0 B4R0.2 C#CCCN MC424006 [0,0,0,0,0,0|0,0,2]=2 1 B4R0.2 C#CCNC MC41929 [0,0,0,0,0,0|2,0,1]=3 2 B4R0.2 C#CCON MC113172 [0,0,0,0,0,0|1,0,2]=3 3 B4R0.2 C#CC[Mg]Br MC116035 [0,0,0,0,0,0|2,0,2]=4 4 B4R0.2 C=CCNN MC107856 [0,0,0,0,0,0|1,0,2]=3 5 B4R0.2 C=CC[Pd]Cl MC444917 [0,0,0,0,0,0|2,0,2]=4 6 B4R0.2 C=COCC MC41915 [0,0,0,0,0,0|2,0,1]=3 7 B4R0.2 CCCC=O MC41868 [0,0,0,0,0,0|1,0,1]=2 8 B4R0.2 CCCCO MC41869 [0,0,0,0,0,0|1,0,0]=1 9 B4R0.2 CCC[Zn]Br MC121348 [0,0,0,0,0,0|2,0,0]=2 10 B4R0.2 CCNCC CS11240 [0,0,0,0,0,0|2,0,0]=2 11 B4R0.2 CCOC=N MC33024 [0,0,0,0,0,0|1,0,2]=3 12 B4R0.2 CCOC=O MC41912 [0,0,0,0,0,0|2,0,1]=3 13 B4R0.2 CCOCC MC41960 [0,0,0,0,0,0|2,0,0]=2 14 B4R0.2 CC[Zn]CC MC10752 [0,0,0,0,0,0|2,0,0]=2 15 B4R0.2 CNCC#N CS19888 [0,0,0,0,0,0|1,0,2]=3 16 B4R0.2 CNCCO CS20910 [0,0,0,0,0,0|2,0,0]=2 17 B4R0.2 COCC#N MC40783 [0,0,0,0,0,0|1,0,2]=3 18 B4R0.2 COCCCl MC428007 [0,0,0,0,0,0|2,0,0]=2 19 B4R0.2 C\C=C\C=O MC41879 [0,0,0,0,0,0|1,0,3]=4 20 B4R0.2 ClCCCBr MC41861 [0,0,0,0,0,0|2,0,0]=2 21 B4R0.2 N#CCC#N MC41923 [0,0,0,0,0,0|1,0,3]=4 22 B4R0.2 N#CCCBr CS22188 [0,0,0,0,0,0|1,0,2]=3 23 B4R0.2 NCCCBr CS22190 [0,0,0,0,0,0|1,0,0]=1 24 B4R0.2 NCCCS MC428180 [0,0,0,0,0,0|1,0,0]=1 25 B4R0.2 [NH3+]CCCS MC428140 [0,0,0,0,0,0|1,0,1]=2 26 B3R0.1 BrCCBr MC41884 [1,0,0,0,0,0|2,0,0]=3 27 B3R0.1 C=CCBr MC41858 [1,0,0,0,0,0|1,0,2]=4 28 B3R0.1 CCC#N MC41959 [1,0,0,0,0,0|0,0,2]=3 29 B3R0.1 CCON CS11314 [1,0,0,0,0,0|1,0,0]=2 30 B3R0.1 CC[Zn]Br MC116063 [1,0,0,0,0,0|2,0,0]=3 31 B3R0.1 CNOC CS13986 [1,0,0,0,0,0|2,0,0]=3 32 B3R0.1 COCCl MC41874 [1,0,0,0,0,0|2,0,0]=3 33 B3R0.1 C\C=C\C MC428373 [1,0,0,0,0,0|0,0,2]=3 34 B3R0.1 FCCBr MC429448 [1,0,0,0,0,0|2,0,0]=3 35 B3R0.1 N#CCCl MC41870 [1,0,0,0,0,0|1,0,2]=4 36 B3R0.1 N#CCN CS19759 [1,0,0,0,0,0|1,0,1]=3 37 B3R0.1 NCCBr CS14044 [1,0,0,0,0,0|1,0,0]=2 38 B3R0.1 NCCCl CS16188 [1,0,0,0,0,0|1,0,0]=2 39 B3R0.1 NCCF CS21564 [1,0,0,0,0,0|1,0,0]=2 40 B3R0.1 SCCS MC20652 [1,0,0,0,0,0|2,0,0]=3 41 B5R0.1 C=C(C)CCBr CS14513 [0,1,0,0,0,0|1,0,1]=3 42 B5R0.1 CC(C)=CCBr MC41900 [0,1,0,0,0,0|1,0,2]=4 43 B5R0.1 CC(C)CC=O CS11530 [0,1,0,0,0,0|1,0,1]=3 44 B5R0.1 CC(C)SC#N MC41971 [0,1,0,0,0,0|1,0,2]=4 45 B5R0.1 CC(N)CCO CS14355 [0,1,0,0,0,0|1,0,0]=2 46 B5R0.1 CC(N)CCO CS14356 [0,1,0,0,0,0|1,0,0]=2 47 B5R0.1 CC(N)CCO CS22096 [0,1,0,0,0,0|1,0,0]=2 48 B5R0.1 CC(O)CON CS17735 [0,1,0,0,0,0|1,0,0]=2 49 B5R0.1 CCCB(O)O CS14802 [0,1,0,0,0,0|2,0,0]=3 50 B5R0.1 CCCC(C)=O CS21731 [0,1,0,0,0,0|1,0,1]=3 51 B5R0.1 CCC[N+](=O)[O-] MC428297 [0,1,0,0,0,0|2,0,0]=3 52 B5R0.1 CCOC(=N)N CS11818 [0,1,0,0,0,0|1,0,1]=3 53 B5R0.1 CN(C)CC=O CS17734 [0,1,0,0,0,0|2,0,1]=4 54 B5R0.1 CN(C)CCBr CS10949 [0,1,0,0,0,0|2,0,0]=3 55 B5R0.1 CN(C)CCCl CS14471 [0,1,0,0,0,0|2,0,0]=3 56 B5R0.1 CN(C)CCCl CS17225 [0,1,0,0,0,0|2,0,0]=3 57 B5R0.1 CN(C)CCN CS18603 [0,1,0,0,0,0|1,0,0]=2 58 B5R0.1 CN(C)CCO CS11733 [0,1,0,0,0,0|2,0,0]=3 59 B5R0.1 CNCC(=O)O CS18595 [0,1,0,0,0,0|2,0,1]=4 60 B5R0.1 CNCC(N)=O MC438151 [0,1,0,0,0,0|1,0,1]=3 61 B5R0.1 COCC(=O)Cl MC40491 [0,1,0,0,0,0|2,0,1]=4 62 B5R0.1 COCC(=O)O CS11579 [0,1,0,0,0,0|2,0,1]=4 63 B5R0.1 COCC(C)N CS15401 [0,1,0,0,0,0|1,0,0]=2 64 B5R0.1 COCC(C)O CS20249 [0,1,0,0,0,0|2,0,0]=3 65 B5R0.1 