0 B5R0.1 C=C(C)C[Mg]Cl M10078985P [0,0,0,0,0,0|3,0,1]=4 1 B5R0.1 C=C(OCC)C M10023218P [0,0,0,0,0,0|2,0,1]=3 2 B5R0.1 C=COC(C)C M10023217P [0,0,0,0,0,0|2,0,2]=4 3 B5R0.1 CC(C)=CCCl M10012522P [0,0,0,0,0,0|2,0,1]=3 4 B5R0.1 CC(CC#N)=O M10044340P [0,0,0,0,0,0|1,0,2]=3 5 B5R0.1 CC(CCCl)=O M10089400P [0,0,0,0,0,0|1,0,2]=3 6 B5R0.1 CC(COC)=O M10081509P [0,0,0,0,0,0|1,0,1]=2 7 B5R0.1 CC(N)CCC M10393249P [0,0,0,0,0,0|1,0,3]=4 8 B5R0.1 CC(OC=O)=O M10041862P [0,0,0,0,0,0|2,0,0]=2 9 B5R0.1 CC(OCC)=N M10041195P [0,0,0,0,0,0|2,0,1]=3 10 B5R0.1 CSCS(C)=O M10220911P [0,0,0,0,0,0|2,0,1]=3 11 B5R0.1 C[C@@H](O)COC M10067779P [0,0,0,0,0,0|1,0,3]=4 12 B5R0.1 C[C@H](O)COC M10194416P [0,0,0,0,0,0|1,0,3]=4 13 B5R0.1 C[SiH](OCC)C M10133661P [0,0,0,0,0,0|2,1,1]=4 14 B5R0.1 C\C=C\C(Cl)=O M10016774P [0,0,0,0,0,0|1,0,0]=1 15 B5R0.1 C\C=C\C(Cl)=O M10115520P [0,0,0,0,0,0|1,0,0]=1 16 B5R0.1 ClCOC(C)=O M10016791P [0,0,0,0,0,0|2,0,1]=3 17 B5R0.1 NC(OCC)=N M10213773P [0,0,0,0,0,0|3,0,1]=4 18 B5R0.1 O=C(Cl)OCCl M10173503P [0,0,0,0,0,0|3,0,1]=4 19 B5R0.1 O=C(O)CCF M10011311P [0,0,0,0,0,0|2,0,2]=4 20 B5R0.1 O=C(O)CCO M10012525P [0,0,0,0,0,0|2,0,2]=4 21 B5R0.1 O=C([O-])CNC M10061947P [0,0,0,0,0,0|2,0,1]=3 22 B4R0.1 C#CC(N)=O M10104034P [1,0,0,0,0,0|1,0,2]=4 23 B4R0.1 C=C(C)C=O M10001153P [1,0,0,0,0,0|2,0,0]=3 24 B4R0.1 C=C(C)CBr M10031081P [1,0,0,0,0,0|2,0,1]=4 25 B4R0.1 C=CC(Cl)C M10014214P [1,0,0,0,0,0|1,0,1]=3 26 B4R0.1 C=CC([O-])=O M10105582P [1,0,0,0,0,0|1,0,0]=2 27 B4R0.1 C=CC([O-])=O M10132485P [1,0,0,0,0,0|1,0,0]=2 28 B4R0.1 C=C[N+]([O-])=O M10056294P [1,0,0,0,0,0|2,0,0]=3 29 B4R0.1 CC(C)=CBr M10050220P [1,0,0,0,0,0|2,0,0]=3 30 B4R0.1 CC(CCl)=O M10001162P [1,0,0,0,0,0|1,0,1]=3 31 B4R0.1 CC(CN)=O M10110205P [1,0,0,0,0,0|1,0,1]=3 32 B4R0.1 CC(O)C=C M10195978P [1,0,0,0,0,0|0,0,2]=3 33 B4R0.1 CC(SC)=O M10032388P [1,0,0,0,0,0|1,0,0]=2 34 B4R0.1 CCC(N)=S M10017126P [1,0,0,0,0,0|1,1,1]=4 35 B4R0.1 CCC([O-])=O M10205103P [1,0,0,0,0,0|1,0,1]=3 36 B4R0.1 CCN(C)C M10015350P [1,0,0,0,0,0|2,0,1]=4 37 B4R0.1 CNC(C)C M10065934P [1,0,0,0,0,0|2,0,1]=4 38 B4R0.1 C[C@@H](N)CC M10122112P [1,0,0,0,0,0|1,0,2]=4 39 B4R0.1 C[C@@H](O)CC M10133832P [1,0,0,0,0,0|0,0,3]=4 40 B4R0.1 C[SiH](OC)C M10152986P [1,0,0,0,0,0|2,1,0]=4 41 B4R0.1 C\C(Br)=C\C M12004205P [1,0,0,0,0,0|1,0,0]=2 42 B4R0.1 C\C(N)=N\O M10173143P [1,0,0,0,0,0|3,0,0]=4 43 B4R0.1 NC(NC)=N M10171679P [1,0,0,0,0,0|3,0,0]=4 44 B4R0.1 NC(NC)=N M10176185P [1,0,0,0,0,0|3,0,0]=4 45 B4R0.1 NC(SC)=N M10131709P [1,0,0,0,0,0|3,0,0]=4 46 B4R0.1 NCC([O-])=O M10102492P [1,0,0,0,0,0|2,0,1]=4 47 B4R0.1 NCC([O-])=O M10164487P [1,0,0,0,0,0|2,0,1]=4 48 B4R0.1 NCC([O-])=O M10229094P [1,0,0,0,0,0|2,0,1]=4 49 B4R0.1 NNC(N)=O M10000401P [1,0,0,0,0,0|3,0,0]=4 50 B4R0.1 O=C(C)C=C M10001161P [1,0,0,0,0,0|0,0,0]=1 51 B4R0.1 O=C(Cl)CBr M10173456P [1,0,0,0,0,0|2,0,1]=4 52 B4R0.1 O=C(Cl)CF M10009145P [1,0,0,0,0,0|2,0,1]=4 53 B4R0.1 O=C(N)CF M10017415P [1,0,0,0,0,0|2,0,1]=4 54 B4R0.1 O=C(N)CN M10015343P [1,0,0,0,0,0|2,0,1]=4 55 B4R0.1 O=C([O-])CN M10133319P [1,0,0,0,0,0|2,0,1]=4 56 B4R0.1 O=C([O-])CO M10048155P [1,0,0,0,0,0|2,0,1]=4 57 B4R0.1 S=C(N)NC M10015347P [1,0,0,0,0,0|2,1,0]=4 58 B4R0.1 SCC([O-])=O M10194150P [1,0,0,0,0,0|2,0,1]=4 59 B4R0.1 SCC([O-])=O M12278138P [1,0,0,0,0,0|2,0,1]=4 60 B4R0.1 [Li]C(C)CC M10015338P [1,0,0,0,0,0|1,0,2]=4 61 B4R0.1 [NH-]CC(O)=O M12278746P [1,0,0,0,0,0|2,0,1]=4 62 B4R0.2 C(NCC)=O M10016925P [1,0,0,0,0,0|1,0,1]=3 63 B4R0.2 C=CCOC M10016921P [1,0,0,0,0,0|1,0,2]=4 64 B4R0.2 CC[Zn]CC M10014098P [1,0,0,0,0,0|1,0,2]=4 65 B4R0.2 CSCSC M10033691P [1,0,0,0,0,0|2,0,1]=4 66 B4R0.2 C\C=C\C=O M10004592P [1,0,0,0,0,0|0,0,0]=1 67 B4R0.2 C\C=C\CCl M10015079P [1,0,0,0,0,0|1,0,1]=3 68 B4R0.2 C\C=C\OC M10103777P [1,0,0,0,0,0|1,0,0]=2 69 B6R0.1 C=CC(NCC)=O M10081542P [0,1,0,0,0,0|1,0,2]=4 70 B6R0.1 C=CC(OCC)=O M10186126P [0,1,0,0,0,0|1,0,2]=4 71 B6R0.1 CC#CC(OC)=O M10179372P [0,1,0,0,0,0|0,0,2]=3 72 B6R0.1 CCCC(C)C=O M10004549P [0,1,0,0,0,0|0,0,3]=4 73 B6R0.1 CCCC(NN)=O M10055378P [0,1,0,0,0,0|1,0,2]=4 74 B6R0.1 C\C=C\C(OC)=O M10156893P [0,1,0,0,0,0|0,0,0]=1 75 B6R0.1 O=C(C#N)OCC M10016649P [0,1,0,0,0,0|1,0,2]=4 76 B6R0.1 O=C(OC)CCN M10060379P [0,1,0,0,0,0|1,0,2]=4 77 B6R0.1 O=C(OC)C[N+]#[C-] M10240268P [0,1,0,0,0,0|1,0,2]=4 78 B6R0.1 O=C(OC=C)CCl M10186320P [0,1,0,0,0,0|1,0,1]=3 79 B6R0.1 O=C(OCC)CBr M10003242P [0,1,0,0,0,0|1,0,1]=3 80 B6R0.1 O=C(OCC)CN M10011247P [0,1,0,0,0,0|1,0,1]=3 81 B6R0.2 CC(CC(C)=O)=O M10123299P [0,1,0,0,0,0|0,0,1]=2 82 B6R0.2 CC(N)CC(O)=O M10187780P [0,1,0,0,0,0|1,0,2]=4 83 B6R0.2 CC(NC(N)=N)=O M10079352P [0,1,0,0,0,0|2,0,0]=3 84 B6R0.2 CC(O)CC([O-])=O M10005658P [0,1,0,0,0,0|1,0,2]=4 85 B6R0.2 CC(OC(Br)C)=O M10242154P [0,1,0,0,0,0|1,0,1]=3 86 B6R0.2 C[C@@H](O)CC(O)=O M10016803P [0,1,0,0,0,0|1,0,2]=4 87 B6R0.2 C[C@@H](O)CC([O-])=O M10125260P [0,1,0,0,0,0|1,0,2]=4 88 B6R0.2 C[C@H](N)CC(O)=O M10057573P [0,1,0,0,0,0|1,0,2]=4 89 B6R0.2 C[C@H](N)CC(O)=O M10302309P [0,1,0,0,0,0|1,0,2]=4 90 B6R0.2 C[C@H](O)CC(O)=O M10084600P [0,1,0,0,0,0|1,0,2]=4 91 B6R0.2 C[S+](CC([O-])=O)C M10065707P [0,1,0,0,0,0|2,0,1]=4 