0 B7R1.4 C=C1CCOC1=O M10013811P [0,0,0,0,0,0|2,0,1]=3 1 B7R1.4 CC1=CCCC1=O M10027183P [0,0,0,0,0,0|1,0,1]=2 2 B7R1.4 NC1=C(C)ON=C1 M10520047P [0,0,0,0,0,0|2,0,2]=4 3 B7R1.4 O=C1C(Br)CCC1 M10172483P [0,0,0,0,0,0|2,0,0]=2 4 B7R1.4 O=C1C(C)CCC1 M10027182P [0,0,0,0,0,0|1,0,0]=1 5 B7R1.4 O=C1C(Cl)CCC1 M10018599P [0,0,0,0,0,0|2,0,0]=2 6 B7R1.4 O=C1NCCC1O M10135336P [0,0,0,0,0,0|3,0,0]=3 7 B7R1.4 O=C1NCC[C@@H]1N M10060287P [0,0,0,0,0,0|3,0,0]=3 8 B7R1.4 O=C1NCC[C@@H]1N M10288485P [0,0,0,0,0,0|3,0,0]=3 9 B7R1.4 O=C1NCC[C@H]1O M10468150P [0,0,0,0,0,0|3,0,0]=3 10 B7R1.4 O[C@@H]1[C@@H](N)CCC1 M10430095P [0,0,0,0,0,0|2,0,2]=4 11 B7R1.4 O[C@@H]1[C@H](N)CCC1 M10841437P [0,0,0,0,0,0|2,0,2]=4 12 B7R1.4 O[C@H]1[C@@H](N)CCC1 M10743008P [0,0,0,0,0,0|2,0,2]=4 13 B7R1.4 O[C@H]1[C@H](N)CCC1 M10215039P [0,0,0,0,0,0|2,0,2]=4 14 B7R1.4 O[C@H]1[C@H](N)CCC1 M10430096P [0,0,0,0,0,0|2,0,2]=4 15 B7R1.4 O[C@H]1[C@H](O)CCC1 M10192705P [0,0,0,0,0,0|2,0,2]=4 16 B7R1.4 [Mn]C1=C(C)C=CC1 M10118086P [0,0,0,0,0,0|2,0,2]=4 17 B6R1.2 BrC1COCC1 M10160220P [1,0,0,0,0,0|1,0,1]=3 18 B6R1.2 CC1=NCCO1 M10027175P [1,0,0,0,0,0|1,0,1]=3 19 B6R1.2 CC1=NCCS1 M10042677P [1,0,0,0,0,0|1,1,1]=4 20 B6R1.2 CC1SCCS1 M10078227P [1,0,0,0,0,0|1,1,0]=3 21 B6R1.2 C[C@H]1NCCC1 M10246674P [1,0,0,0,0,0|1,0,1]=3 22 B6R1.2 FC1CNCC1 M10798431P [1,0,0,0,0,0|2,0,1]=4 23 B6R1.2 F[C@@H]1CNCC1 M10742011P [1,0,0,0,0,0|2,0,1]=4 24 B6R1.2 F[C@H]1CNCC1 M10939528P [1,0,0,0,0,0|2,0,1]=4 25 B6R1.2 NC1=NCCC1 M10108538P [1,0,0,0,0,0|3,0,0]=4 26 B6R1.2 NC1CNCC1 M10474878P [1,0,0,0,0,0|2,0,1]=4 27 B6R1.2 NC1COCC1 M10544670P [1,0,0,0,0,0|1,0,1]=3 28 B6R1.2 NC1COCC1 M10831251P [1,0,0,0,0,0|1,0,1]=3 29 B6R1.2 NN1CCCC1 M10143774P [1,0,0,0,0,0|3,0,0]=4 30 B6R1.2 N[C@@H]1COCC1 M10654784P [1,0,0,0,0,0|1,0,1]=3 31 B6R1.2 N[C@@H]1COCC1 M10831252P [1,0,0,0,0,0|1,0,1]=3 32 B6R1.2 O=C1CNCC1 M10002481P [1,0,0,0,0,0|1,0,0]=2 33 B6R1.2 O=C1CNCC1 M10057424P [1,0,0,0,0,0|1,0,0]=2 34 B6R1.2 O=C1NCNC1 