COCC(C)O CS20309 [0,1,0,0,0,0|2,0,0]=3 66 B5R0.1 COCC(C)O CS20741 [0,1,0,0,0,0|2,0,0]=3 67 B5R0.1 COCC(N)=O MC41924 [0,1,0,0,0,0|1,0,1]=3 68 B5R0.1 COCC(N)=S MC102255 [0,1,0,0,0,0|1,0,1]=3 69 B5R0.1 CSCC(=O)Cl MC106201 [0,1,0,0,0,0|2,0,1]=4 70 B5R0.1 CSCC(N)=O CS12608 [0,1,0,0,0,0|1,0,1]=3 71 B5R0.1 N#CCC(N)=O CS18594 [0,1,0,0,0,0|1,0,2]=4 72 B5R0.1 N#CCC(N)=S MC428323 [0,1,0,0,0,0|1,0,2]=4 73 B5R0.1 NCCC(=O)O CS13499 [0,1,0,0,0,0|1,0,1]=3 74 B5R0.1 NCCC(N)=O MC436150 [0,1,0,0,0,0|1,0,1]=3 75 B5R0.1 O=C(O)CCO MC20638 [0,1,0,0,0,0|2,0,1]=4 76 B5R0.2 BrCCCCBr MC41885 [0,1,0,0,0,0|1,0,0]=2 77 B5R0.2 C=CCCON MC110761 [0,1,0,0,0,0|0,0,2]=3 78 B5R0.2 C=CCC[Zn]Br MC121337 [0,1,0,0,0,0|1,0,2]=4 79 B5R0.2 CC#CC[Mg]Br MC116059 [0,1,0,0,0,0|1,0,2]=4 80 B5R0.2 CCCCCBr CS20657 [0,1,0,0,0,0|1,0,0]=2 81 B5R0.2 CCCC[Zn]Br MC121334 [0,1,0,0,0,0|1,0,0]=2 82 B5R0.2 CCOCCBr CS21396 [0,1,0,0,0,0|1,0,0]=2 83 B5R0.2 CCOCCCl MC428008 [0,1,0,0,0,0|1,0,0]=2 84 B5R0.2 CNCCC#N CS22369 [0,1,0,0,0,0|0,0,2]=3 85 B5R0.2 CNCCCO CS14200 [0,1,0,0,0,0|1,0,0]=2 86 B5R0.2 CNCCNC CS15116 [0,1,0,0,0,0|1,0,0]=2 87 B5R0.2 CNCCOC MC427349 [0,1,0,0,0,0|1,0,0]=2 88 B5R0.2 COCCC#N CS22345 [0,1,0,0,0,0|0,0,2]=3 89 B5R0.2 COCCCBr CS20649 [0,1,0,0,0,0|1,0,0]=2 90 B5R0.2 COCCCO CS20039 [0,1,0,0,0,0|1,0,0]=2 91 B5R0.2 COCCNN MC103229 [0,1,0,0,0,0|1,0,0]=2 92 B5R0.2 COCCNN MC107041 [0,1,0,0,0,0|1,0,0]=2 93 B5R0.2 COCCOC MC41899 [0,1,0,0,0,0|2,0,0]=3 94 B5R0.2 COCCOC MC445008 [0,1,0,0,0,0|2,0,0]=3 95 B5R0.2 C\C=C\C[Pd]Cl MC444919 [0,1,0,0,0,0|1,0,2]=4 96 B5R0.2 ClC\C=C\CCl MC10276 [0,1,0,0,0,0|1,0,2]=4 97 B5R0.2 ClC\C=C\CCl MC10277 [0,1,0,0,0,0|1,0,2]=4 98 B5R0.2 N#CCCC#N MC10499 [0,1,0,0,0,0|0,0,3]=4 99 B5R0.2 N#CCCCBr MC433750 [0,1,0,0,0,0|0,0,2]=3 100 B5R0.2 NCC#CCCl MC436177 [0,1,0,0,0,0|0,0,2]=3 101 B5R0.2 NCCCCBr CS14979 [0,1,0,0,0,0|0,0,0]=1 102 B5R0.2 NCCCCN CS19906 [0,1,0,0,0,0|0,0,0]=1 103 B5R0.2 OC\C=C\CCl MC10262 [0,1,0,0,0,0|1,0,2]=4 104 B5R0.2 OC\C=C\CO MC41968 [0,1,0,0,0,0|1,0,2]=4 105 B5R0.2 OC\C=C\CO MC424009 [0,1,0,0,0,0|1,0,2]=4 106 B5R0.3 C=C(CO)CO CS21689 [0,1,0,0,0,0|2,0,1]=4 107 B5R0.3 CCC(C)[Zn]Br MC121335 [0,1,0,0,0,0|2,0,0]=3 108 B5R0.3 CCC(N)CO CS15119 [0,1,0,0,0,0|1,0,0]=2 109 B5R0.3 CCC(N)CO MC10528 [0,1,0,0,0,0|1,0,0]=2 110 B5R0.3 CCC(N)CO MC20718 [0,1,0,0,0,0|1,0,0]=2 111 B5R0.3 CCC(N)CO MC436159 [0,1,0,0,0,0|1,0,0]=2 112 B5R0.3 CCC(O)CO CS15622 [0,1,0,0,0,0|1,0,0]=2 113 B5R0.3 CNC(=O)CCl MC21094 [0,1,0,0,0,0|2,0,1]=4 114 B5R0.3 CNC(=O)CN MC437710 [0,1,0,0,0,0|1,0,1]=3 115 B5R0.3 COC(=O)CN CS15045 [0,1,0,0,0,0|1,0,1]=3 116 B5R0.3 COC(=O)CO CS19433 [0,1,0,0,0,0|2,0,1]=4 117 B5R0.3 COC(=O)CS MC20578 [0,1,0,0,0,0|2,0,1]=4 118 B5R0.3 COC(=O)NN MC20825 [0,1,0,0,0,0|2,0,1]=4 119 B5R0.3 COC(C)CN CS17733 [0,1,0,0,0,0|1,0,0]=2 120 B5R0.3 COC(C)CO CS12306 [0,1,0,0,0,0|2,0,0]=3 121 B5R0.3 NC(CO)CO CS18352 [0,1,0,0,0,0|2,0,0]=3 122 B5R0.3 NCC(O)CCl MC427329 [0,1,0,0,0,0|1,0,0]=2 123 B5R0.3 NCC(O)CN CS14232 [0,1,0,0,0,0|1,0,0]=2 124 B5R0.3 NCC(O)CO CS14832 [0,1,0,0,0,0|1,0,0]=2 125 B5R0.3 NCC(O)CO CS18397 [0,1,0,0,0,0|1,0,0]=2 126 B5R0.3 NCC(O)CO MC20311 [0,1,0,0,0,0|1,0,0]=2 127 B5R0.3 O=C(CO)CO CS11245 [0,1,0,0,0,0|2,0,1]=4 