,1,1,0,0,0|0,0,0]=2 98 B4R0.1 CC(N)CN CS20323 [0,1,1,0,0,0|1,0,0]=3 99 B4R0.1 CC(N)CN MC10147 [0,1,1,0,0,0|1,0,0]=3 100 B4R0.1 CC(N)CO CS14182 [0,1,1,0,0,0|0,0,0]=2 101 B4R0.1 CC(N)CO CS19476 [0,1,1,0,0,0|0,0,0]=2 102 B4R0.1 CC(N)CO CS21310 [0,1,1,0,0,0|0,0,0]=2 103 B4R0.1 CC(O)CCl MC20696 [0,1,1,0,0,0|1,0,0]=3 104 B4R0.1 CC(O)CCl MC20697 [0,1,1,0,0,0|1,0,0]=3 105 B4R0.1 CC(O)CN CS14075 [0,1,1,0,0,0|1,0,0]=3 106 B4R0.1 CC(O)CO MC20330 [0,1,1,0,0,0|0,0,0]=2 107 B4R0.1 CCB(O)O CS13979 [0,1,1,0,0,0|1,0,0]=3 108 B4R0.1 CCC(C)O MC10786 [0,1,1,0,0,0|0,0,0]=2 109 B4R0.1 CCC(N)=O CS11886 [0,1,1,0,0,0|0,0,2]=4 110 B4R0.1 COC(N)=O CS11667 [0,1,1,0,0,0|1,0,1]=4 111 B4R0.1 COC(N)=[NH2+] CS11820 [0,1,1,0,0,0|1,0,1]=4 112 B4R0.1 C\C(N)=N\O CS10879 [0,1,1,0,0,0|1,0,1]=4 113 B4R0.1 C\C=C(/C)Br MC10255 [0,1,1,0,0,0|1,0,1]=4 114 B4R0.1 FC(F)CBr MC429454 [0,1,1,0,0,0|2,0,0]=4 115 B4R0.1 FC(F)CI MC429447 [0,1,1,0,0,0|2,0,0]=4 116 B4R0.1 NCC(=O)O CS19951 [0,1,1,0,0,0|1,0,1]=4 117 B4R0.1 NCC(F)F MC429451 [0,1,1,0,0,0|2,0,0]=4 118 B4R0.1 O=C(O)CCl MC41871 [0,1,1,0,0,0|1,0,1]=4 119 B4R0.1 O=C(O)CO CS19334 [0,1,1,0,0,0|1,0,1]=4 120 B4R0.1 O=S([O-])CO CS11936 [0,1,1,0,0,0|2,0,0]=4 121 B4R0.1 OCC(F)F CS20974 [0,1,1,0,0,0|1,0,0]=3 122 B4R0.2 C#CCCN MC424006 [0,1,1,0,0,0|1,0,1]=4 123 B4R0.2 C#CCNC MC41929 [0,1,1,0,0,0|1,0,1]=4 124 B4R0.2 C#CCON MC113172 [0,1,1,0,0,0|0,0,2]=4 125 B4R0.2 C=COCC MC41915 [0,1,1,0,0,0|0,0,1]=3 126 B4R0.2 CCCC=O MC41868 [0,1,1,0,0,0|0,0,1]=3 127 B4R0.2 CCCCO MC41869 [0,1,1,0,0,0|0,0,0]=2 128 B4R0.2 CCC[Zn]Br MC121348 [0,1,1,0,0,0|1,0,0]=3 129 B4R0.2 CCNCC CS11240 [0,1,1,0,0,0|1,0,0]=3 130 B4R0.2 CCOC=N MC33024 [0,1,1,0,0,0|0,0,1]=3 131 B4R0.2 CCOC=O MC41912 [0,1,1,0,0,0|0,0,1]=3 132 B4R0.2 CCOCC MC41960 [0,1,1,0,0,0|0,0,0]=2 133 B4R0.2 CC[Zn]CC MC10752 [0,1,1,0,0,0|1,0,0]=3 134 B4R0.2 CNCC#N CS19888 [0,1,1,0,0,0|1,0,1]=4 