M10035055P [1,0,0,0,0,0|2,0,0]=3 35 B6R1.2 O=C1NCNC1 M10140916P [1,0,0,0,0,0|2,0,0]=3 36 B6R1.2 O=C1OCCO1 M10002484P [1,0,0,0,0,0|2,0,1]=4 37 B6R1.2 O=C1SCCN1 M10046694P [1,0,0,0,0,0|3,0,0]=4 38 B6R1.2 O=S1OCCO1 M10057276P [1,0,0,0,0,0|3,0,0]=4 39 B6R1.2 O[C@H]1COCC1 M10505325P [1,0,0,0,0,0|0,0,2]=3 40 B8R1.11 OC[C@@H]1N(C)CCC1 M10637872P [0,1,0,0,0,0|3,0,0]=4 41 B8R1.50 O=C1C(C(C)CC1)=O M10020173P [0,1,0,0,0,0|1,0,1]=3 42 B8R1.50 O=C1CCC(N1Br)=O M10004790P [0,1,0,0,0,0|3,0,0]=4 43 B8R1.50 O=C1COC(C)=C1O M10160292P [0,1,0,0,0,0|0,0,3]=4 44 B6R0.1 C=CC(O)CCC M10066392P [0,0,1,0,0,0|3,0,0]=4 45 B6R0.1 C=CC(OCC)=O M10186126P [0,0,1,0,0,0|2,0,1]=4 46 B6R0.1 CC(OC)CCO M10044895P [0,0,1,0,0,0|2,0,1]=4 47 B6R0.1 CCCC(C)C=O M10004549P [0,0,1,0,0,0|1,0,0]=2 48 B6R0.1 CCCC(NN)=O M10055378P [0,0,1,0,0,0|3,0,0]=4 49 B6R0.1 O=C(OC)CCN M10060379P [0,0,1,0,0,0|2,0,0]=3 50 B6R0.1 O=C(OC)C[N+]#[C-] M10240268P [0,0,1,0,0,0|3,0,0]=4 51 B6R0.1 O=C(OCC)CBr M10003242P [0,0,1,0,0,0|3,0,0]=4 52 B6R0.1 O=C(OCC)CN M10011247P [0,0,1,0,0,0|3,0,0]=4 53 B6R0.3 CC(C(CBr)=O)=O M10070633P [0,0,1,0,0,0|1,0,2]=4 54 B6R0.3 CC(C(NC)=O)=C M10058367P [0,0,1,0,0,0|2,0,1]=4 55 B6R0.3 CC(C(S)CC)=O M10426560P [0,0,1,0,0,0|2,0,0]=3 56 B6R0.3 CC(C)C(OC)=O M10013809P [0,0,1,0,0,0|2,0,0]=3 57 B6R0.3 CC(N(C)C=C)=O M10052111P [0,0,1,0,0,0|2,0,1]=4 58 B6R0.3 CC(NC)C(O)=O M10015418P [0,0,1,0,0,0|2,0,0]=3 59 B6R0.3 CC(O)C(OC)=O M10013810P [0,0,1,0,0,0|1,0,0]=2 60 B6R0.3 CC(OC)C(O)=O M10062023P [0,0,1,0,0,0|1,0,0]=2 61 B6R0.3 CCC(Br)C(Br)=O M10192304P [0,0,1,0,0,0|3,0,0]=4 62 B6R0.3 CCC(C(O)=O)=C M10055842P [0,0,1,0,0,0|2,0,1]=4 63 B6R0.3 C[C@@H](NC)C(O)=O M10206333P [0,0,1,0,0,0|2,0,0]=3 64 B6R0.3 C[C@H](O)C(OC)=O M10199944P [0,0,1,0,0,0|1,0,0]=2 65 B6R0.3 C\C(C(O)=O)=C\C M10014266P [0,0,1,0,0,0|2,0,1]=4 66 B6R0.3 O=C(CBr)C(Br)Br M10054834P [0,0,1,0,0,0|3,0,0]=4 67 B6R0.3 O=C(N(C)C)CBr M10076656P [0,0,1,0,0,0|3,0,0]=4 68 B6R0.3 O=C(N(C)C)CN M10037195P [0,0,1,0,0,0|3,0,0]=4 69 B6R0.3 O=C(N(C)C)CN M10446751P [0,0,1,0,0,0|3,0,0]=4 70 B6R0.3 O=C(OC)C(F)F M10010713P [0,0,1,0,0,0|3,0,0]=4 71 B6R0.6 C=CCCCCCl M10208182P [0,0,1,0,0,0|3,0,0]=4 72 B6R0.6 CCCCCCI M10197538P [0,0,1,0,0,0|2,0,1]=4 73 B6R0.6 CCCCC[Mg]Br M10018552P [0,0,1,0,0,0|3,0,0]=4 74 B6R0.6 N#CCCOCC M10040387P [0,0,1,0,0,0|1,0,1]=3 75 B6R0.6 [Li]CCCCCC M10170025P [0,0,1,0,0,0|2,0,1]=4 76 B8R1.4 CC1CCCC(C)N1 M10012541P [0,0,0,0,0,1|2,0,1]=4 77 B8R1.4 O=C1CN(C)CCC1 M10077248P [0,0,0,0,0,1|2,0,0]=3 78 B8R1.4 O=C1NCCC(O)C1 M10882636P [0,0,0,0,0,1|3,0,0]=4 79 B8R1.4 O=C1NCCN(C)C1 M10224934P [0,0,0,0,0,1|3,0,0]=4 80 B8R1.4 O=C1NCC[C@H](O)C1 M10882637P [0,0,0,0,0,1|3,0,0]=4 81 B8R1.5 CC1N(C)CCNC1 M10187604P [0,0,0,0,0,1|3,0,0]=4 82 B8R1.5 C[C@H]1N(C)CCNC1 M10903043P [0,0,0,0,0,1|3,0,0]=4 83 B8R1.5 NC1C(C)CCCC1 M10100073P [0,0,0,0,0,1|2,0,1]=4 84 B8R1.5 O=C1C(Br)COCC1 M10633741P [0,0,0,0,0,1|1,0,0]=2 85 B8R1.5 O=C1C(C)CCCC1 M10014758P [0,0,0,0,0,1|1,0,0]=2 86 B8R1.5 O=C1C(Cl)CCCC1 M10021353P [0,0,0,0,0,1|2,0,0]=3 87 B8R1.5 O=C1C(N)CCCC1 M10098058P [0,0,0,0,0,1|2,0,0]=3 88 B5R0.1 C=C(OCC)C M10023218P [1,0,1,0,0,0|0,0,1]=3 89 B5R0.1 CC(CC#N)=O M10044340P [1,0,1,0,0,0|1,0,1]=4 90 B5R0.1 CC(CCCl)=O M10089400P [1,0,1,0,0,0|1,0,0]=3 91 B5R0.1 CC(COC)=O M10081509P [1,0,1,0,0,0|0,0,0]=2 92 B5R0.1 CC(N)CCC M10393249P [1,0,1,0,0,0|1,0,1]=4 93 B5R0.1 CC(N)CCO M10048445P [1,0,1,0,0,0|1,0,1]=4 94 B5R0.1 CC(OCC)=N M10041195P [1,0,1,0,0,0|1,0,1]=4 95 B5R0.1 CSCS(C)=O M10220911P [1,0,1,0,0,0|1,1,0]=4 96 B5R0.1 C[C@@H](N)CCO M10335804P [1,0,1,0,0,0|1,0,1]=4 97 B5R0.1 C[C@@H](O)COC M10067779P [1,0,1,0,0,0|0,0,2]=4 98 B5R0.1 C[C@H](N)CCO M10335803P [1,0,1,0,0,0|1,0,1]=4 99 B5R0.1 C[C@H](O)COC M10194416P [1,0,1,0,0,0|0,0,2]=4 100 B5R0.1 C[SiH](OCC)C M10133661P [1,0,1,0,0,0|0,1,1]=4 101 B5R0.1 ClCOC(C)=O M10016791P [1,0,1,0,0,0|1,0,1]=4 102 B5R0.1 O=C(O)CCF M10011311P [1,0,1,0,0,0|2,0,0]=4 103 B5R0.1 O=C(O)CCO M10012525P [1,0,1,0,0,0|1,0,0]=3 104 B5R0.1 O=C([O-])CNC M10061947P [1,0,1,0,0,0|2,0,0]=4 105 B5R0.1 O=[N+](CCO)[O-] M10016784P [1,0,1,0,0,0|2,0,0]=4 106 B5R0.2 C=CCCCCl M10023281P [1,0,1,0,0,0|2,0,0]=4 107 B5R0.2 C=CCOCC M10014106P [1,0,1,0,0,0|0,0,1]=3 108 B5R0.2 CCC#CCO M10085562P [1,0,1,0,0,0|0,0,2]=4 109 B5R0.2 CCCN=C=O M10003745P [1,0,1,0,0,0|1,0,1]=4 110 B5R0.2 CCCOC=C M10020114P [1,0,1,0,0,0|2,0,0]=4 111 B5R0.2 CCOCCCl M10016975P [1,0,1,0,0,0|1,0,0]=3 112 B5R0.2 CCSCCCl M10018543P [1,0,1,0,0,0|1,1,0]=4 113 B5R0.2 CCSCCO M10003744P [1,0,1,0,0,0|1,0,0]=3 114 B5R0.2 COCCOC M10003738P [1,0,1,0,0,0|2,0,0]=4 115 B5R0.2 C\C=C\OCC M10023285P [1,0,1,0,0,0|1,0,1]=4 116 B5R0.2 Cl[Mg]CCCC M10018540P [1,0,1,0,0,0|2,0,0]=4 117 B5R0.2 OCCCCBr M10196369P [1,0,1,0,0,0|1,0,1]=4 118 B5R0.2 OCCCCBr M10219049P [1,0,1,0,0,0|1,0,1]=4 119 B5R0.2 OCCCCCl M10030203P [1,0,1,0,0,0|1,0,1]=4 120 B5R0.2 OC\C=C\CCl M10033040P [1,0,1,0,0,0|1,0,1]=4 121 B5R0.3 C=CC(O)CC M10016219P [1,0,1,0,0,0|2,0,0]=4 122 B5R0.3 CCC(Br)CC M10036560P [1,0,1,0,0,0|1,0,1]=4 123 B5R0.3 CCC(C)CBr M10114990P [1,0,1,0,0,0|1,0,1]=4 124 B5R0.3 CCC(C)CS M10037434P [1,0,1,0,0,0|0,1,1]=4 125 B5R0.3 CCC(C=O)=C M10023101P [1,0,1,0,0,0|0,0,2]=4 126 B5R0.3 CCC(CBr)=O M10021171P [1,0,1,0,0,0|1,0,0]=3 127 B5R0.3 CCC(N)CC M10016218P [1,0,1,0,0,0|1,0,1]=4 128 B5R0.3 CCC(N)CO M10120213P [1,0,1,0,0,0|1,0,1]=4 129 B5R0.3 CCC(NC)=O M10028553P [1,0,1,0,0,0|1,0,0]=3 130 B5R0.3 CCC(NO)=N M10205861P [1,0,1,0,0,0|2,0,0]=4 131 B5R0.3 CCC([Mg]Br)C M10023104P [1,0,1,0,0,0|2,0,0]=4 132 B5R0.3 CCC([Mg]Cl)C M12278734P [1,0,1,0,0,0|2,0,0]=4 133 B5R0.3 CC[Al](Cl)CC M10002450P [1,0,1,0,0,0|2,0,0]=4 134 B5R0.3 O=C(CBr)CBr M10204064P [1,0,1,0,0,0|2,0,0]=4 135 B5R0.3 O=C(CO)CO M10002465P [1,0,1,0,0,0|1,0,0]=3 136 B5R0.3 O=C(OC)C=O M10023106P [1,0,1,0,0,0|1,0,1]=4 137 B5R0.3 O=C(OC)CBr M10002471P [1,0,1,0,0,0|2,0,0]=4 138 B5R0.3 O=C(OC)OC M10016226P [1,0,1,0,0,0|2,0,0]=4 139 B5R0.3 OCC(CO)=C M10055135P [1,0,1,0,0,0|2,0,0]=4 140 B5R0.5 CC(C(C)=C)=O M10021132P [1,0,1,0,0,0|0,0,2]=4 141 B5R0.5 CC(C)C([O-])=O M10209916P [1,0,1,0,0,0|1,0,0]=3 142 B5R0.5 CC(F)C(O)=O M10083620P [1,0,1,0,0,0|2,0,0]=4 143 B5R0.5 CC(S)C(C)C M10039796P [1,0,1,0,0,0|0,1,1]=4 144 B5R0.5 C[C@@H](Cl)C(Cl)=O M12278061P [1,0,1,0,0,0|2,0,0]=4 145 B5R0.5 C[C@@H](Cl)C(O)=O M10106671P [1,0,1,0,0,0|2,0,0]=4 146 B5R0.5 C[C@@H](O)C(O)=O M10114112P [1,0,1,0,0,0|1,0,0]=3 147 B5R0.5 C[C@@H](O)[C@@H](S)C M10234757P [1,0,1,0,0,0|0,1,1]=4 148 B5R0.5 C[C@@H](O)[C@H](O)C M10184381P [1,0,1,0,0,0|0,0,2]=4 149 B5R0.5 C[C@H](Br)C(O)=O M10217830P [1,0,1,0,0,0|2,0,0]=4 150 B5R0.5 C[C@H](O)[C@@H](O)C M10159152P [1,0,1,0,0,0|0,0,2]=4 151 B5R0.5 OC(C)C([O-])=O M10140216P [1,0,1,0,0,0|1,0,0]=3 152 B5R0.5 OC(C)C([O-])=O M10189588P [1,0,1,0,0,0|1,0,0]=3 153 B5R0.5 [O-]C(C)C([O-])=O M10249277P [1,0,1,0,0,0|1,0,1]=4 154 B5R1.1 C1CCCS1 M10003672P [2,0,0,0,0,0|0,1,1]=4 155 B5R1.1 O1NCCC1 M10012567P [2,0,0,0,0,0|1,0,1]=4 156 B7R0.2 CC(N)CC(OC)=O M10083532P [0,1,1,0,0,0|2,0,0]=4 157 B7R0.2 CC(O)CC(OC)=O M10031579P [0,1,1,0,0,0|1,0,0]=3 158 B7R0.2 C[C@@H](N)CC(OC)=O M10650212P [0,1,1,0,0,0|2,0,0]=4 159 B7R0.3 O=C(OC)CCC=O M10126962P [0,1,1,0,0,0|1,0,1]=4 160 B7R0.3 O=C(OC)CCCN M10119950P [0,1,1,0,0,0|2,0,0]=4 161 B7R0.3 O=C(OCCC)CBr M10226573P [0,1,1,0,0,0|2,0,0]=4 162 B7R0.5 CC(Br)C(OCC)=O M10013455P [0,1,1,0,0,0|2,0,0]=4 163 B7R0.5 CC(C(CCC)=O)=O M10058081P [0,1,1,0,0,0|1,0,1]=4 164 B7R0.5 CC(C)C(OCCl)=O M10342363P [0,1,1,0,0,0|2,0,0]=4 165 B7R0.5 CC(S)C(OCC)=O M10162587P [0,1,1,0,0,0|2,0,0]=4 166 B7R0.5 CCCC(Br)C(O)=O M10014810P [0,1,1,0,0,0|2,0,0]=4 167 B7R0.5 CCCC(C)C(O)=O M10209692P [0,1,1,0,0,0|1,0,0]=3 168 B7R0.5 CC\C=C(C)\C(O)=O M10051561P [0,1,1,0,0,0|1,0,1]=4 169 B7R0.5 C[C@@H](Cl)C(OCC)=O M10248724P [0,1,1,0,0,0|2,0,0]=4 170 B7R0.5 C[C@@H](O)C(OCC)=O M10109851P [0,1,1,0,0,0|2,0,0]=4 171 B7R0.5 O=C(O)C(OCC)=O M10016281P [0,1,1,0,0,0|1,0,1]=4 172 B7R0.5 