0 B5R0.2 BrC\C=C\CBr M10099734P [0,0,0,0,0,0|4,0,0]=4 1 B5R0.2 C=CCOCC M10014106P [0,0,0,0,0,0|1,1,2]=4 2 B5R0.2 CCC#CCBr M10142580P [0,0,0,0,0,0|3,0,0]=3 3 B5R0.2 CCC#CCO M10085562P [0,0,0,0,0,0|3,0,0]=3 4 B5R0.2 CCCN=C=O M10003745P [0,0,0,0,0,0|3,0,1]=4 5 B5R0.2 CCCOC=C M10020114P [0,0,0,0,0,0|1,1,2]=4 6 B5R0.2 CCOCCCl M10016975P [0,0,0,0,0,0|2,1,0]=3 7 B5R0.2 CCSCCCl M10018543P [0,0,0,0,0,0|2,0,0]=2 8 B5R0.2 CCSCCO M10003744P [0,0,0,0,0,0|2,0,0]=2 9 B5R0.2 CC[Se][Se]CC M10016980P [0,0,0,0,0,0|0,2,0]=2 10 B5R0.2 COCCOC M10003738P [0,0,0,0,0,0|4,0,0]=4 11 B5R0.2 C\C=C\OCC M10023285P [0,0,0,0,0,0|1,1,1]=3 12 B5R0.2 ClCC#CCCl M10021276P [0,0,0,0,0,0|4,0,0]=4 13 B5R0.2 Cl[Mg]CCCC M10018540P [0,0,0,0,0,0|4,0,0]=4 14 B5R0.2 ICCCCI M10016968P [0,0,0,0,0,0|4,0,0]=4 15 B5R0.2 OCCCCBr M10196369P [0,0,0,0,0,0|4,0,0]=4 16 B5R0.2 OCCCCBr M10219049P [0,0,0,0,0,0|4,0,0]=4 17 B5R0.2 OCCCCCl M10030203P [0,0,0,0,0,0|4,0,0]=4 18 B5R0.2 OC\C=C\CCl M10033040P [0,0,0,0,0,0|4,0,0]=4 19 B4R0.2 C(NCC)=O M10016925P [1,0,0,0,0,0|2,0,1]=4 20 B4R0.2 CCCCN M10058158P [1,0,0,0,0,0|2,0,0]=3 21 B4R0.2 CCCC[O-] M10026120P [1,0,0,0,0,0|2,0,0]=3 22 B4R0.2 CCC[Mg]Cl M10041602P [1,0,0,0,0,0|3,0,0]=4 23 B4R0.2 CCOCCl M10052059P [1,0,0,0,0,0|1,1,0]=3 24 B4R0.2 CC[Zn]CC M10014098P [1,0,0,0,0,0|1,0,0]=2 25 B4R0.2 CSCCO M10070197P [1,0,0,0,0,0|2,0,0]=3 26 B4R0.2 CSCSC M10033691P [1,0,0,0,0,0|2,0,0]=3 27 B4R0.2 C\C=C\CCl M10015079P [1,0,0,0,0,0|2,0,1]=4 28 B4R0.2 C\C=C\OC M10103777P [1,0,0,0,0,0|1,1,1]=4 29 B4R0.2 ClCCNC M10064229P [1,0,0,0,0,0|3,0,0]=4 30 B4R0.2 FCCCBr M10008947P [1,0,0,0,0,0|3,0,0]=4 31 B4R0.2 NCCOC M10003657P [1,0,0,0,0,0|2,1,0]=4 32 B4R0.2 OCCCF M10011351P [1,0,0,0,0,0|3,0,0]=4 33 B6R0.1 CCC[C@H](N)CO M10176483P [0,1,0,0,0,0|3,0,0]=4 34 B6R0.1 O=C(OCC)CBr M10003242P [0,1,0,0,0,0|2,1,0]=4 35 B6R0.1 O=C(OCC)CN M10011247P [0,1,0,0,0,0|2,1,0]=4 36 B6R0.4 CC(C)CCCBr M10016880P [0,1,0,0,0,0|3,0,0]=4 37 B6R0.4 CC(C)CCCO M10016881P [0,1,0,0,0,0|3,0,0]=4 38 B6R0.4 CC(NCCCl)C M10088269P [0,1,0,0,0,0|3,0,0]=4 39 B6R0.4 CC(O)CCCO M10016886P [0,1,0,0,0,0|3,0,0]=4 40 B6R0.4 CC(OCCBr)C M10275026P [0,1,0,0,0,0|2,1,0]=4 41 B6R0.6 CCCCCCI M10197538P [0,1,0,0,0,0|2,0,0]=3 42 B6R0.6 CCCCC[Mg]Br M10018552P [0,1,0,0,0,0|3,0,0]=4 43 B6R0.6 CCCOCCCl M10247973P [0,1,0,0,0,0|1,1,0]=3 44 B6R0.6 COBCCCC M10104694P [0,1,0,0,0,0|3,0,0]=4 45 B6R0.6 COCCCCCl M10152312P [0,1,0,0,0,0|3,0,0]=4 46 B6R0.6 N#CCCOCC M10040387P [0,1,0,0,0,0|1,1,1]=4 47 B6R0.6 NCCCCCN M10031362P [0,1,0,0,0,0|3,0,0]=4 48 B6R0.6 NCCSCCN M10022220P [0,1,0,0,0,0|2,0,0]=3 49 B6R0.6 OCCCCNC M10247660P [0,1,0,0,0,0|3,0,0]=4 50 B6R0.6 OCCSCCO M10003812P [0,1,0,0,0,0|2,0,0]=3 51 B6R0.6 [Li]CCCCCC M10170025P [0,1,0,0,0,0|2,0,0]=3 52 B6R1.1 C1CCCCS1 M10033603P [0,0,0,1,0,0|1,0,0]=2 53 B6R1.1 C1CCCNN1 M10012589P [0,0,0,1,0,0|2,0,0]=3 54 B6R1.1 N1CCCCC1 M10083674P [0,0,0,1,0,0|2,0,0]=3 55 B6R1.1 N1CCNCC1 M10005439P [0,0,0,1,0,0|3,0,0]=4 56 B6R1.1 N1CCSCC1 M10082418P [0,0,0,1,0,0|2,0,0]=3 57 B6R1.1 O1CCSCC1 M10139809P [0,0,0,1,0,0|2,0,0]=3 58 B6R1.1 [NH2+]1CCCCC1 M10064261P [0,0,0,1,0,0|2,0,0]=3 59 B6R1.2 BrC1COCC1 M10160220P [0,0,0,1,0,0|2,1,0]=4 60 B6R1.2 CC1=NCCS1 M10042677P [0,0,0,1,0,0|2,0,1]=4 61 B6R1.2 CC1SCCS1 M10078227P [0,0,0,1,0,0|2,0,0]=3 62 B6R1.2 C[C@H]1NCCC1 M10246674P [0,0,0,1,0,0|2,0,0]=3 63 B6R1.2 FC1CNCC1 M10798431P [0,0,0,1,0,0|3,0,0]=4 64 B6R1.2 F[C@@H]1CNCC1 M10742011P [0,0,0,1,0,0|3,0,0]=4 65 B6R1.2 F[C@H]1CNCC1 M10939528P [0,0,0,1,0,0|3,0,0]=4 66 B6R1.2 NC1CNCC1 M10474878P [0,0,0,1,0,0|3,0,0]=4 67 B6R1.2 NC1COCC1 M10544670P [0,0,0,1,0,0|2,1,0]=4 68 B6R1.2 NC1COCC1 M10831251P [0,0,0,1,0,0|2,1,0]=4 69 B6R1.2 N[C@@H]1COCC1 M10654784P [0,0,0,1,0,0|2,1,0]=4 70 B6R1.2 N[C@@H]1COCC1 M10831252P [0,0,0,1,0,0|2,1,0]=4 71 B6R1.2 O[C@H]1COCC1 M10505325P [0,0,0,1,0,0|2,1,0]=4 72 B6R1.6 NCC1OCC1 M11018010P [0,0,0,1,0,0|2,1,0]=4 73 B6R1.6 OC[C@H]1NCC1 M10655012P [0,0,0,1,0,0|3,0,0]=4 