135 B4R0.2 CNCCO CS20910 [0,1,1,0,0,0|0,0,0]=2 136 B4R0.2 COCC#N MC40783 [0,1,1,0,0,0|0,0,1]=3 137 B4R0.2 COCCCl MC428007 [0,1,1,0,0,0|0,0,0]=2 138 B4R0.2 ClCCCBr MC41861 [0,1,1,0,0,0|1,0,0]=3 139 B4R0.2 N#CCCBr CS22188 [0,1,1,0,0,0|1,0,1]=4 140 B4R0.2 NCCCBr CS22190 [0,1,1,0,0,0|1,0,0]=3 141 B4R0.2 NCCCS MC428180 [0,1,1,0,0,0|0,1,0]=3 142 B4R0.2 [NH3+]CCCS MC428140 [0,1,1,0,0,0|0,1,0]=3 143 B4R0.3 CC(C)(C)Br MC41863 [0,1,1,0,0,0|1,0,0]=3 144 B4R0.3 CC(C)(C)Cl MC41875 [0,1,1,0,0,0|1,0,0]=3 145 B4R0.3 CC(C)(C)[O-] MC10621 [0,1,1,0,0,0|0,0,1]=3 146 B4R0.3 CC(C)(C)[O-] MC21066 [0,1,1,0,0,0|0,0,1]=3 147 B4R0.3 CS(=O)(=O)O MC40426 [0,1,1,0,0,0|2,0,0]=4 148 B4R0.3 CS(=O)(=O)O MC40428 [0,1,1,0,0,0|2,0,0]=4 149 B4R0.3 C[N+](C)(C)C CS12014 [0,1,1,0,0,0|2,0,0]=4 150 B4R0.3 C[N+](C)(C)C CS12015 [0,1,1,0,0,0|2,0,0]=4 151 B4R0.3 C[Pt](C)(C)I MC445016 [0,1,1,0,0,0|2,0,0]=4 152 B4R0.3 C[S+](C)(C)=O CS12054 [0,1,1,0,0,0|1,0,1]=4 153 B4R0.3 C[Si](C)(C)Br MC21154 [0,1,1,0,0,0|1,1,0]=4 154 B4R0.3 C[Si](C)(C)Cl MC41877 [0,1,1,0,0,0|1,1,0]=4 155 B6R1.4 CC1COC1=O MC121237 [0,1,0,0,0,1|0,0,0]=2 156 B6R1.4 NC1CCC1O MC111877 [0,1,0,0,0,1|2,0,0]=4 157 B6R1.5 CC1CC(N)C1 MC105778 [0,1,0,0,0,1|1,0,0]=3 158 B6R1.5 CN1CC(N)C1 MC444125 [0,1,0,0,0,1|2,0,0]=4 159 B6R1.5 CN1CC(O)C1 MC444271 [0,1,0,0,0,1|2,0,0]=4 160 B6R1.5 CN1CC(O)C1 MC444272 [0,1,0,0,0,1|2,0,0]=4 161 B6R1.5 NC1CC(=O)C1 MC444232 [0,1,0,0,0,1|2,0,0]=4 162 B6R1.5 NC1CC(F)C1 MC101921 [0,1,0,0,0,1|2,0,0]=4 163 B6R1.5 NC1CC(F)C1 MC104866 [0,1,0,0,0,1|2,0,0]=4 164 B6R1.5 NC1CC(F)C1 MC104867 [0,1,0,0,0,1|2,0,0]=4 165 B6R1.5 NC1CC(F)C1 MC112996 [0,1,0,0,0,1|2,0,0]=4 166 B6R1.5 NC1CC(F)C1 MC115644 [0,1,0,0,0,1|2,0,0]=4 167 B6R1.5 NC1CC(F)C1 MC444599 [0,1,0,0,0,1|2,0,0]=4 168 B6R1.5 NC1CC(N)C1 MC103595 [0,1,0,0,0,1|2,0,0]=4 169 B6R1.5 NC1CC(N)C1 MC103596 [0,1,0,0,0,1|2,0,0]=4 170 B6R1.5 NC1CC(N)C1 