92 B6R0.2 O=C(Cl)C=C(C)C M10053608P [0,1,0,0,0,0|1,0,0]=2 93 B6R0.2 O=C(N)CC(N)=N M10224228P [0,1,0,0,0,0|2,0,1]=4 94 B6R0.2 O=C([O-])CN(C)C M10154757P [0,1,0,0,0,0|2,0,1]=4 95 B6R0.3 C=C(C#N)C(O)=O M10138630P [0,1,0,0,0,0|2,0,1]=4 96 B6R0.3 C=C(CBr)C(O)=O M10448395P [0,1,0,0,0,0|2,0,1]=4 97 B6R0.3 C=C(F)C(OC)=O M10042642P [0,1,0,0,0,0|2,0,1]=4 98 B6R0.3 CC(C(CBr)=O)=O M10070633P [0,1,0,0,0,0|1,0,1]=3 99 B6R0.3 CC(C(NC)=O)=C M10058367P [0,1,0,0,0,0|2,0,0]=3 100 B6R0.3 CC(C(S)CC)=O M10426560P [0,1,0,0,0,0|0,0,2]=3 101 B6R0.3 CC(C)C(OC)=O M10013809P [0,1,0,0,0,0|2,0,1]=4 102 B6R0.3 CC(N(C)C=C)=O M10052111P [0,1,0,0,0,0|1,0,1]=3 103 B6R0.3 CC(NC)C(O)=O M10015418P [0,1,0,0,0,0|2,0,1]=4 104 B6R0.3 CC(O)C(OC)=O M10013810P [0,1,0,0,0,0|1,0,2]=4 105 B6R0.3 CC(OC)C(O)=O M10062023P [0,1,0,0,0,0|2,0,1]=4 106 B6R0.3 CCC(Br)C(Br)=O M10192304P [0,1,0,0,0,0|1,0,2]=4 107 B6R0.3 CCC(C(O)=O)=C M10055842P [0,1,0,0,0,0|1,0,1]=3 108 B6R0.3 C[C@@H](NC)C(O)=O M10206333P [0,1,0,0,0,0|2,0,1]=4 109 B6R0.3 C[C@H](O)C(OC)=O M10199944P [0,1,0,0,0,0|1,0,2]=4 110 B6R0.3 C\C(C(O)=O)=C\C M10014266P [0,1,0,0,0,0|1,0,0]=2 111 B6R0.3 O=C(N)C(NN)=O M10012868P [0,1,0,0,0,0|3,0,0]=4 112 B6R0.4 C=CCCC(Cl)=O M10240332P [0,1,0,0,0,0|1,0,2]=4 113 B6R0.4 C=C\C=C\C(O)=O M10016890P [0,1,0,0,0,0|1,0,1]=3 114 B6R0.4 CC(CCC=C)=O M10003621P [0,1,0,0,0,0|0,0,2]=3 115 B6R0.4 CC(CCCBr)=O M10058337P [0,1,0,0,0,0|0,0,2]=3 116 B6R0.4 CC(NCCO)=O M10005418P [0,1,0,0,0,0|1,0,1]=3 117 B6R0.4 CC(OCCO)=O M10013697P [0,1,0,0,0,0|1,0,1]=3 118 B6R0.4 CC\C=C\C(O)=O M10016889P [0,1,0,0,0,0|1,0,0]=2 119 B6R0.4 CC\C=C\C([O-])=O M12008293P [0,1,0,0,0,0|1,0,0]=2 120 B6R0.4 O=C(Cl)CCCBr M10023246P [0,1,0,0,0,0|1,0,2]=4 121 B6R0.4 O=C(Cl)OCCCl M10016902P [0,1,0,0,0,0|2,0,1]=4 122 B6R0.4 O=C(N)NCCO M10039744P [0,1,0,0,0,0|2,0,1]=4 123 B6R0.4 O=C(O)CCCCl M10016891P [0,1,0,0,0,0|1,0,2]=4 124 B6R0.4 O=C(O)CCOC M10045190P [0,1,0,0,0,0|1,0,2]=4 125 B6R0.4 O=C(O)CCSC M10017612P [0,1,0,0,0,0|1,0,2]=4 126 B6R0.4 O=C(O)COCC M10016894P [0,1,0,0,0,0|1,0,2]=4 127 B6R0.4 O=C(O)\C=C\CBr M10127900P [0,1,0,0,0,0|1,0,0]=2 128 B6R0.4 O=C([O-])CNCO M10437440P [0,1,0,0,0,0|2,0,1]=4 129 B6R0.5 C\C=C/P(O)(O)=O M10189255P [0,1,0,0,0,0|2,0,0]=3 130 B6R0.5 C\C=C\[B-](F)(F)F M10961300P [0,1,0,0,0,0|3,0,0]=4 131 B6R1.2 BrC1=NNC=C1 M10131684P [0,0,0,1,0,0|3,0,0]=4 132 B6R1.2 CC1=CC=CN1 M10017268P [0,0,0,1,0,0|1,0,1]=3 133 B6R1.2 CC1=CC=NN1 M10522458P [0,0,0,1,0,0|2,0,0]=3 134 B6R1.2 CC1=CN=CS1 M10055792P [0,0,0,1,0,0|1,1,1]=4 135 B6R1.2 CC1=CNN=N1 M10199661P [0,0,0,1,0,0|3,0,0]=4 136 B6R1.2 CC1=COC=C1 M10023353P [0,0,0,1,0,0|2,0,0]=3 137 B6R1.2 CC1=NCCO1 M10027175P [0,0,0,1,0,0|1,0,2]=4 138 B6R1.2 CC1=NCCS1 M10042677P [0,0,0,1,0,0|1,1,1]=4 139 B6R1.2 CC1=NNC=N1 M10102125P [0,0,0,1,0,0|3,0,0]=4 140 B6R1.2 IC1=CSC=C1 M10115512P [0,0,0,1,0,0|2,0,1]=4 141 B6R1.2 NC1=CC=NO1 M10132694P [0,0,0,1,0,0|2,0,1]=4 142 B6R1.2 NC1=CSC=C1 M10189866P [0,0,0,1,0,0|2,0,1]=4 143 B6R1.2 NC1=CSC=C1 M11005288P [0,0,0,1,0,0|2,0,1]=4 144 B6R1.2 NC1=NCCC1 M10108538P [0,0,0,1,0,0|2,0,1]=4 145 B6R1.2 O=C1CNCC1 M10002481P [0,0,0,1,0,0|1,0,1]=3 146 B6R1.2 O=C1CNCC1 M10057424P [0,0,0,1,0,0|1,0,1]=3 147 B6R1.2 O=C1NCNC1 M10035055P [0,0,0,1,0,0|2,0,1]=4 148 B6R1.2 O=C1NCNC1 M10140916P [0,0,0,1,0,0|2,0,1]=4 149 B6R1.2 O=C1NNC=N1 M10023357P [0,0,0,1,0,0|3,0,0]=4 150 B6R1.2 O=C1OCCO1 M10002484P [0,0,0,1,0,0|2,0,1]=4 151 B6R1.2 O=C1SCCN1 M10046694P [0,0,0,1,0,0|2,0,1]=4 152 B3R0.1 C#CC=O M10016729P [2,0,0,0,0,0|0,0,2]=4 153 B3R0.1 C=CC#N M10003410P [2,0,0,0,0,0|1,0,1]=4 154 B3R0.1 C=CCBr M12278706P [2,0,0,0,0,0|1,0,1]=4 155 B3R0.1 C=CCI M10014069P [2,0,0,0,0,0|1,0,1]=4 156 B3R0.1 C=CCN M10003408P [2,0,0,0,0,0|1,0,1]=4 157 B3R0.1 C=COC M10003420P [2,0,0,0,0,0|1,0,0]=3 158 B3R0.1 C=C[Mg]Cl M10055369P [2,0,0,0,0,0|2,0,0]=4 159 B3R0.1 CONC M10027051P [2,0,0,0,0,0|2,0,0]=4 160 B3R0.1 C[Se][Se]C M10100996P [2,0,0,0,0,0|2,0,0]=4 161 B3R0.1 OCC=O M12277445P [2,0,0,0,0,0|1,0,1]=4 162 B3R0.2 CC(I)C M10000881P [2,0,0,0,0,0|1,0,1]=4 163 B3R0.2 CC(O)=O M10103976P [2,0,0,0,0,0|1,0,0]=3 164 B3R0.2 CC([O-])=O M10013508P [2,0,0,0,0,0|1,0,0]=3 165 B3R0.2 CC([O-])=O M10022986P [2,0,0,0,0,0|1,0,0]=3 166 B3R0.2 CC([O-])=O M10033374P [2,0,0,0,0,0|1,0,0]=3 167 B3R0.2 CC([O-])=O M10051025P [2,0,0,0,0,0|1,0,0]=3 168 B3R0.2 CC([O-])=O M10054051P [2,0,0,0,0,0|1,0,0]=3 169 B3R0.2 CC([O-])=O M10083855P [2,0,0,0,0,0|1,0,0]=3 170 B3R0.2 CC([O-])=O M10108862P [2,0,0,0,0,0|1,0,0]=3 171 B3R0.2 CC([O-])=O M10248137P [2,0,0,0,0,0|1,0,0]=3 172 B3R0.2 CC([O-])=O M10446324P [2,0,0,0,0,0|1,0,0]=3 173 B3R0.2 CC([O-])=O M10641144P [2,0,0,0,0,0|1,0,0]=3 174 B3R0.2 CC([O-])=O M11189623P [2,0,0,0,0,0|1,0,0]=3 175 B3R0.2 CC([O-])=O M11194227P [2,0,0,0,0,0|1,0,0]=3 176 B3R0.2 C[Al](C)C M10000875P [2,0,0,0,0,0|2,0,0]=4 177 B3R0.2 C[S+](C)C M10188680P [2,0,0,0,0,0|2,0,0]=4 178 B3R0.2 C[SiH](Cl)C M10025935P [2,0,0,0,0,0|1,1,0]=4 179 B3R0.2 NC(N)=O M10111063P [2,0,0,0,0,0|2,0,0]=4 180 B3R0.2 O=[P+](C)C M10102480P [2,0,0,0,0,0|1,0,0]=3 181 B3R0.2 OC([O-])=O M10082436P [2,0,0,0,0,0|2,0,0]=4 182 B3R0.2 [Li]C(C)C M10037583P [2,0,0,0,0,0|1,0,1]=4 183 B3R0.2 [O-]C([O-])=O M10013429P [2,0,0,0,0,0|2,0,0]=4 184 B3R0.2 [O-]C([O-])=O M10014782P [2,0,0,0,0,0|2,0,0]=4 185 B3R0.2 [O-]C([O-])=O M10177017P [2,0,0,0,0,0|2,0,0]=4 186 B3R0.2 [O-]C([O-])=O M10295180P [2,0,0,0,0,0|2,0,0]=4 187 B5R0.3 C=CC(NC)=O M10028554P [1,1,0,0,0,0|0,0,0]=2 188 B5R0.3 C=CC(O)CC M10016219P [1,1,0,0,0,0|0,0,2]=4 189 B5R0.3 C=C[C@H](O)CO M10361006P [1,1,0,0,0,0|0,0,2]=4 190 B5R0.3 CCC(C=O)=C M10023101P [1,1,0,0,0,0|0,0,2]=4 191 B5R0.3 CCC(CBr)=O M10021171P [1,1,0,0,0,0|0,0,1]=3 192 B5R0.3 CCC(NC)=O M10028553P [1,1,0,0,0,0|0,0,1]=3 193 B5R0.3 O=C(CBr)CBr M10204064P [1,1,0,0,0,0|1,0,1]=4 194 B5R0.3 O=C(CO)CO M10002465P [1,1,0,0,0,0|1,0,1]=4 195 B5R0.3 O=C(OC)C=O M10023106P [1,1,0,0,0,0|1,0,0]=3 196 B5R0.3 O=C(OC)CBr M10002471P [1,1,0,0,0,0|1,0,0]=3 197 B5R0.3 O=C(OC)OC M10016226P [1,1,0,0,0,0|1,0,0]=3 198 B5R0.3 O=S(OC)OC M10016229P [1,1,0,0,0,0|2,0,0]=4 199 B5R0.4 C=CS(=O)(C)=O M10056663P [1,1,0,0,0,0|1,0,0]=3 200 B5R0.4 C=CS(=O)(Cl)=O M12277955P [1,1,0,0,0,0|2,0,0]=4 201 B5R0.4 C=CS(=O)([O-])=O M10050451P [1,1,0,0,0,0|2,0,0]=4 202 B5R0.4 C=C[Si](Cl)(Cl)C M10004653P [1,1,0,0,0,0|1,1,0]=4 203 B5R0.4 CS(=O)(SC)=O M10188260P [1,1,0,0,0,0|2,0,0]=4 204 B5R0.4 C[Si](C=C)(Cl)C M10035273P [1,1,0,0,0,0|1,1,0]=4 205 B5R0.5 C=C(F)C(O)=O M10010638P [1,1,0,0,0,0|1,0,0]=3 206 B5R0.5 CC(C(C)=C)=O M10021132P [1,1,0,0,0,0|0,0,0]=2 207 B5R0.5 CC(C([O-])=O)=C M10077430P [1,1,0,0,0,0|1,0,0]=3 208 B5R0.5 CC(C([O-])=O)=C M10097056P [1,1,0,0,0,0|1,0,0]=3 209 B5R0.5 CC(C)C([O-])=O M10209916P [1,1,0,0,0,0|1,0,1]=4 210 B5R0.5 CC(F)C(O)=O M10083620P [1,1,0,0,0,0|1,0,1]=4 211 B5R0.5 C[C@@H](Cl)C(Cl)=O M12278061P [1,1,0,0,0,0|1,0,1]=4 212 B5R0.5 C[C@@H](Cl)C(O)=O M10106671P [1,1,0,0,0,0|1,0,1]=4 213 B5R0.5 C[C@@H](O)C(O)=O M10114112P [1,1,0,0,0,0|1,0,1]=4 214 B5R0.5 C[C@H](Br)C(O)=O M10217830P [1,1,0,0,0,0|1,0,1]=4 215 B5R0.5 O=C(C)C([O-])=O M10204094P [1,1,0,0,0,0|1,0,0]=3 216 B5R0.5 O=C(O)C(O)=O M10094285P [1,1,0,0,0,0|2,0,0]=4 217 B5R0.5 O=C([O-])C([O-])=O M10013989P [1,1,0,0,0,0|2,0,0]=4 218 B5R0.5 O=C([O-])C([O-])=O M10082392P [1,1,0,0,0,0|2,0,0]=4 219 B5R0.5 O=C([O-])C([O-])=O M10193068P [1,1,0,0,0,0|2,0,0]=4 220 B5R0.5 O=C([O-])C([O-])=O M10211923P [1,1,0,0,0,0|2,0,0]=4 221 B5R0.5 O=C([O-])C([O-])=O M10271683P [1,1,0,0,0,0|2,0,0]=4 222 B5R0.5 OC(C)C([O-])=O M10140216P [1,1,0,0,0,0|1,0,1]=4 223 B5R0.5 OC(C)C([O-])=O M10189588P [1,1,0,0,0,0|1,0,1]=4 224 B5R0.5 [O-]C(C)C([O-])=O M10249277P [1,1,0,0,0,0|1,0,1]=4 225 