128 B5R0.3 O=CC(O)CO MC107096 [0,1,0,0,0,0|2,0,1]=4 129 B5R0.3 O=CC(O)CO MC20361 [0,1,0,0,0,0|2,0,1]=4 130 B5R0.3 O=CC(O)CO MC20362 [0,1,0,0,0,0|2,0,1]=4 131 B5R0.3 OC(CCl)CCl MC428012 [0,1,0,0,0,0|2,0,0]=3 132 B5R0.3 OC(CF)CF MC429449 [0,1,0,0,0,0|2,0,0]=3 133 B5R0.3 OCC(O)CCl CS15061 [0,1,0,0,0,0|2,0,0]=3 134 B5R0.3 OCC(O)CCl MC20314 [0,1,0,0,0,0|2,0,0]=3 135 B5R1.1 C1=CCNC1 MC10278 [0,0,0,1,0,0|0,0,2]=3 136 B5R1.1 C1CCNC1 MC41708 [0,0,0,1,0,0|0,0,0]=1 137 B5R1.1 C1CNNC1 CS16750 [0,0,0,1,0,0|1,0,0]=2 138 B5R1.2 BrC1CNC1 MC444255 [0,0,0,1,0,0|2,0,0]=3 139 B5R1.2 BrC1COC1 MC425330 [0,0,0,1,0,0|2,0,0]=3 140 B5R1.2 CC1CNC1 CS13089 [0,0,0,1,0,0|2,0,0]=3 141 B5R1.2 ClC1CNC1 MC444320 [0,0,0,1,0,0|2,0,0]=3 142 B5R1.2 FC1CNC1 CS22297 [0,0,0,1,0,0|2,0,0]=3 143 B5R1.2 FC1COC1 MC113065 [0,0,0,1,0,0|2,0,0]=3 144 B5R1.2 IC1CNC1 MC444286 [0,0,0,1,0,0|2,0,0]=3 145 B5R1.2 IC1COC1 MC10503 [0,0,0,1,0,0|2,0,0]=3 146 B5R1.2 NC1COC1 CS22388 [0,0,0,1,0,0|1,0,0]=2 147 B5R1.2 NC1COC1 MC425332 [0,0,0,1,0,0|1,0,0]=2 148 B5R1.2 NC1CSC1 MC102176 [0,0,0,1,0,0|1,0,0]=2 149 B5R1.2 NC1CSC1 MC115657 [0,0,0,1,0,0|1,0,0]=2 150 B5R1.2 O=C1CCC1 MC10479 [0,0,0,1,0,0|1,0,1]=3 151 B5R1.2 O=C1CCN1 MC31231 [0,0,0,1,0,0|1,0,1]=3 152 B5R1.2 O=C1CNC1 MC444241 [0,0,0,1,0,0|2,0,1]=4 153 B5R1.2 O=C1COC1 CS22391 [0,0,0,1,0,0|2,0,1]=4 154 B5R1.2 O=C1CSC1 CS13345 [0,0,0,1,0,0|2,0,1]=4 155 B5R1.2 OC1CCC1 CS11176 [0,0,0,1,0,0|1,0,0]=2 156 B5R1.2 OC1CNC1 CS14687 [0,0,0,1,0,0|2,0,0]=3 157 B5R1.2 OC1COC1 CS19329 [0,0,0,1,0,0|2,0,0]=3 158 B5R1.2 SC1COC1 MC101966 [0,0,0,1,0,0|2,0,0]=3 159 B5R1.3 BrCC1CC1 MC10481 [0,0,0,1,0,0|1,0,0]=2 160 B5R1.3 Br[Zn]C1CC1 MC121325 [0,0,0,1,0,0|2,0,0]=3 161 B5R1.3 C=CC1CO1 MC428261 [0,0,0,1,0,0|1,0,2]=4 162 B5R1.3 CCC1CO1 MC20699 [0,0,0,1,0,0|1,0,0]=2 163 B5R1.3 CCC1CO1 MC428314 [0,0,0,1,0,0|1,0,0]=2 164 B5R1.3 CNC1CC1 CS13160 [0,0,0,1,0,0|2,0,0]=3 165 B5R1.3 ClCC1CC1 CS19956 [0,0,0,1,0,0|1,0,0]=2 166 B5R1.3 ClCC1CO1 MC20322 [0,0,0,1,0,0|2,0,0]=3 167 B5R1.3 ClCC1CO1 MC41680 [0,0,0,1,0,0|2,0,0]=3 168 B5R1.3 ICC1CO1 MC102795 [0,0,0,1,0,0|2,0,0]=3 169 B5R1.3 N#CC1CC1 MC41837 [0,0,0,1,0,0|0,0,2]=3 170 B5R1.3 NCC1CC1 CS18907 [0,0,0,1,0,0|0,0,0]=1 171 B5R1.3 NNC1CC1 CS15677 [0,0,0,1,0,0|1,0,0]=2 172 B5R1.3 NNC1CC1 CS18095 [0,0,0,1,0,0|1,0,0]=2 173 B5R1.3 O=CC1CC1 MC428327 [0,0,0,1,0,0|1,0,1]=3 174 B5R1.3 OCC1CC1 CS19620 [0,0,0,1,0,0|1,0,0]=2 175 B5R1.4 FC1CC1Br MC102831 [0,0,0,1,0,0|2,0,0]=3 176 B5R1.4 NC1CC1F MC102833 [0,0,0,1,0,0|1,0,0]=2 177 B5R1.4 NC1CC1F MC425321 [0,0,0,1,0,0|1,0,0]=2 178 B2R0.1 CC#N CS13723 [2,0,0,0,0,0|0,0,2]=4 179 B2R0.1 CC[O-] MC10763 [2,0,0,0,0,0|1,0,0]=3 180 B2R0.1 CNC CS11262 [2,0,0,0,0,0|1,0,0]=3 181 B2R0.1 CNC MC20856 [2,0,0,0,0,0|1,0,0]=3 182 B2R0.1 CNC MC41898 [2,0,0,0,0,0|1,0,0]=3 183 B2R0.1 CNO CS21748 [2,0,0,0,0,0|2,0,0]=4 184 B2R0.1 CON CS19173 [2,0,0,0,0,0|1,0,0]=3 185 B2R0.1 C[Mg]Br MC10193 [2,0,0,0,0,0|2,0,0]=4 186 B2R0.1 C[Zn]Br MC116062 [2,0,0,0,0,0|2,0,0]=4 187 B2R0.1 N#CN MC41880 [2,0,0,0,0,0|1,0,1]=4 188 B4R0.1 C#CC(C)O MC427719 [1,1,0,0,0,0|0,0,2]=4 189 B4R0.1 CC(=O)CBr MC20986 [1,1,0,0,0,0|1,0,1]=4 190 B4R0.1 CC(=O)CN CS10921 [1,1,0,0,0,0|0,0,1]=3 191 B4R0.1 CC(=O)CO