O=C(OCC)C(N)=O M10016280P [0,1,1,0,0,0|1,0,1]=4 173 B7R0.7 CCCC(OCCl)=O M10221194P [0,1,1,0,0,0|2,0,0]=4 174 B7R0.7 O=C(CCCl)CCCl M10055903P [0,1,1,0,0,0|1,0,0]=3 175 B7R0.7 O=C(OCC)CCS M10076471P [0,1,1,0,0,0|0,1,0]=3 176 B7R0.7 O=C(OCC)CNN M10098052P [0,1,1,0,0,0|2,0,0]=4 177 B7R0.7 O=C(OCCl)OCC M10226366P [0,1,1,0,0,0|2,0,0]=4 178 B7R0.10 C=C(CO)C(OC)=O M10137156P [0,1,1,0,0,0|1,0,1]=4 179 B7R0.10 CCC(C)C(C)C=O M10218111P [0,1,1,0,0,0|1,0,0]=3 180 B7R0.10 N[C@@H](CCl)C(OC)=O M10147479P [0,1,1,0,0,0|2,0,0]=4 181 B7R0.10 O=C(NN)C(N)CO M10285009P [0,1,1,0,0,0|2,0,0]=4 182 B7R0.10 O=C(OC)C(Br)CBr M10035422P [0,1,1,0,0,0|2,0,0]=4 183 B7R0.10 O=C(OC)C(Cl)CCl M10056613P [0,1,1,0,0,0|2,0,0]=4 184 B7R0.10 O=C(OC)[C@@H](O)CO M10113922P [0,1,1,0,0,0|1,0,0]=3 185 B7R0.10 O=C(OC)[C@H](N)CCl M10682812P [0,1,1,0,0,0|2,0,0]=4 186 B7R0.10 O=C([C@@H](O)CO)CO M10013403P [0,1,1,0,0,0|1,0,0]=3 187 B7R0.11 C=C[Si](C)(OCC)C M10072047P [0,1,1,0,0,0|1,1,0]=4 188 B7R0.11 C[C@@](O)(OCC)CO M10787517P [0,1,1,0,0,0|0,0,2]=4 189 B7R0.12 CCN(CCO)CC M10131017P [0,1,1,0,0,0|2,0,0]=4 190 B7R0.13 CC(C)(ON)C(O)=O M10581540P [0,1,1,0,0,0|2,0,0]=4 191 B7R0.13 CC[C@@](C)(N)C(O)=O M10050652P [0,1,1,0,0,0|2,0,0]=4 192 B7R0.13 CC[C@](C)(N)C(O)=O M10015239P [0,1,1,0,0,0|2,0,0]=4 193 B7R0.14 CC(C)(C)C(OC)=O M10015374P [0,1,1,0,0,0|2,0,0]=4 194 B7R0.14 CCC(C(F)(F)F)=O M10009747P [0,1,1,0,0,0|2,0,0]=4 195 B7R0.15 CC(N(CC)CC)=O M10018363P [0,1,1,0,0,0|2,0,0]=4 196 B7R0.15 CN(C)C(OC)OC M10064954P [0,1,1,0,0,0|2,0,0]=4 197 B7R0.16 CC(C)C(C(O)=O)=O M10019964P [0,1,1,0,0,0|1,0,1]=4 198 B7R0.16 CC(C)[C@H](C)C(O)=O M10134757P [0,1,1,0,0,0|2,0,0]=4 199 B7R0.1 C=CCCCCCCl M10023319P [0,1,1,0,0,0|2,0,0]=4 200 B7R0.1 CCCCOCCCl M10115661P [0,1,1,0,0,0|1,0,1]=4 201 B7R0.1 CCOCCOCC M10017029P [0,1,1,0,0,0|1,0,1]=4 202 B7R0.1 COCCOCCN M11203897P [0,1,1,0,0,0|2,0,0]=4 203 B7R0.4 CC(CCCCBr)=O M10113189P [0,1,1,0,0,0|2,0,0]=4 204 B7R0.4 CCCCCC(Cl)=O M10005436P [0,1,1,0,0,0|1,0,0]=3 205 B7R0.4 O=C(Cl)\C=C\OCC M10084811P [0,1,1,0,0,0|0,0,2]=4 206 B7R0.4 O=C(N)NCCCC M10195780P [0,1,1,0,0,0|2,0,0]=4 207 B7R0.4 O=C(N)NCCCC M10200467P [0,1,1,0,0,0|2,0,0]=4 208 B7R0.4 O=C(O)CCCCO M10123275P [0,1,1,0,0,0|2,0,0]=4 209 B7R0.4 O=C(O)CCOCC M10062024P [0,1,1,0,0,0|0,0,0]=2 210 B7R0.4 O=C(O)COCCC M10276951P [0,1,1,0,0,0|2,0,0]=4 211 B7R0.4 O=C([O-])CCCCO M10233260P [0,1,1,0,0,0|2,0,0]=4 212 B7R1.1 BrCC1CCCC1 M10057867P [1,1,0,0,0,0|1,0,1]=4 213 B7R1.1 CCC1=NCCO1 M10115051P [1,1,0,0,0,0|1,0,1]=4 214 B7R1.1 COC1CCCC1 M10078199P [1,1,0,0,0,0|1,0,1]=4 215 B7R1.1 ClCC1OCCO1 M10045516P [1,1,0,0,0,0|1,0,0]=3 216 B7R1.1 N#CC1COCC1 M10132399P [1,1,0,0,0,0|1,0,1]=4 217 B7R1.1 NCC1CCCC1 M10302882P [1,1,0,0,0,0|1,0,1]=4 218 B7R1.1 NCC1COCC1 M10794275P [1,1,0,0,0,0|1,0,1]=4 219 B7R1.1 NCC1COCC1 M10812914P [1,1,0,0,0,0|1,0,1]=4 220 B7R1.1 NCC1OCCC1 M10066380P [1,1,0,0,0,0|0,0,1]=3 221 B7R1.1 NC[C@@H]1OCCC1 M10102346P [1,1,0,0,0,0|0,0,1]=3 222 B7R1.1 NC[C@H]1OCCC1 M10102169P [1,1,0,0,0,0|0,0,1]=3 223 B7R1.1 O=CC1OCCC1 M10109701P [1,1,0,0,0,0|0,0,2]=4 224 B7R1.1 OCC1COCC1 M10138830P [1,1,0,0,0,0|0,0,2]=4 225 B7R1.1 OCC1OCCO1 M10079280P [1,1,0,0,0,0|1,0,0]=3 226 B7R1.2 N[C@H]1COC(C1)=O M10174878P [1,1,0,0,0,0|2,0,0]=4 227 B7R1.2 O=C1CC(CC1)=O M10058164P [1,1,0,0,0,0|1,0,0]=3 228 B7R1.2 O=C1CN(C)CC1 M10472463P [1,1,0,0,0,0|1,0,0]=3 229 B7R1.2 O=C1NC(CC1)=O M10004579P [1,1,0,0,0,0|2,0,0]=4 230 B7R1.2 O=C1OC(C)=CC1 M10015036P [1,1,0,0,0,0|0,0,2]=4 231 B7R1.2 O=C1OC[C@H](O)C1 M10299052P [1,1,0,0,0,0|2,0,0]=4 232 B7R1.14 CC1(C)NCCC1 M10225767P [1,1,0,0,0,0|1,0,1]=4 233 B7R1.14 CC1(C)SCCN1 M10160446P [1,1,0,0,0,0|1,1,0]=4 234 B9R1.34 O=C1CC(C)NC(C)C1 M11091903P [0,1,0,0,0,1|1,0,0]=3 235 B9R1.34 O=C1CC(CC(C)C1)=O M10062153P [0,1,0,0,0,1|1,0,1]=4 236 B9R1.66 O=C1CC(C)(C)OCC1 M10028787P [0,1,0,0,0,1|0,0,0]=2 237 B9R1.66 O=C1CC(C)(O)CCO1 M12271779P [0,1,0,0,0,1|2,0,0]=4 238 B9R1.15 N#CC1CNCCC1=O M10159401P [0,1,0,0,0,1|1,0,1]=4 239 B9R1.15 O=C1C(OC)COCC1 M10903127P [0,1,0,0,0,1|0,0,0]=2 240 B9R1.15 O=C1NCCCC1OC M10188359P [0,1,0,0,0,1|1,0,0]=3 241 B9R1.40 O=C1C(C)(C)CCCC1 M10028759P [0,1,0,0,0,1|1,0,0]=3 242 B9R1.27 O=C1C(CC)C(CC1)=O M10021371P [0,2,0,0,0,0|1,0,0]=3 243 B9R1.27 O=C1CCC(N1CO)=O M12278742P [0,2,0,0,0,0|2,0,0]=4 244 B9R1.33 O=C1N(CCC)CCC1 M10054809P [0,2,0,0,0,0|2,0,0]=4 245 B9R1.37 O=C1C(C(C)C(C)C1)=O M10124286P [0,2,0,0,0,0|1,0,1]=4 246 B9R1.37 O=C1C(C(C)CC1C)=O M10124287P [0,2,0,0,0,0|1,0,1]=4 247 B9R1.38 O=C1NC(C(O1)(C)C)=O M10018657P [0,2,0,0,0,0|1,0,1]=4 248 B7R1.3 BrC1=CCOCC1 M10183929P [0,0,1,1,0,0|1,0,1]=4 249 B7R1.3 CC1CNCCO1 M10198590P [0,0,1,1,0,0|1,0,1]=4 250 B7R1.3 C[C@H]1CNCCO1 M10456369P [0,0,1,1,0,0|1,0,1]=4 251 B7R1.3 C[C@H]1CNCCO1 M11103989P [0,0,1,1,0,0|1,0,1]=4 252 B7R1.3 O=C1CCNCC1 M10246538P [0,0,1,1,0,0|1,0,0]=3 253 B7R1.3 O=C1CCNCC1 M10247465P [0,0,1,1,0,0|1,0,0]=3 254 B7R1.3 O=C1CCNCC1 M10857977P [0,0,1,1,0,0|1,0,0]=3 255 B7R1.3 O=C1CCOCC1 M10179636P [0,0,1,1,0,0|0,0,0]=2 256 B7R1.3 O=C1CNCCC1 M10342345P [0,0,1,1,0,0|2,0,0]=4 257 B7R1.3 O=S1CCCCC1 M10067807P [0,0,1,1,0,0|2,0,0]=4 258 B7R1.22 O=C([C@@H]1OC1)OC M12003527P [0,0,1,1,0,0|1,0,0]=3 259 B7R1.18 O=C(C1NCC1)O M10164146P [0,0,1,1,0,0|2,0,0]=4 260 B7R1.18 O=C(C1OCC1)O M10006194P [0,0,1,1,0,0|1,0,0]=3 261 B7R1.18 O=C([C@@H]1NCC1)O M10110131P [0,0,1,1,0,0|2,0,0]=4 262 B7R1.18 O=C([C@H]1NCC1)O M10875068P [0,0,1,1,0,0|2,0,0]=4 263 B7R1.19 O=C(C1(C)CC1)N M10139369P [0,0,1,1,0,0|2,0,0]=4 264 B7R1.24 O1CCNCCC1 M10806668P [0,0,1,1,0,0|1,0,1]=4 265 B5R1.2 BrC1COC1 M10239305P [1,0,0,0,1,0|1,0,1]=4 266 B5R1.2 ClC1CCC1 M10027170P [1,0,0,0,1,0|1,0,1]=4 267 B5R1.2 O=C1CNC1 M10150179P [1,0,0,0,1,0|1,0,0]=3 268 B5R1.2 O=C1CSC1 M10173528P [1,0,0,0,1,0|0,1,0]=3 269 B5R1.2 O=C1NCC1 M10023349P [1,0,0,0,1,0|1,0,0]=3 270 B9R1.5 O=C1NCCCCC1N M10018058P [0,0,0,0,0,2|2,0,0]=4 271 B9R1.5 O=C1NCCCC[C@H]1N M10204271P [0,0,0,0,0,2|2,0,0]=4