B5R0.2 BrC\C=C\CBr M10099734P [1,1,0,0,0,0|1,0,1]=4 226 B5R0.2 C\C=C\OCC M10023285P [1,1,0,0,0,0|0,0,1]=3 227 B5R0.2 O=CNNC=O M10016977P [1,1,0,0,0,0|2,0,0]=4 228 B5R0.2 OC\C=C\CCl M10033040P [1,1,0,0,0,0|0,0,2]=4 229 B7R0.2 CC(N)CC(OC)=O M10083532P [0,2,0,0,0,0|0,0,2]=4 230 B7R0.2 CC(O)CC(OC)=O M10031579P [0,2,0,0,0,0|0,0,2]=4 231 B7R0.2 C[C@@H](N)CC(OC)=O M10650212P [0,2,0,0,0,0|0,0,2]=4 232 B7R0.2 O=C(NC(C)C)CBr M10460688P [0,2,0,0,0,0|1,0,1]=4 233 B7R0.2 O=C(NC(C)C)CN M10428027P [0,2,0,0,0,0|1,0,1]=4 234 B7R0.2 O=C(OC(C)C)CCl M10003254P [0,2,0,0,0,0|1,0,1]=4 235 B7R0.2 OCC(OC(C)C)=O M10016659P [0,2,0,0,0,0|1,0,1]=4 236 B7R0.3 O=C(OC)CCC=O M10126962P [0,2,0,0,0,0|1,0,1]=4 237 B7R0.3 O=C(OC)CCCN M10119950P [0,2,0,0,0,0|0,0,2]=4 238 B7R0.3 O=C(OC)\C=C\OC M10080442P [0,2,0,0,0,0|0,0,0]=2 239 B7R0.3 O=C(OCC=C)CCl M10049025P [0,2,0,0,0,0|0,0,2]=4 240 B7R0.3 O=C(OCCC)CBr M10226573P [0,2,0,0,0,0|0,0,2]=4 241 B7R0.5 CC(Br)C(OCC)=O M10013455P [0,2,0,0,0,0|1,0,1]=4 242 B7R0.5 CC(C(CCC)=O)=O M10058081P [0,2,0,0,0,0|0,0,1]=3 243 B7R0.5 CC(S)C(OCC)=O M10162587P [0,2,0,0,0,0|1,0,1]=4 244 B7R0.5 CC\C=C(C)\C(O)=O M10051561P [0,2,0,0,0,0|0,0,1]=3 245 B7R0.5 C[C@@H](Cl)C(OCC)=O M10248724P [0,2,0,0,0,0|1,0,1]=4 246 B7R0.5 C[C@@H](O)C(OCC)=O M10109851P [0,2,0,0,0,0|1,0,1]=4 247 B7R0.5 O=C(O)C(OCC)=O M10016281P [0,2,0,0,0,0|1,0,1]=4 248 B7R0.5 O=C(OCC)C(N)=O M10016280P [0,2,0,0,0,0|1,0,1]=4 249 B7R0.7 CCCC(OCCl)=O M10221194P [0,2,0,0,0,0|0,0,2]=4 250 B7R0.7 C\C=C\C(OCC)=O M10116065P [0,2,0,0,0,0|0,0,0]=2 251 B7R0.7 O=C(OCC)C=[N+]=[N-] M10016667P [0,2,0,0,0,0|2,0,0]=4 252 B7R0.7 O=C(OCC)CCS M10076471P [0,2,0,0,0,0|1,0,1]=4 253 B7R0.7 O=C(OCC)CNN M10098052P [0,2,0,0,0,0|1,0,1]=4 254 B7R0.7 O=C(OCC)\C=C\I M10215517P [0,2,0,0,0,0|1,0,0]=3 255 B7R0.7 O=C(OCCl)OCC M10226366P [0,2,0,0,0,0|1,0,1]=4 256 B7R0.10 C=C(CBr)C(OC)=O M10061142P [0,2,0,0,0,0|1,0,1]=4 257 B7R0.10 C=C(CCl)C(OC)=O M10023089P [0,2,0,0,0,0|1,0,1]=4 258 B7R0.10 C=C(CO)C(OC)=O M10137156P [0,2,0,0,0,0|1,0,1]=4 259 B7R0.10 O=C(N(OC)C)CCl M10425298P [0,2,0,0,0,0|2,0,0]=4 260 B7R0.9 CC(C)=CC(C)(C)C M10003432P [0,2,0,0,0,0|1,0,1]=4 261 B7R0.9 CC(CC(C)(S)C)=O M10163133P [0,2,0,0,0,0|0,0,2]=4 262 B7R0.16 C=C(C)C(N(C)C)=O M12276663P [0,2,0,0,0,0|2,0,0]=4 263 B7R0.16 CC(C(N)C(O)=O)=O M10092972P [0,2,0,0,0,0|1,0,1]=4 264 B7R0.16 CC(C)C(C(O)=O)=O M10019964P [0,2,0,0,0,0|1,0,1]=4 265 B7R0.16 CC(C)C(C([O-])=O)=O M10057013P [0,2,0,0,0,0|1,0,1]=4 266 B7R0.16 CC(C)C(C([O-])=O)=O M10262012P [0,2,0,0,0,0|1,0,1]=4 267 B7R0.16 O=C(O)C(N(C)C)=O