CS11467 [1,1,0,0,0,0|1,0,1]=4 192 B4R0.1 CC(=O)NN CS10881 [1,1,0,0,0,0|1,0,1]=4 193 B4R0.1 CC(C)C#N MC41920 [1,1,0,0,0,0|0,0,2]=4 194 B4R0.1 CC(C)NN CS11525 [1,1,0,0,0,0|1,0,0]=3 195 B4R0.1 CC(C)ON CS13668 [1,1,0,0,0,0|1,0,0]=3 196 B4R0.1 CC(C)[Zn]Br MC121350 [1,1,0,0,0,0|2,0,0]=4 197 B4R0.1 CC(Cl)CO CS20251 [1,1,0,0,0,0|1,0,0]=3 198 B4R0.1 CC(Cl)CO MC428270 [1,1,0,0,0,0|1,0,0]=3 199 B4R0.1 CC(N)CN CS20323 [1,1,0,0,0,0|0,0,0]=2 200 B4R0.1 CC(N)CN MC10147 [1,1,0,0,0,0|0,0,0]=2 201 B4R0.1 CC(N)CO CS14182 [1,1,0,0,0,0|1,0,0]=3 202 B4R0.1 CC(N)CO CS19476 [1,1,0,0,0,0|1,0,0]=3 203 B4R0.1 CC(N)CO CS21310 [1,1,0,0,0,0|1,0,0]=3 204 B4R0.1 CC(O)CCl MC20696 [1,1,0,0,0,0|1,0,0]=3 205 B4R0.1 CC(O)CCl MC20697 [1,1,0,0,0,0|1,0,0]=3 206 B4R0.1 CC(O)CN CS14075 [1,1,0,0,0,0|0,0,0]=2 207 B4R0.1 CC(O)CO MC20330 [1,1,0,0,0,0|1,0,0]=3 208 B4R0.1 CCB(O)O CS13979 [1,1,0,0,0,0|2,0,0]=4 209 B4R0.1 CCC(C)O MC10786 [1,1,0,0,0,0|0,0,0]=2 210 B4R0.1 CCC(N)=O CS11886 [1,1,0,0,0,0|0,0,1]=3 211 B4R0.1 CNC(N)=O MC10792 [1,1,0,0,0,0|1,0,1]=4 212 B4R0.1 CNC(N)=S CS11797 [1,1,0,0,0,0|1,0,1]=4 213 B4R0.1 COC(N)=O CS11667 [1,1,0,0,0,0|1,0,1]=4 214 B4R0.1 COC(N)=[NH2+] CS11820 [1,1,0,0,0,0|1,0,1]=4 215 B4R0.1 CSC(=N)N MC41956 [1,1,0,0,0,0|1,0,1]=4 216 B4R0.1 C\C=C(/C)Br MC10255 [1,1,0,0,0,0|0,0,2]=4 217 B4R0.1 FC(F)CBr MC429454 [1,1,0,0,0,0|2,0,0]=4 218 B4R0.1 FC(F)CI MC429447 [1,1,0,0,0,0|2,0,0]=4 219 B4R0.1 NC(=O)CBr CS21389 [1,1,0,0,0,0|1,0,1]=4 220 B4R0.1 NCC(=O)O CS19951 [1,1,0,0,0,0|1,0,1]=4 221 B4R0.1 NCC(=O)[O-] CS10910 [1,1,0,0,0,0|1,0,1]=4 222 B4R0.1 NCC(=O)[O-] MC20522 [1,1,0,0,0,0|1,0,1]=4 223 B4R0.1 NCC(F)F MC429451 [1,1,0,0,0,0|1,0,0]=3 224 B4R0.1 NCC(N)=O CS13806 [1,1,0,0,0,0|1,0,1]=4 225 B4R0.1 NCC(N)=O MC437712 [1,1,0,0,0,0|1,0,1]=4 226 B4R0.1 NCS(=O)[O-] MC105927 [1,1,0,0,0,0|2,0,0]=4 227 B4R0.1 OCC(F)F CS20974 [1,1,0,0,0,0|2,0,0]=4 228 B6R0.1 CCC(C)CCBr MC112369 [0,2,0,0,0,0|1,0,0]=3 229 B6R0.1 CCCC(=O)NN CS22544 [0,2,0,0,0,0|0,0,1]=3 230 B6R0.1 CCCC(C)CBr MC112368 [0,2,0,0,0,0|1,0,0]=3 231 B6R0.1 CCCC(O)CO CS20495 [0,2,0,0,0,0|1,0,0]=3 232 B6R0.1 CCNC(=O)NC MC428152 [0,2,0,0,0,0|1,0,1]=4 233 B6R0.1 CCOC(=O)CBr MC41907 [0,2,0,0,0,0|1,0,1]=4 234 B6R0.1 CCOC(=O)CCl MC41910 [0,2,0,0,0,0|1,0,1]=4 235 B6R0.1 CCOC(=O)CN CS15347 [0,2,0,0,0,0|0,0,1]=3 236 B6R0.1 CCOC(=O)CO CS11386 [0,2,0,0,0,0|1,0,1]=4 237 B6R0.1 CCOC(=O)NN CS11383 [0,2,0,0,0,0|1,0,1]=4 238 B6R0.1 CNC(=O)CCN MC112263 [0,2,0,0,0,0|0,0,1]=3 239 B6R0.1 CNCC(=O)OC MC438154 [0,2,0,0,0,0|1,0,1]=4 240 B6R0.1 COC(=O)CCBr CS18993 [0,2,0,0,0,0|1,0,1]=4 241 B6R0.1 COC(=O)CCN CS22266 [0,2,0,0,0,0|0,0,1]=3 242 B6R0.1 COCC(=O)NN CS11580 [0,2,0,0,0,0|1,0,1]=4 243 B6R0.1 N#CCC(O)CCl CS22599 [0,2,0,0,0,0|0,0,2]=4 244 B6R0.1 OC(CBr)CCBr MC107100 [0,2,0,0,0,0|1,0,0]=3 245 B6R0.1 OC(CBr)CCBr MC107101 [0,2,0,0,0,0|1,0,0]=3 246 B6R0.1 OCCC(O)CO MC42234 [0,2,0,0,0,0|1,0,0]=3 247 B6R0.1 [NH3+]CCC(F)C[NH3+] MC112759 [0,2,0,0,0,0|0,0,1]=3 248 B6R0.2 CC(Br)CC(=O)O MC106689 [0,2,0,0,0,0|1,0,1]=4 249 B6R0.2 CC(Br)CC(N)=S MC106193 [0,2,0,0,0,0|0,0,1]=3 250 B6R0.2 CC(C)CB(O)O CS22276 [0,2,0,0,0,0|2,0,0]=4 251 B6R0.2 CC(C)PC(C)C MC444830 [0,2,0,0,0,0|2,0,0]=4 252 B6R0.2 CC(N)CC(=O)O