74 B3R0.1 CCC#N M10003409P [2,0,0,0,0,0|1,0,1]=4 75 B3R0.1 CCC#N M10053961P [2,0,0,0,0,0|1,0,1]=4 76 B3R0.1 CCCN M10194639P [2,0,0,0,0,0|1,0,0]=3 77 B3R0.1 CCC[O-] M10018423P [2,0,0,0,0,0|1,0,0]=3 78 B3R0.1 CCC[O-] M10050959P [2,0,0,0,0,0|1,0,0]=3 79 B3R0.1 CCC[O-] M10180358P [2,0,0,0,0,0|1,0,0]=3 80 B3R0.1 CC[Mg]Br M10023187P [2,0,0,0,0,0|2,0,0]=4 81 B3R0.1 COCBr M10120227P [2,0,0,0,0,0|1,1,0]=4 82 B3R0.1 COCCl M10003424P [2,0,0,0,0,0|1,1,0]=4 83 B3R0.1 CONC M10027051P [2,0,0,0,0,0|1,1,0]=4 84 B3R0.1 C[Se][Se]C M10100996P [2,0,0,0,0,0|0,2,0]=4 85 B3R0.1 Cl[Mg]CC M10043221P [2,0,0,0,0,0|2,0,0]=4 86 B3R0.1 NCCO M10038856P [2,0,0,0,0,0|2,0,0]=4 87 B3R0.1 NOCC M10053406P [2,0,0,0,0,0|1,1,0]=4 88 B3R0.1 ONCC M10249174P [2,0,0,0,0,0|1,1,0]=4 89 B5R0.1 C=C(OCC)C M10023218P [1,1,0,0,0,0|0,1,1]=4 90 B5R0.1 CC(C)CCI M10013642P [1,1,0,0,0,0|2,0,0]=4 91 B5R0.1 CC(N)CCC M10393249P [1,1,0,0,0,0|1,0,0]=3 92 B5R0.1 CC(N)CCO M10048445P [1,1,0,0,0,0|2,0,0]=4 93 B5R0.1 CC(OCC)=N M10041195P [1,1,0,0,0,0|0,1,1]=4 94 B5R0.1 CSCS(C)=O M10220911P [1,1,0,0,0,0|2,0,0]=4 95 B5R0.1 C[C@@H](N)CCO M10335804P [1,1,0,0,0,0|2,0,0]=4 96 B5R0.1 C[C@@H](O)COC M10067779P [1,1,0,0,0,0|1,1,0]=4 97 B5R0.1 C[C@H](N)CCO M10335803P [1,1,0,0,0,0|2,0,0]=4 98 B5R0.1 C[C@H](O)COC M10194416P [1,1,0,0,0,0|1,1,0]=4 99 B5R0.1 C[SiH](OCC)C M10133661P [1,1,0,0,0,0|0,2,0]=4 100 B5R0.3 CCC(Br)CC M10036560P [1,1,0,0,0,0|1,0,0]=3 101 B5R0.3 CCC(C)CBr M10114990P [1,1,0,0,0,0|2,0,0]=4 102 B5R0.3 CCC(C)CS M10037434P [1,1,0,0,0,0|2,0,0]=4 103 B5R0.3 CCC(CBr)=O M10021171P [1,1,0,0,0,0|2,0,0]=4 104 B5R0.3 CCC(N)CC M10016218P [1,1,0,0,0,0|1,0,0]=3 105 B5R0.3 CCC(N)CO M10120213P [1,1,0,0,0,0|2,0,0]=4 106 B5R0.3 CCC(NC)=O M10028553P [1,1,0,0,0,0|2,0,0]=4 107 B5R0.3 CC[Al](Cl)CC M10002450P [1,1,0,0,0,0|1,0,0]=3 108 B7R0.2 CC(N)CC(C)CC M10003248P [0,2,0,0,0,0|2,0,0]=4 109 B7R0.5 CC(Br)C(OCC)=O M10013455P [0,2,0,0,0,0|1,1,0]=4 110 B7R0.5 CC(S)C(OCC)=O