M10218436P [0,2,0,0,0,0|2,0,0]=4 268 B7R0.15 CC(N(CC)CC)=O M10018363P [0,2,0,0,0,0|1,0,1]=4 269 B7R0.4 CC(CCCCBr)=O M10113189P [0,2,0,0,0,0|0,0,2]=4 270 B7R0.4 CC(OCCOC)=O M10003718P [0,2,0,0,0,0|0,0,2]=4 271 B7R0.4 O=C(Cl)\C=C\OCC M10084811P [0,2,0,0,0,0|1,0,0]=3 272 B7R0.6 CC(C)=CC=C(C)C M10020099P [0,2,0,0,0,0|1,0,0]=3 273 B7R0.6 CC(C)\C=C\C(O)=O M10114075P [0,2,0,0,0,0|1,0,0]=3 274 B7R0.6 CC(CCC([O-])=O)=O M10183682P [0,2,0,0,0,0|1,0,1]=4 275 B7R0.6 CC(\C=C\N(C)C)=O M10047810P [0,2,0,0,0,0|0,0,0]=2 276 B7R0.6 O=C(C)CCC([O-])=O M10015062P [0,2,0,0,0,0|1,0,1]=4 277 B7R0.6 O=C(O)\C=C/C(N)=O M10014102P [0,2,0,0,0,0|1,0,1]=4 278 B7R0.6 O=C(O)\C=C/C([O-])=O M10251006P [0,2,0,0,0,0|1,0,1]=4 279 B7R0.6 O=C([O-])\C=C/C(O)=O M10018448P [0,2,0,0,0,0|1,0,1]=4 280 B5R1.2 O=C1CNC1 M10150179P [1,0,0,1,0,0|1,0,1]=4 281 B5R1.2 O=C1CSC1 M10173528P [1,0,0,1,0,0|1,0,1]=4 282 B5R1.2 O=C1NCC1 M10023349P [1,0,0,1,0,0|1,0,0]=3 283 B5R1.1 O1N=CC=C1 M10007514P [1,0,0,1,0,0|1,0,1]=4 284 B5R1.1 S1N=CC=C1 M10007515P [1,0,0,1,0,0|1,1,0]=4 285 B7R1.1 BrCC1=CC=CO1 M10063276P [0,1,0,1,0,0|0,0,2]=4 286 B7R1.1 BrCC1=NNC=C1 M10649267P [0,1,0,1,0,0|2,0,0]=4 287 B7R1.1 ClCC1=CC=CS1 M10020165P [0,1,0,1,0,0|0,1,1]=4 288 B7R1.1 NCC1=CC=CN1 M10405721P [0,1,0,1,0,0|1,0,1]=4 289 B7R1.1 NCC1=NNC=C1 M10233808P [0,1,0,1,0,0|2,0,0]=4 290 B7R1.1 NCC1=NOC=C1 M10109645P [0,1,0,1,0,0|2,0,0]=4 291 B7R1.1 O=CC1=CC=CN1 M10846417P [0,1,0,1,0,0|1,0,1]=4 292 B7R1.1 O=CC1=NNC=C1 M10058610P [0,1,0,1,0,0|2,0,0]=4 293 B7R1.1 OCC1=NNC=C1 M10180756P [0,1,0,1,0,0|2,0,0]=4 294 B7R1.1 SCC1=CC=CS1 M10085524P [0,1,0,1,0,0|0,1,1]=4 295 B7R1.2 CC1=CC(Br)=CS1 M10206144P [0,1,0,1,0,0|0,1,1]=4 296 B7R1.2 CC1=CC=C(Br)O1 M10718133P [0,1,0,1,0,0|0,0,2]=4 297 B7R1.2 CC1=CC=C(Cl)S1 M10148223P [0,1,0,1,0,0|0,1,1]=4 298 B7R1.2 CC1=CN(C)N=C1 M10026171P [0,1,0,1,0,0|2,0,0]=4 299 B7R1.2 CC1=COC(Br)=N1 M11097892P [0,1,0,1,0,0|2,0,0]=4 300 B7R1.2 CC1=CSC(C)=C1 M10017342P [0,1,0,1,0,0|0,1,0]=3 301 B7R1.2 CC1=CSC(Cl)=N1 M10195545P [0,1,0,1,0,0|2,0,0]=4 302 B7R1.2 CC1=NN(C)C=C1 M10018607P [0,1,0,1,0,0|1,0,0]=3 303 B7R1.2 CC1=NN=C(C)N1 M10104063P [0,1,0,1,0,0|2,0,0]=4 304 B7R1.2 CN1N=C(Br)C=C1 M10776437P [0,1,0,1,0,0|2,0,0]=4 305 B7R1.2 CN1N=C(Cl)C=C1 M10392492P [0,1,0,1,0,0|2,0,0]=4 306 B7R1.2 C[N+]1=CN(C)C=C1 M10477361P [0,1,0,1,0,0|2,0,0]=4 307 B7R1.2 NC1=CC(C)=NS1 M10184328P [0,1,0,1,0,0|1,1,0]=4 308 B7R1.2 NC1=CC=C(C)S1 M10282879P [0,1,0,1,0,0|0,1,1]=4 309 B7R1.2 NC1=NC(C)=CO1 M10228028P [0,1,0,1,0,0|2,0,0]=4 310 B7R1.2 NC1=NC=C(C)O1 