CS19028 [0,2,0,0,0,0|1,0,1]=4 253 B6R0.2 CC(N)CC(=O)O CS20346 [0,2,0,0,0,0|1,0,1]=4 254 B6R0.2 CC(N)CC(=O)O MC439098 [0,2,0,0,0,0|1,0,1]=4 255 B6R0.2 CC(O)CC(=O)O MC426020 [0,2,0,0,0,0|1,0,1]=4 256 B6R0.2 CC(O)CC(=O)O MC426021 [0,2,0,0,0,0|1,0,1]=4 257 B6R0.2 CC(O)CC(=O)[O-] CS20253 [0,2,0,0,0,0|1,0,1]=4 258 B6R0.2 CN(C)CC(N)=S CS15155 [0,2,0,0,0,0|1,0,1]=4 259 B6R0.2 NC([SeH])CC(=O)O MC435590 [0,2,0,0,0,0|1,0,1]=4 260 B6R0.2 NC([SeH])CC(=O)O MC435591 [0,2,0,0,0,0|1,0,1]=4 261 B6R0.3 CC(C)C(C)CO MC113312 [0,2,0,0,0,0|1,0,0]=3 262 B6R0.3 CC(C)C(N)CO CS17224 [0,2,0,0,0,0|1,0,0]=3 263 B6R0.3 CC(C)C(N)CO CS22659 [0,2,0,0,0,0|1,0,0]=3 264 B6R0.3 CC(CN)C(=O)O MC105846 [0,2,0,0,0,0|1,0,1]=4 265 B6R0.3 CC(CN)C(=O)O MC105847 [0,2,0,0,0,0|1,0,1]=4 266 B6R0.3 CC(O)C(N)CO MC438221 [0,2,0,0,0,0|1,0,0]=3 267 B6R0.3 CCC(Br)C(=O)O MC426015 [0,2,0,0,0,0|1,0,1]=4 268 B6R0.3 CCC(Cl)C(=O)O MC426016 [0,2,0,0,0,0|1,0,1]=4 269 B6R0.3 CCC(N)B(O)O MC442680 [0,2,0,0,0,0|2,0,0]=4 270 B6R0.3 CCC(N)B(O)O MC442681 [0,2,0,0,0,0|2,0,0]=4 271 B6R0.3 CCC(N)C(=O)O CS13661 [0,2,0,0,0,0|1,0,1]=4 272 B6R0.3 CCC(N)C(=O)O CS14054 [0,2,0,0,0,0|1,0,1]=4 273 B6R0.3 CCC(N)C(=O)O CS14084 [0,2,0,0,0,0|1,0,1]=4 274 B6R0.3 CCC(N)C(N)=O CS15891 [0,2,0,0,0,0|0,0,1]=3 275 B6R0.3 CCC(N)C(N)=O MC436006 [0,2,0,0,0,0|0,0,1]=3 276 B6R0.3 CN(C)C(=O)CN CS21306 [0,2,0,0,0,0|1,0,1]=4 277 B6R0.3 CN(C)C(=O)CN MC116188 [0,2,0,0,0,0|1,0,1]=4 278 B6R0.3 CN(C)C(=O)CN MC437713 [0,2,0,0,0,0|1,0,1]=4 279 B6R0.3 CNC(=O)C(C)N MC436151 [0,2,0,0,0,0|1,0,1]=4 280 B6R0.3 COC(=O)C(C)N CS14901 [0,2,0,0,0,0|1,0,1]=4 281 B6R0.3 COC(=O)C(C)N CS16663 [0,2,0,0,0,0|1,0,1]=4 282 B6R0.3 COC(=O)C(C)N CS22242 [0,2,0,0,0,0|1,0,1]=4 283 B6R0.3 NC(=O)C(N)CO MC438160 [0,2,0,0,0,0|1,0,1]=4 284 B6R0.3 NCC(N)C(=O)O CS14756 [0,2,0,0,0,0|1,0,1]=4 285 B6R0.3 NCC(N)C(=O)O CS19624 [0,2,0,0,0,0|1,0,1]=4 286 B6R0.3 NCC(N)C(=O)O CS19672 [0,2,0,0,0,0|1,0,1]=4 287 B6R0.3 NCC(O)C(=O)O CS20294 [0,2,0,0,0,0|1,0,1]=4 288 B6R0.3 NCC(O)C(=O)O MC437816 [0,2,0,0,0,0|1,0,1]=4 289 B6R0.4 C#CCCC(N)=O MC106194 [0,2,0,0,0,0|0,0,2]=4 290 B6R0.4 CC(=O)CCCBr CS10305 [0,2,0,0,0,0|1,0,0]=3 291 B6R0.4 CC(=O)CCCCl CS10334 [0,2,0,0,0,0|1,0,0]=3 292 B6R0.4 CC(=O)NCCCl MC33011 [0,2,0,0,0,0|1,0,1]=4 293 B6R0.4 CC(C)CCC=O MC428026 [0,2,0,0,0,0|1,0,0]=3 294 B6R0.4 CC(C)CCCO MC428025 [0,2,0,0,0,0|1,0,0]=3 295 B6R0.4 CC(C)NCCN MC20461 [0,2,0,0,0,0|0,0,0]=2 296 B6R0.4 CCCCC(=O)Cl MC40508 [0,2,0,0,0,0|1,0,0]=3 297 B6R0.4 CN(C)CCCBr CS22184 [0,2,0,0,0,0|1,0,0]=3 298 B6R0.4 CN(C)CCCCl CS13505 [0,2,0,0,0,0|1,0,0]=3 299 B6R0.4 CN(C)CCCCl CS14943 [0,2,0,0,0,0|1,0,0]=3 300 B6R0.4 CNCCN(C)C CS11723 [0,2,0,0,0,0|1,0,0]=3 301 B6R0.4 CNCCN(C)C CS15131 [0,2,0,0,0,0|1,0,0]=3 302 B6R0.4 NCCCC(=O)O CS14998 [0,2,0,0,0,0|0,0,1]=3 303 B6R0.4 NCCCC(N)=O MC112262 [0,2,0,0,0,0|0,0,1]=3 304 B6R0.4 O=C(Cl)CCCCl MC40450 [0,2,0,0,0,0|1,0,1]=4 305 B6R0.4 O=C(O)CCCBr CS14053 [0,2,0,0,0,0|1,0,1]=4 306 B6R0.5 CC(C)(C)CC=O MC20142 [0,2,0,0,0,0|1,0,1]=4 307 B6R0.5 CC(C)(C)CCO CS21905 [0,2,0,0,0,0|1,0,0]=3 308 B6R0.5 CC(C)(F)CCN MC116087 [0,2,0,0,0,0|0,0,0]=2 309 B6R0.5 CC(C)(O)CCBr CS15788 [0,2,0,0,0,0|1,0,0]=3 310 B6R0.5 CC(C)(O)CON MC427561 [0,2,0,0,0,0|1,0,0]=3 311 B6R0.5 CCCS(=O)(=O)Cl MC20992 [0,2,0,0,0,0|2,0,0]=4 312 B6R0.5 CCCS(=O)(=O)O MC32073 [0,2,0,0,0,0|2,0,0]=4 313 B6R0.5 CCCS(=O)(=O)[O-] MC32074 [0,2,0,0,0,0|2,0,0]=4 314 B6R0.5 CCCS(N)(=O)=O MC32075 [0,2,0,0,0,0|1,0,0]=3 315 B6R0.5 CS(=O)(=O)CCN CS21301 [0,2,0,0,0,0|1,0,0]=3 316 B6R0.5 FC(F)(F)CCI MC20958 [0,2,0,0,0,0|2,0,0]=4 317 B6R0.5 NCCC(F)(F)F CS14596 [0,2,0,0,0,0|1,0,0]=3 318 B6R0.5 NNCC(F)(F)F MC429158 [0,2,0,0,0,0|2,0,0]=4 319 B6R0.5 NOCC(F)(F)F MC429985 [0,2,0,0,0,0|2,0,0]=4 320 B6R0.6 BrCCCCCBr MC41886 [0,2,0,0,0,0|1,0,0]=3 321 B6R0.6 BrCCNCCBr CS11032 [0,2,0,0,0,0|1,0,0]=3 322 B6R0.6 C#CCCCCO MC424004 [0,2,0,0,0,0|1,0,0]=3 323 B6R0.6 C=CCCCCCl MC427568 [0,2,0,0,0,0|1,0,0]=3 324 B6R0.6 C=CCCCCN MC111853 [0,2,0,0,0,0|0,0,0]=2 325 B6R0.6 C=CCCCCO CS10397 [0,2,0,0,0,0|1,0,0]=3 326 B6R0.6 C=CCCC[Zn]Br MC121349 [0,2,0,0,0,0|1,0,1]=4 327 B6R0.6 C=COCCCN MC41859 [0,2,0,0,0,0|0,0,1]=3 328 B6R0.6 C=COCCON MC106384 [0,2,0,0,0,0|0,0,2]=4 329 B6R0.6 CCCOCCCl MC428009 [0,2,0,0,0,0|1,0,0]=3 330 B6R0.6 COCCCC=O MC111975 [0,2,0,0,0,0|1,0,0]=3 331 B6R0.6 COCCCCBr CS22933 [0,2,0,0,0,0|1,0,0]=3 332 B6R0.6 COCCCCCl MC428014 [0,2,0,0,0,0|1,0,0]=3 333 B6R0.6 ClCCNCCCl CS16038 [0,2,0,0,0,0|1,0,0]=3 334 B6R0.6 ClCCOCCCl MC41873 [0,2,0,0,0,0|1,0,0]=3 335 B6R0.6 FCCCCCBr CS14708 [0,2,0,0,0,0|1,0,0]=3 336 B6R0.6 FCCCC[Mg]Br MC116032 [0,2,0,0,0,0|1,0,0]=3 337 B6R0.6 N#CCCCCCl CS10359 [0,2,0,0,0,0|0,0,1]=3 338 B6R0.6 NCCCCCN CS19074 [0,2,0,0,0,0|0,0,0]=2 339 B6R0.6 OCCCCCCl CS14778 [0,2,0,0,0,0|1,0,0]=3 340 B6R0.6 OCCCCCO CS20549 [0,2,0,0,0,0|1,0,0]=3 341 B6R0.6 OCCOCCO MC41893 [0,2,0,0,0,0|1,0,0]=3 342 B6R0.6 SCCOCCS MC112783 [0,2,0,0,0,0|1,0,0]=3 343 B6R0.8 C#CC(C)(N)CC CS22059 [0,2,0,0,0,0|1,0,1]=4 344 B6R0.8 CC(C)(CBr)CBr CS20516 [0,2,0,0,0,0|2,0,0]=4 345 B6R0.8 CC(C)(CN)CO CS22037 [0,2,0,0,0,0|1,0,0]=3 346 B6R0.8 CCC(Br)(Br)C=O MC106928 [0,2,0,0,0,0|1,0,1]=4 347 B6R0.8 CCC(C)(N)C#N CS17000 [0,2,0,0,0,0|0,0,2]=4 348 B6R0.8 NCC(F)(F)CO MC444228 [0,2,0,0,0,0|1,0,0]=3 349 B6R0.9 CCN(CC)CC MC426119 [0,2,0,0,0,0|2,0,0]=4 350 B6R0.9 CCP(CC)CC MC444861 [0,2,0,0,0,0|2,0,0]=4 351 B6R0.9 CCP(CC)CC MC444910 [0,2,0,0,0,0|2,0,0]=4 352 B6R0.9 CC[SiH](CC)CC MC41948 [0,2,0,0,0,0|1,1,0]=4 353 B6R0.9 COC(CBr)OC MC428001 [0,2,0,0,0,0|2,0,0]=4 354 B6R0.9 COC(CCl)OC MC428004 [0,2,0,0,0,0|2,0,0]=4 355 B6R0.9 COC(CN)OC MC428005 [0,2,0,0,0,0|1,0,0]=3 356 B4R1.1 C1CNC1 CS14211 [1,0,0,1,0,0|0,0,0]=2 357 B4R1.1 C1CNC1 MC445038 [1,0,0,1,0,0|0,0,0]=2 358 B4R1.2 BrC1CC1 CS19063 [1,0,0,1,0,0|1,0,0]=3 359 B4R1.2 CC1=CC1 MC20873 [1,0,0,1,0,0|0,0,2]=4 360 B4R1.2 CC1CO1 MC428272 [1,0,0,1,0,0|1,0,0]=3 361 B4R1.2 OC1CC1 MC443565 [1,0,0,1,0,0|1,0,0]=3 362 B6R1.2 BrC1CCNC1 CS15742 [0,1,0,1,0,0|0,0,0]=2 363 B6R1.2 BrC1CCOC1 CS14643 [0,1,0,1,0,0|1,0,0]=3 364 B6R1.2 CC1=NCCC1 CS21664 [0,1,0,1,0,0|0,0,1]=3 365 B6R1.2 CC1CCCN1 CS18299 [0,1,0,1,0,0|0,0,0]=2 366 B6R1.2 CC1CCCN1 CS18800 [0,1,0,1,0,0|0,0,0]=2 367 B6R1.2 CC1CCCN1 CS19735 [0,1,0,1,0,0|0,0,0]=2 368 B6R1.2 CC1CCCN1 CS21699 [0,1,0,1,0,0|0,0,0]=2 369 B6R1.2 CC1CCCN1 CS21700 [0,1,0,1,0,0|0,0,0]=2 370 B6R1.2 CC1CCCN1 MC428345 [0,1,0,1,0,0|0,0,0]=2 371 B6R1.2 CC1CCCO1 MC20580 [0,1,0,1,0,0|1,0,0]=3 372 B6R1.2 FC1CCNC1 CS12894 [0,1,0,1,0,0|0,0,0]=2 373 B6R1.2 FC1CCNC1 CS14870 [0,1,0,1,0,0|0,0,0]=2 374 B6R1.2 FC1CCNC1 MC31003 [0,1,0,1,0,0|0,0,0]=2 375 B6R1.2 IC1CCOC1 MC101926 [0,1,0,1,0,0|1,0,0]=3 376 B6R1.2 NC1=NCCC1 CS19310 [0,1,0,1,0,0|0,0,1]=3 377 B6R1.2 NC1CC=CC1 CS19415 [0,1,0,1,0,0|0,0,1]=3 378 B6R1.2 NC1CCOC1 CS12010 [0,1,0,1,0,0|0,0,0]=2 379 B6R1.2 NC1CCOC1 CS13003 [0,1,0,1,0,0|0,0,0]=2 380 B6R1.2 NC1CCOC1 CS20366 [0,1,0,1,0,0|0,0,0]=2 381 B6R1.2 NC1CCOC1 MC443324 [0,1,0,1,0,0|0,0,0]=2 382 B6R1.2 NC1CCOC1 MC444237 [0,1,0,1,0,0|0,0,0]=2 383 B6R1.2 O=C1CCCC1 MC21085 [0,1,0,1,0,0|1,0,0]=3 384 B6R1.2 O=C1CCNC1 CS22412 [0,1,0,1,0,0|0,0,1]=3 385 B6R1.2 O=C1CCOC1 CS18178 [0,1,0,1,0,0|1,0,1]=4 386 B6R1.2 O=C1CCSC1 MC20305 [0,1,0,1,0,0|1,0,1]=4 387 B6R1.2 O=C1CNCN1 CS15654 [0,1,0,1,0,0|1,0,1]=4 388 B6R1.2 O=C1NCCN1 CS21607 [0,1,0,1,0,0|1,0,1]=4 389 B6R1.2 O=C1NCCS1 CS20525 [0,1,0,1,0,0|1,0,1]=4 390 B6R1.2 OC1CC=CC1 MC10342 [0,1,0,1,0,0|1,0,1]=4 391 B6R1.2 OC1CCNC1 CS16166 [0,1,0,1,0,0|0,0,0]=2 392 B6R1.2 OC1CCNC1 CS16635 [0,1,0,1,0,0|0,0,0]=2 393 B6R1.2 OC1CCNC1 CS16650 [0,1,0,1,0,0|0,0,0]=2 394 B6R1.2 OC1CCNC1 CS17407 [0,1,0,1,0,0|0,0,0]=2 395 B6R1.2 OC1CCNC1 CS21757 [0,1,0,1,0,0|0,0,0]=2 396 B6R1.2 OC1CCOC1 CS20284 [0,1,0,1,0,0|1,0,0]=3 397 B6R1.2 OC1CCOC1 MC42235 [0,1,0,1,0,0|1,0,0]=3 398 B6R1.2 OC1CCOC1 MC444279 [0,1,0,1,0,0|1,0,0]=3 399 B6R1.3 N#CCC1CC1 MC433947 [0,1,0,1,0,0|0,0,1]=3 400 B6R1.3 NCCC1CC1 MC425320 [0,1,0,1,0,0|0,0,0]=2 401 B6R1.3 NCCN1CC1 MC100405 [0,1,0,1,0,0|0,0,0]=2 402 B6R1.3 NOCC1CC1 MC107884 [0,1,0,1,0,0|0,0,0]=2 403 B6R1.3 O=C=NC1CC1 MC418391 [0,1,0,1,0,0|1,0,1]=4 404 B6R1.3 OCCC1CC1 MC433884 [0,1,0,1,0,0|1,0,0]=3 405 B6R1.5 CC1CC(N)C1 MC105778 [0,1,0,1,0,0|0,0,0]=2 406 B6R1.5 CN1CC(N)C1 MC444125 [0,1,0,1,0,0|1,0,0]=3 407 B6R1.5 CN1CC(O)C1 MC444271 [0,1,0,1,0,0|2,0,0]=4 408 B6R1.5 CN1CC(O)C1 MC444272 [0,1,0,1,0,0|2,0,0]=4 409 B6R1.5 NC1CC(=O)C1 MC444232 [0,1,0,1,0,0|0,0,1]=3 410 B6R1.5 NC1CC(F)C1 MC101921 [0,1,0,1,0,0|0,0,0]=2 411 B6R1.5 NC1CC(F)C1 MC104866 [0,1,0,1,0,0|0,0,0]=2 412 B6R1.5 NC1CC(F)C1 MC104867 [0,1,0,1,0,0|0,0,0]=2 413 B6R1.5 NC1CC(F)C1 MC112996 [0,1,0,1,0,0|0,0,0]=2 414 B6R1.5 NC1CC(F)C1 MC115644 [0,1,0,1,0,0|0,0,0]=2 415 B6R1.5 NC1CC(F)C1 MC444599 [0,1,0,1,0,0|0,0,0]=2 416 B6R1.5 NC1CC(N)C1 MC103595 [0,1,0,1,0,0|0,0,0]=2 417 B6R1.5 NC1CC(N)C1 MC103596 [0,1,0,1,0,0|0,0,0]=2 418 B6R1.5 NC1CC(N)C1 MC103597 [0,1,0,1,0,0|0,0,0]=2 419 B6R1.5 NC1CC(N)C1 MC103598 [0,1,0,1,0,0|0,0,0]=2 420 B6R1.5 NC1CC(N)C1 MC104654 [0,1,0,1,0,0|0,0,0]=2 421 B6R1.5 NC1CC(O)C1 MC105248 [0,1,0,1,0,0|0,0,0]=2 422 B6R1.5 NC1CC(O)C1 MC105286 [0,1,0,1,0,0|0,0,0]=2 423 B6R1.5 NC1CC(O)C1 MC444231 [0,1,0,1,0,0|0,0,0]=2 424 B6R1.5 NC1CC(O)C1 MC444480 [0,1,0,1,0,0|0,0,0]=2 425 B6R1.5 NC1CC(O)C1 MC444598 [0,1,0,1,0,0|0,0,0]=2 426 B6R1.5 O=C1CC(F)C1 MC104154 [0,1,0,1,0,0|1,0,1]=4 427 B6R1.5 OC1CC(F)C1 MC103711 [0,1,0,1,0,0|1,0,0]=3 428 B6R1.5 OC1CC(F)C1 MC104375 [0,1,0,1,0,0|1,0,0]=3 429 B6R1.5 OC1CC(F)C1 MC104868 [0,1,0,1,0,0|1,0,0]=3 430 B6R1.8 N#CC1CC1F MC102844 [0,1,0,1,0,0|0,0,2]=4 431 B6R1.8 N#CC1CC1F MC102845 [0,1,0,1,0,0|0,0,2]=4 432 B6R1.8 OCC1CC1F