MC103597 [0,1,0,0,0,1|2,0,0]=4 171 B6R1.5 NC1CC(N)C1 MC103598 [0,1,0,0,0,1|2,0,0]=4 172 B6R1.5 NC1CC(N)C1 MC104654 [0,1,0,0,0,1|2,0,0]=4 173 B6R1.5 NC1CC(O)C1 MC105248 [0,1,0,0,0,1|2,0,0]=4 174 B6R1.5 NC1CC(O)C1 MC105286 [0,1,0,0,0,1|2,0,0]=4 175 B6R1.5 NC1CC(O)C1 MC444231 [0,1,0,0,0,1|2,0,0]=4 176 B6R1.5 NC1CC(O)C1 MC444480 [0,1,0,0,0,1|2,0,0]=4 177 B6R1.5 NC1CC(O)C1 MC444598 [0,1,0,0,0,1|2,0,0]=4 178 B6R1.5 O=C1CC(F)C1 MC104154 [0,1,0,0,0,1|2,0,0]=4 179 B6R1.5 OC1CC(F)C1 MC103711 [0,1,0,0,0,1|2,0,0]=4 180 B6R1.5 OC1CC(F)C1 MC104375 [0,1,0,0,0,1|2,0,0]=4 181 B6R1.5 OC1CC(F)C1 MC104868 [0,1,0,0,0,1|2,0,0]=4 182 B6R1.6 BrCC1CCC1 MC10470 [0,1,0,0,0,1|1,0,0]=3 183 B6R1.6 BrCC1CCO1 MC444177 [0,1,0,0,0,1|0,0,0]=2 184 B6R1.6 CNC1CNC1 MC444567 [0,1,0,0,0,1|1,0,0]=3 185 B6R1.6 CNC1COC1 MC425340 [0,1,0,0,0,1|0,0,0]=2 186 B6R1.6 CNC1COC1 MC444120 [0,1,0,0,0,1|0,0,0]=2 187 B6R1.6 COC1CNC1 CS17370 [0,1,0,0,0,1|1,0,0]=3 188 B6R1.6 Cl[Zn]C1CCC1 MC121327 [0,1,0,0,0,1|2,0,0]=4 189 B6R1.6 ICC1COC1 MC101907 [0,1,0,0,0,1|0,0,0]=2 190 B6R1.6 N#CC1CNC1 CS10942 [0,1,0,0,0,1|1,0,1]=4 191 B6R1.6 NCC1CCC1 CS11178 [0,1,0,0,0,1|1,0,0]=3 192 B6R1.6 NCC1CCN1 MC121273 [0,1,0,0,0,1|1,0,0]=3 193 B6R1.6 NCC1CCO1 MC121118 [0,1,0,0,0,1|0,0,0]=2 194 B6R1.6 NCC1CNC1 MC105370 [0,1,0,0,0,1|1,0,0]=3 195 B6R1.6 NCC1COC1 MC10517 [0,1,0,0,0,1|0,0,0]=2 196 B6R1.6 NCC1CSC1 MC121257 [0,1,0,0,0,1|0,1,0]=3 197 B6R1.6 NNC1CCC1 MC111229 [0,1,0,0,0,1|2,0,0]=4 198 B6R1.6 NNC1COC1 MC111202 [0,1,0,0,0,1|1,0,0]=3 199 B6R1.6 OCC1CCN1 CS15230 [0,1,0,0,0,1|1,0,0]=3 200 B6R1.6 OCC1CCN1 MC102029 [0,1,0,0,0,1|1,0,0]=3 201 B6R1.6 OCC1CCN1 MC102030 [0,1,0,0,0,1|1,0,0]=3 202 B6R1.6 OCC1CCO1 CS15009 [0,1,0,0,0,1|0,0,0]=2 203 B6R1.6 OCC1CNC1 CS12891 [0,1,0,0,0,1|1,0,0]=3 204 B6R1.6 OCC1CNC1 MC444028 [0,1,0,0,0,1|1,0,0]=3 205 B6R1.6 OCC1COC1 CS14670 [0,1,0,0,0,1|0,0,0]=2 206 B6R1.10 