M10162587P [0,2,0,0,0,0|1,1,0]=4 111 B7R0.5 C[C@@H](Cl)C(OCC)=O M10248724P [0,2,0,0,0,0|1,1,0]=4 112 B7R0.5 C[C@@H](O)C(OCC)=O M10109851P [0,2,0,0,0,0|1,1,0]=4 113 B7R0.7 C=C(OCC)OCC M10046654P [0,2,0,0,0,0|0,2,0]=4 114 B7R0.7 O=C(OCC)CCS M10076471P [0,2,0,0,0,0|1,1,0]=4 115 B7R0.7 O=S(OCC)OCC M10016673P [0,2,0,0,0,0|0,1,1]=4 116 B7R0.4 CC(N)CCCCC M10004600P [0,2,0,0,0,0|2,0,0]=4 117 B7R0.4 CC(O)CNCCN M10004602P [0,2,0,0,0,0|2,0,0]=4 118 B7R0.6 CC(O)C#CC(O)C M10050361P [0,2,0,0,0,0|2,0,0]=4 119 B7R0.1 CCCCCCCI M10061657P [0,2,0,0,0,0|2,0,0]=4 120 B7R0.1 CCCCOCCCl M10115661P [0,2,0,0,0,0|1,1,0]=4 121 B7R0.1 CCCSSCCC M10017032P [0,2,0,0,0,0|0,0,0]=2 122 B7R0.1 CCOCCOCC M10017029P [0,2,0,0,0,0|0,2,0]=4 123 B7R0.1 COCCOCCN M11203897P [0,2,0,0,0,0|1,1,0]=4 124 B7R0.1 ICCCCCCI M10017025P [0,2,0,0,0,0|2,0,0]=4 125 B7R0.1 NCCCCCCN M10083288P [0,2,0,0,0,0|2,0,0]=4 126 B7R0.1 NCCCNCCBr M10180506P [0,2,0,0,0,0|2,0,0]=4 127 B5R1.1 C1CCCS1 M10003672P [1,0,0,1,0,0|0,0,0]=2 128 B5R1.1 O1NCCC1 M10012567P [1,0,0,1,0,0|1,1,0]=4 129 B5R1.2 ClC1CCC1 M10027170P [1,0,0,1,0,0|2,0,0]=4 130 B5R1.3 CC[C@H]1OC1 M10057431P [1,0,0,1,0,0|1,1,0]=4 131 B5R1.3 CNC1CC1 M10424936P [1,0,0,1,0,0|2,0,0]=4 132 B7R1.1 BrCC1CCCC1 M10057867P [0,1,0,1,0,0|2,0,0]=4 133 B7R1.1 CCC1=NCCO1 M10115051P [0,1,0,1,0,0|1,1,0]=4 134 B7R1.1 COC1CCCC1 M10078199P [0,1,0,1,0,0|2,0,0]=4 135 B7R1.1 COC1CNCC1 M10742008P [0,1,0,1,0,0|2,0,0]=4 136 B7R1.1 CSC1=NCCS1 M10163702P [0,1,0,1,0,0|2,0,0]=4 137 B7R1.1 NCC1CCCC1 M10302882P [0,1,0,1,0,0|2,0,0]=4 138 B7R1.1 NCC1COCC1 M10794275P [0,1,0,1,0,0|1,1,0]=4 139 B7R1.1 NCC1COCC1 M10812914P [0,1,0,1,0,0|1,1,0]=4 140 B7R1.1 NCC1OCCC1 M10066380P [0,1,0,1,0,0|1,1,0]=4 141 B7R1.1 NC[C@@H]1OCCC1 M10102346P [0,1,0,1,0,0|1,1,0]=4 142 B7R1.1 NC[C@H]1OCCC1 M10102169P [0,1,0,1,0,0|1,1,0]=4 143 B7R1.1 OCC1COCC1 M10138830P [0,1,0,1,0,0|1,1,0]=4 144 B7R1.1 OC[C@@H]1CNCC1 M10673087P [0,1,0,1,0,0|2,0,0]=4 145 B7R1.1 OC[C@H]1CNCC1 