MC102847 [0,1,0,1,0,0|1,0,0]=3 433 B6R1.8 OCC1CC1F MC102848 [0,1,0,1,0,0|1,0,0]=3 434 B6R1.8 OCC1CC1F MC102849 [0,1,0,1,0,0|1,0,0]=3 435 B6R1.8 OCC1CC1F MC102850 [0,1,0,1,0,0|1,0,0]=3 436 B6R1.9 NC1CC1(F)F MC431141 [0,1,0,1,0,0|1,0,0]=3 437 B6R1.10 CC1(F)CNC1 MC102153 [0,1,0,1,0,0|2,0,0]=4 438 B6R1.10 CC1(N)COC1 CS14859 [0,1,0,1,0,0|1,0,0]=3 439 B6R1.10 CC1(N)COC1 MC444292 [0,1,0,1,0,0|1,0,0]=3 440 B6R1.10 CC1(N)CSC1 MC113158 [0,1,0,1,0,0|1,0,0]=3 441 B6R1.10 CC1(O)CNC1 CS15502 [0,1,0,1,0,0|2,0,0]=4 442 B6R1.10 FC1(F)CNC1 CS21899 [0,1,0,1,0,0|2,0,0]=4 443 B6R1.11 CC(I)C1CC1 MC429998 [0,1,0,1,0,0|1,0,0]=3 444 B6R1.11 CC(N)C1CC1 MC428207 [0,1,0,1,0,0|0,0,0]=2 445 B6R1.11 N=C(N)C1CC1 CS16535 [0,1,0,1,0,0|0,0,1]=3 446 B6R1.11 NC(=O)C1CC1 CS16456 [0,1,0,1,0,0|0,0,1]=3 447 B6R1.11 NC(=S)C1CC1 MC21067 [0,1,0,1,0,0|0,0,1]=3 448 B6R1.11 O=C(Cl)C1CC1 MC434039 [0,1,0,1,0,0|1,0,1]=4 449 B6R1.11 O=C(O)C1CC1 CS13839 [0,1,0,1,0,0|1,0,1]=4 450 B6R1.11 OB(O)C1CC1 MC20194 [0,1,0,1,0,0|2,0,0]=4 451 B6R1.1 C1=CCNCC1 MC444071 [0,1,0,1,0,0|0,0,1]=3 452 B6R1.1 C1=CCOCC1 MC427315 [0,1,0,1,0,0|1,0,1]=4 453 B6R1.1 C1=CCSCC1 MC427366 [0,1,0,1,0,0|1,0,1]=4 454 B6R1.1 C1=COCCC1 MC20500 [0,1,0,1,0,0|1,0,1]=4 455 B6R1.1 C1CCCCC1 MC41853 [0,1,0,1,0,0|1,0,0]=3 456 B6R1.1 C1CCNNC1 CS17893 [0,1,0,1,0,0|0,0,0]=2 457 B6R1.1 C1CC[NH2+]CC1 CS16333 [0,1,0,1,0,0|0,0,1]=3 458 B6R1.1 C1CNCCN1 MC41703 [0,1,0,1,0,0|0,0,0]=2 459 B6R1.1 C1COCCN1 MC20726 [0,1,0,1,0,0|0,0,0]=2 460 B6R1.1 C1CSCCN1 MC20759 [0,1,0,1,0,0|0,0,0]=2 461 B6R1.4 CC1COC1=O MC121237 [0,1,0,1,0,0|1,0,1]=4 462 B6R1.4 NC1CCC1O MC111877 [0,1,0,1,0,0|0,0,0]=2 463 B6R1.6 BrCC1CCC1 MC10470 [0,1,0,1,0,0|1,0,0]=3 464 B6R1.6 BrCC1CCO1 MC444177 [0,1,0,1,0,0|1,0,0]=3 465 B6R1.6 CNC1CNC1 MC444567 [0,1,0,1,0,0|1,0,0]=3 466 B6R1.6 CNC1COC1 MC425340 [0,1,0,1,0,0|1,0,0]=3 467 B6R1.6 CNC1COC1 MC444120 [0,1,0,1,0,0|1,0,0]=3 468 B6R1.6 COC1CNC1 CS17370 [0,1,0,1,0,0|1,0,0]=3 469 B6R1.6 Cl[Zn]C1CCC1 MC121327 [0,1,0,1,0,0|1,0,0]=3 470 B6R1.6 ICC1COC1 MC101907 [0,1,0,1,0,0|1,0,0]=3 471 B6R1.6 N#CC1CNC1 CS10942 [0,1,0,1,0,0|0,0,2]=4 472 B6R1.6 NCC1CCC1 CS11178 [0,1,0,1,0,0|0,0,0]=2 473 B6R1.6 NCC1CCN1 MC121273 [0,1,0,1,0,0|0,0,0]=2 474 B6R1.6 NCC1CCO1 MC121118 [0,1,0,1,0,0|0,0,0]=2 475 B6R1.6 NCC1CNC1 MC105370 [0,1,0,1,0,0|0,0,0]=2 476 B6R1.6 NCC1COC1 MC10517 [0,1,0,1,0,0|0,0,0]=2 477 B6R1.6 NCC1CSC1 MC121257 [0,1,0,1,0,0|0,0,0]=2 478 B6R1.6 NNC1CCC1 MC111229 [0,1,0,1,0,0|0,0,0]=2 479 B6R1.6 NNC1COC1 MC111202 [0,1,0,1,0,0|1,0,0]=3 480 B6R1.6 OCC1CCN1 CS15230 [0,1,0,1,0,0|0,0,0]=2 481 B6R1.6 OCC1CCN1 MC102029 [0,1,0,1,0,0|0,0,0]=2 482 B6R1.6 OCC1CCN1 MC102030 [0,1,0,1,0,0|0,0,0]=2 483 B6R1.6 OCC1CCO1 CS15009 [0,1,0,1,0,0|1,0,0]=3 484 B6R1.6 OCC1CNC1 CS12891 [0,1,0,1,0,0|1,0,0]=3 485 B6R1.6 OCC1CNC1 MC444028 [0,1,0,1,0,0|1,0,0]=3 486 B6R1.6 OCC1COC1 CS14670 [0,1,0,1,0,0|1,0,0]=3 487 B6R1.7 C#CC1(N)CC1 MC21061 [0,1,0,1,0,0|1,0,1]=4 488 B6R1.7 N#CC1(N)CC1 CS13582 [0,1,0,1,0,0|0,0,2]=4 489 B6R1.7 NC1(CF)CC1 MC107347 [0,1,0,1,0,0|1,0,0]=3 490 B6R1.7 NC1(CO)CC1 CS13349 [0,1,0,1,0,0|1,0,0]=3 491 B6R1.7 NC1(CO)CC1 MC113084 [0,1,0,1,0,0|1,0,0]=3 492 B6R1.7 NCC1(O)CC1 CS20441 [0,1,0,1,0,0|0,0,0]=2