CC1(F)CNC1 MC102153 [0,1,0,0,0,1|1,0,0]=3 207 B6R1.10 CC1(N)COC1 CS14859 [0,1,0,0,0,1|0,0,0]=2 208 B6R1.10 CC1(N)COC1 MC444292 [0,1,0,0,0,1|0,0,0]=2 209 B6R1.10 CC1(N)CSC1 MC113158 [0,1,0,0,0,1|0,1,0]=3 210 B6R1.10 CC1(O)CNC1 CS15502 [0,1,0,0,0,1|1,0,0]=3 211 B6R1.10 FC1(F)CNC1 CS21899 [0,1,0,0,0,1|2,0,0]=4 212 B6R1.3 N#CCC1CC1 MC433947 [0,2,0,0,0,0|1,0,0]=3 213 B6R1.3 NCCC1CC1 MC425320 [0,2,0,0,0,0|1,0,0]=3 214 B6R1.3 NCCN1CC1 MC100405 [0,2,0,0,0,0|2,0,0]=4 215 B6R1.3 NOCC1CC1 MC107884 [0,2,0,0,0,0|1,0,0]=3 216 B6R1.3 O=C=NC1CC1 MC418391 [0,2,0,0,0,0|1,0,1]=4 217 B6R1.3 OCCC1CC1 MC433884 [0,2,0,0,0,0|1,0,0]=3 218 B6R1.7 C#CC1(N)CC1 MC21061 [0,2,0,0,0,0|1,0,1]=4 219 B6R1.7 N#CC1(N)CC1 CS13582 [0,2,0,0,0,0|1,0,1]=4 220 B6R1.7 NC1(CF)CC1 MC107347 [0,2,0,0,0,0|1,0,0]=3 221 B6R1.7 NC1(CO)CC1 CS13349 [0,2,0,0,0,0|1,0,0]=3 222 B6R1.7 NC1(CO)CC1 MC113084 [0,2,0,0,0,0|1,0,0]=3 223 B6R1.7 NCC1(O)CC1 CS20441 [0,2,0,0,0,0|1,0,0]=3 224 B6R1.8 N#CC1CC1F MC102844 [0,2,0,0,0,0|1,0,1]=4 225 B6R1.8 N#CC1CC1F MC102845 [0,2,0,0,0,0|1,0,1]=4 226 B6R1.8 OCC1CC1F MC102847 [0,2,0,0,0,0|1,0,0]=3 227 B6R1.8 OCC1CC1F MC102848 [0,2,0,0,0,0|1,0,0]=3 228 B6R1.8 OCC1CC1F MC102849 [0,2,0,0,0,0|1,0,0]=3 229 B6R1.8 OCC1CC1F MC102850 [0,2,0,0,0,0|1,0,0]=3 230 B6R1.11 CC(I)C1CC1 MC429998 [0,2,0,0,0,0|1,0,0]=3 231 B6R1.11 CC(N)C1CC1 MC428207 [0,2,0,0,0,0|1,0,0]=3 232 B6R1.11 N=C(N)C1CC1 CS16535 [0,2,0,0,0,0|1,0,1]=4 233 B6R1.11 NC(=O)C1CC1 CS16456 [0,2,0,0,0,0|1,0,1]=4 234 B6R1.11 NC(=S)C1CC1 MC21067 [0,2,0,0,0,0|1,0,1]=4 235 B6R1.11 O=C(Cl)C1CC1 MC434039 [0,2,0,0,0,0|1,0,1]=4 236 B6R1.11 O=C(O)C1CC1 CS13839 [0,2,0,0,0,0|1,0,1]=4 237 B6R1.11 O=C([O-])C1CO1 CS17514 [0,2,0,0,0,0|0,0,1]=3 238 B6R1.11 OB(O)C1CC1 MC20194 [0,2,0,0,0,0|2,0,0]=4 239 B6R1.9 NC1CC1(F)F MC431141 [0,2,0,0,0,0|2,0,0]=4 240 B4R1.1 C1CNC1 CS14211 [0,0,1,1,0,0|1,0,0]=3 241 B4R1.1 C1CNC1 