M10673086P [0,1,0,1,0,0|2,0,0]=4 146 B7R1.3 CC1CNCCO1 M10198590P [0,1,0,1,0,0|1,1,0]=4 147 B7R1.3 CN1CCNCC1 M10003582P [0,1,0,1,0,0|2,0,0]=4 148 B7R1.3 C[C@@H]1NCCOC1 M11094562P [0,1,0,1,0,0|1,1,0]=4 149 B7R1.3 C[C@H]1CNCCC1 M10841057P [0,1,0,1,0,0|2,0,0]=4 150 B7R1.3 C[C@H]1CNCCO1 M10456369P [0,1,0,1,0,0|1,1,0]=4 151 B7R1.3 C[C@H]1CNCCO1 M11103989P [0,1,0,1,0,0|1,1,0]=4 152 B7R1.3 C[C@H]1NCCCC1 M10035322P [0,1,0,1,0,0|2,0,0]=4 153 B7R1.3 C[C@H]1NCCOC1 M10088620P [0,1,0,1,0,0|1,1,0]=4 154 B7R1.3 C[C@H]1NCCOC1 M10456366P [0,1,0,1,0,0|1,1,0]=4 155 B7R1.3 ClC1=CCCCC1 M10208207P [0,1,0,1,0,0|2,0,0]=4 156 B7R1.3 ClC1CCCCO1 M10051478P [0,1,0,1,0,0|1,1,0]=4 157 B7R1.3 ClC1CCNCC1 M10072346P [0,1,0,1,0,0|2,0,0]=4 158 B7R1.3 NC1CCCCC1 M10067868P [0,1,0,1,0,0|2,0,0]=4 159 B7R1.3 NC1CCCCC1 M10164877P [0,1,0,1,0,0|2,0,0]=4 160 B7R1.3 NC1CCCCC1 M10192982P [0,1,0,1,0,0|2,0,0]=4 161 B7R1.3 NC1CCCCC1 M10222576P [0,1,0,1,0,0|2,0,0]=4 162 B7R1.3 NC1CCNCC1 M10227998P [0,1,0,1,0,0|2,0,0]=4 163 B7R1.3 NC1CCSCC1 M10172428P [0,1,0,1,0,0|1,0,0]=3 164 B7R1.3 NC1CCSCC1 M10842884P [0,1,0,1,0,0|1,0,0]=3 165 B7R1.3 NC1CNCCC1 M10274112P [0,1,0,1,0,0|2,0,0]=4 166 B7R1.3 NN1CCCCC1 M10390507P [0,1,0,1,0,0|2,0,0]=4 167 B7R1.3 N[C@@H]1CNCCC1 M10481372P [0,1,0,1,0,0|2,0,0]=4 168 B7R1.3 N[C@@H]1COCCC1 M10121266P [0,1,0,1,0,0|1,1,0]=4 169 B7R1.3 N[C@@H]1COCCC1 M11098623P [0,1,0,1,0,0|1,1,0]=4 170 B7R1.3 N[C@H]1CNCCC1 M10725270P [0,1,0,1,0,0|2,0,0]=4 171 B7R1.3 N[C@H]1COCCC1 M11098624P [0,1,0,1,0,0|1,1,0]=4 172 B7R1.3 O=S1CCCCC1 M10067807P [0,1,0,1,0,0|1,0,1]=4 173 B7R1.3 ON1CCCCC1 M10066414P [0,1,0,1,0,0|2,0,0]=4 174 B7R1.4 O=C1C(C)CCC1 M10027182P [0,1,0,1,0,0|2,0,0]=4 175 B7R1.7 CCCCC1OC1 M10030748P [0,1,0,1,0,0|2,0,0]=4 176 B7R1.14 CC1(C)NCCC1 M10225767P [0,1,0,1,0,0|2,0,0]=4 177 B7R1.14 CC1(C)SCCN1 M10160446P [0,1,0,1,0,0|2,0,0]=4 178 B7R1.24 N1CCNCCC1 M10012608P [0,1,0,1,0,0|2,0,0]=4 179 B7R1.24 O1CCNCCC1 M10806668P [0,1,0,1,0,0|1,1,0]=4