M10219349P [0,1,0,1,0,0|1,0,1]=4 311 B7R1.2 N[C@H]1COC(C1)=O M10174878P [0,1,0,1,0,0|1,0,1]=4 312 B7R1.2 O=C1CC(CC1)=O M10058164P [0,1,0,1,0,0|0,0,1]=3 313 B7R1.2 O=C1CN(C)CC1 M10472463P [0,1,0,1,0,0|0,0,2]=4 314 B7R1.2 O=C1N=C(N)SC1 M10014084P [0,1,0,1,0,0|2,0,0]=4 315 B7R1.2 O=C1N=C(N)SC1 M10040985P [0,1,0,1,0,0|2,0,0]=4 316 B7R1.2 O=C1NC(C)=CN1 M10028708P [0,1,0,1,0,0|1,0,0]=3 317 B7R1.2 O=C1NC(CC1)=O M10004579P [0,1,0,1,0,0|1,0,0]=3 318 B7R1.2 O=C1NCC(O1)=O M10040935P [0,1,0,1,0,0|2,0,0]=4 319 B7R1.2 O=C1OC(C)=CC1 M10015036P [0,1,0,1,0,0|1,0,0]=3 320 B7R1.2 O=C1OC(CO1)C M10003516P [0,1,0,1,0,0|1,0,1]=4 321 B7R1.2 O=C1OC[C@H](C)O1 M10258723P [0,1,0,1,0,0|1,0,1]=4 322 B7R1.2 O=C1OC[C@H](O)C1 M10299052P [0,1,0,1,0,0|1,0,1]=4 323 B7R1.2 OC1=CC(C)=NN1 M10735473P [0,1,0,1,0,0|1,0,1]=4 324 B7R1.3 BrC1=CCOCC1 M10183929P [0,1,0,1,0,0|1,0,1]=4 325 B7R1.3 CC1=NN=CC=C1 M10033962P [0,1,0,1,0,0|1,0,1]=4 326 B7R1.3 ClC1=CCCCC1 M10208207P [0,1,0,1,0,0|1,0,1]=4 327 B7R1.3 O=C1CCNCC1 M10246538P [0,1,0,1,0,0|0,0,2]=4 328 B7R1.3 O=C1CCNCC1 M10247465P [0,1,0,1,0,0|0,0,2]=4 329 B7R1.3 O=C1CCNCC1 M10857977P [0,1,0,1,0,0|0,0,2]=4 330 B7R1.3 O=C1CCOCC1 M10179636P [0,1,0,1,0,0|0,0,2]=4 331 B7R1.3 O=C1CNCCC1 M10342345P [0,1,0,1,0,0|0,0,2]=4 332 B7R1.3 O=C1NC=NC=C1 M10262703P [0,1,0,1,0,0|1,0,1]=4 333 B7R1.3 O=C1NCCCN1 M10037131P [0,1,0,1,0,0|1,0,1]=4 334 B7R1.3 O=C1OCCOC1 M10050467P [0,1,0,1,0,0|1,0,1]=4 335 B7R1.4 C=C1CCOC1=O M10013811P [0,1,0,1,0,0|1,0,1]=4 336 B7R1.4 CC1=C(C)SC=C1 M11197216P [0,1,0,1,0,0|0,1,1]=4 337 B7R1.4 CC1=CCCC1=O M10027183P [0,1,0,1,0,0|0,0,0]=2 338 B7R1.4 CC1=CNN=C1C M10047993P [0,1,0,1,0,0|2,0,0]=4 339 B7R1.4 CC1=CNN=C1C M10830281P [0,1,0,1,0,0|2,0,0]=4 340 B7R1.4 CC1=NNC=C1I M10138633P [0,1,0,1,0,0|2,0,0]=4 341 B7R1.4 NC1=C(C)ON=C1 M10520047P [0,1,0,1,0,0|1,0,1]=4 342 B7R1.4 NC1=CC=NN1C M10028700P [0,1,0,1,0,0|2,0,0]=4 343 B7R1.4 O=C1C(Br)CCC1 M10172483P [0,1,0,1,0,0|0,0,2]=4 344 B7R1.4 O=C1C(C)CCC1 M10027182P [0,1,0,1,0,0|0,0,2]=4 345 B7R1.4 O=C1C(Cl)CCC1 M10018599P [0,1,0,1,0,0|0,0,2]=4 346 B7R1.4 O=C1NCCC1O M10135336P [0,1,0,1,0,0|1,0,1]=4 347 B7R1.4 O=C1NCC[C@@H]1N M10060287P [0,1,0,1,0,0|1,0,1]=4 348 B7R1.4 O=C1NCC[C@@H]1N M10288485P [0,1,0,1,0,0|1,0,1]=4 349 B7R1.4 O=C1NCC[C@H]1O M10468150P [0,1,0,1,0,0|1,0,1]=4 350 B7R1.4 [Mn]C1=C(C)C=CC1 M10118086P [0,1,0,1,0,0|1,0,0]=3 351 B7R1.10 O=C1CC(CO)C1 M10810765P [0,1,0,1,0,0|0,0,2]=4 352 B7R1.22 O=C([C@@H]1OC1)OC M12003527P [0,1,0,1,0,0|1,0,1]=4 353 B7R1.14 O=S1(C=CCO1)=O M10171812P [0,1,0,1,0,0|2,0,0]=4