MC445038 [0,0,1,1,0,0|1,0,0]=3 242 B6R1.2 BrC1CCNC1 CS15742 [0,0,0,0,0,2|2,0,0]=4 243 B6R1.2 BrC1CCOC1 CS14643 [0,0,0,0,0,2|1,0,0]=3 244 B6R1.2 CC1=CC=CO1 MC41695 [0,0,0,0,0,2|0,0,2]=4 245 B6R1.2 CC1=COC=N1 MC427478 [0,0,0,0,0,2|0,0,2]=4 246 B6R1.2 CC1=NC=CO1 CS11827 [0,0,0,0,0,2|0,0,2]=4 247 B6R1.2 CC1=NCCC1 CS21664 [0,0,0,0,0,2|1,0,1]=4 248 B6R1.2 CC1=NN=CO1 CS12863 [0,0,0,0,0,2|0,0,2]=4 249 B6R1.2 CC1=NOC=C1 CS11533 [0,0,0,0,0,2|0,0,2]=4 250 B6R1.2 CC1CCCN1 CS18299 [0,0,0,0,0,2|1,0,0]=3 251 B6R1.2 CC1CCCN1 CS18800 [0,0,0,0,0,2|1,0,0]=3 252 B6R1.2 CC1CCCN1 CS19735 [0,0,0,0,0,2|1,0,0]=3 253 B6R1.2 CC1CCCN1 CS21699 [0,0,0,0,0,2|1,0,0]=3 254 B6R1.2 CC1CCCN1 CS21700 [0,0,0,0,0,2|1,0,0]=3 255 B6R1.2 CC1CCCN1 MC428345 [0,0,0,0,0,2|1,0,0]=3 256 B6R1.2 CC1CCCO1 MC20580 [0,0,0,0,0,2|0,0,0]=2 257 B6R1.2 FC1CCNC1 CS12894 [0,0,0,0,0,2|2,0,0]=4 258 B6R1.2 FC1CCNC1 CS14870 [0,0,0,0,0,2|2,0,0]=4 259 B6R1.2 FC1CCNC1 MC31003 [0,0,0,0,0,2|2,0,0]=4 260 B6R1.2 IC1CCOC1 MC101926 [0,0,0,0,0,2|1,0,0]=3 261 B6R1.2 NC1CC=CC1 CS19415 [0,0,0,0,0,2|2,0,0]=4 262 B6R1.2 NC1CCOC1 CS12010 [0,0,0,0,0,2|1,0,0]=3 263 B6R1.2 NC1CCOC1 CS13003 [0,0,0,0,0,2|1,0,0]=3 264 B6R1.2 NC1CCOC1 CS20366 [0,0,0,0,0,2|1,0,0]=3 265 B6R1.2 NC1CCOC1 MC443324 [0,0,0,0,0,2|1,0,0]=3 266 B6R1.2 NC1CCOC1 MC444237 [0,0,0,0,0,2|1,0,0]=3 267 B6R1.2 O=C1CCOC1 CS18178 [0,0,0,0,0,2|1,0,1]=4 268 B6R1.2 O=C1OCCO1 CS20012 [0,0,0,0,0,2|1,0,1]=4 269 B6R1.2 OC1CC=CC1 MC10342 [0,0,0,0,0,2|2,0,0]=4 270 B6R1.2 OC1CCNC1 CS16166 [0,0,0,0,0,2|2,0,0]=4 271 B6R1.2 OC1CCNC1 CS16635 [0,0,0,0,0,2|2,0,0]=4 272 B6R1.2 OC1CCNC1 CS16650 [0,0,0,0,0,2|2,0,0]=4 273 B6R1.2 OC1CCNC1 CS17407 [0,0,0,0,0,2|2,0,0]=4 274 B6R1.2 OC1CCNC1 CS21757 [0,0,0,0,0,2|2,0,0]=4 275 B6R1.2 OC1CCOC1 CS20284 [0,0,0,0,0,2|1,0,0]=3 276 B6R1.2 OC1CCOC1 MC42235 [0,0,0,0,0,2|1,0,0]=3 277 B6R1.2 OC1CCOC1 MC444279 [0,0,0,0,0,2|1,0,0]=3