0 B7R0.1 CCCCCCCI M10061657P [0,0,0,0,0,0|1,0,2]=3 1 B7R0.1 CCCCOCCCl M10115661P [0,0,0,0,0,0|2,0,2]=4 2 B7R0.1 CCCSSCCC M10017032P [0,0,0,0,0,0|3,0,1]=4 3 B7R0.1 CCOCCOCC M10017029P [0,0,0,0,0,0|3,0,1]=4 4 B7R0.1 ICCCCCCI M10017025P [0,0,0,0,0,0|2,0,2]=4 5 B7R0.1 NCCCCCCN M10083288P [0,0,0,0,0,0|2,0,2]=4 6 B7R0.1 NCCCNCCBr M10180506P [0,0,0,0,0,0|3,0,1]=4 7 B7R0.1 OCCCCOC=C M10151868P [0,0,0,0,0,0|1,0,3]=4 8 B6R0.6 C=CCCCCCl M10208182P [1,0,0,0,0,0|1,0,2]=4 9 B6R0.6 C=CCOCCO M10003808P [1,0,0,0,0,0|1,0,2]=4 10 B6R0.6 CCCCCCI M10197538P [1,0,0,0,0,0|1,0,1]=3 11 B6R0.6 CCCCC[Mg]Br M10018552P [1,0,0,0,0,0|2,0,1]=4 12 B6R0.6 CCCOCCCl M10247973P [1,0,0,0,0,0|2,0,1]=4 13 B6R0.6 COBCCCC M10104694P [1,0,0,0,0,0|2,0,1]=4 14 B6R0.6 COCCCCCl M10152312P [1,0,0,0,0,0|2,0,1]=4 15 B6R0.6 C\C=C\C=C\CO M10147270P [1,0,0,0,0,0|0,0,2]=3 16 B6R0.6 N#CCCOCC M10040387P [1,0,0,0,0,0|2,0,1]=4 17 B6R0.6 NCCCCCN M10031362P [1,0,0,0,0,0|2,0,1]=4 18 B6R0.6 OCCCCNC M10247660P [1,0,0,0,0,0|1,0,1]=3 19 B6R0.6 OCCSCCO M10003812P [1,0,0,0,0,0|2,0,1]=4 20 B6R0.6 [Li]CCCCCC M10170025P [1,0,0,0,0,0|1,0,1]=3 21 B8R0.1 O=C(OCC)CCCBr M10049666P [0,1,0,0,0,0|2,0,0]=3 22 B8R0.1 O=C(OCC)CCCCl M10051695P [0,1,0,0,0,0|2,0,0]=3 23 B8R0.1 O=C(OCC)CCCN M10097497P [0,1,0,0,0,0|2,0,0]=3 24 B8R0.1 O=C(OCC)COCC M10021200P [0,1,0,0,0,0|3,0,0]=4 25 B8R0.1 O=C(OCC)NCCCl M10089881P [0,1,0,0,0,0|3,0,0]=4 26 B8R0.4 BrCCCCCCCBr M10064364P [0,1,0,0,0,0|1,0,2]=4 27 B8R0.4 C#CCCCCCCO M10022227P [0,1,0,0,0,0|0,0,3]=4 28 B8R0.4 CCCCCCCCI M10017037P [0,1,0,0,0,0|1,0,2]=4 29 B8R0.4 CCCCC\C=C\C=O M10045247P [0,1,0,0,0,0|2,0,1]=4 30 B8R0.4 CCCCNCCCC M10087124P [0,1,0,0,0,0|1,0,2]=4 31 B8R0.4 NCCCNCCCN M10000337P [0,1,0,0,0,0|2,0,1]=4 32 B8R0.4 OCCCCCCCO M10017038P [0,1,0,0,0,0|0,0,2]=3 33 B8R0.4 OCCCNCCCO M10128009P [0,1,0,0,0,0|1,0,1]=3 34 B8R0.6 CCCCCC([O-])CC M10026061P [0,1,0,0,0,0|1,0,2]=4 35 B8R0.6 O=C(OC)CCCCCl M10129961P [0,1,0,0,0,0|2,0,1]=4 36 B8R0.6 O=C(OCCCC)CCl M10014991P [0,1,0,0,0,0|3,0,0]=4 37 B8R0.6 O=C(OCCCC)CO M10104696P [0,1,0,0,0,0|3,0,0]=4 38 B8R0.6 OCC(O)CCCCO M10003368P [0,1,0,0,0,0|1,0,2]=4 39 B8R0.7 CC(C)CCCCCO M12278016P [0,1,0,0,0,0|0,0,2]=3 40 B8R0.7 CC(O)CCCCCC M10060290P [0,1,0,0,0,0|0,0,2]=3 41 B8R0.7 CC(O)COCCCC M10069007P [0,1,0,0,0,0|1,0,2]=4 42 B8R0.7 CCCCCCB(O)O M10142242P [0,1,0,0,0,0|1,0,2]=4 43 B8R0.7 CCCC\C=C\C(O)=O M10158440P [0,1,0,0,0,0|2,0,1]=4 44 B8R0.7 C[C@@H](O)CCCCCC M10082518P [0,1,0,0,0,0|0,0,2]=3 45 B8R0.7 C[C@H](O)CCCCCC M10084602P [0,1,0,0,0,0|0,0,2]=3 46 B8R1.2 BrCC1CCNCC1 M10435546P [0,0,0,1,0,0|2,0,1]=4 47 B8R1.2 C=CC1CC=CCC1 M10002808P [0,0,0,1,0,0|1,0,1]=3 48 B8R1.2 CCC1CCCCC1 M10034651P [0,0,0,1,0,0|1,0,2]=4 49 B8R1.2 CCN1CCCCC1 M10020192P [0,0,0,1,0,0|2,0,1]=4 50 B8R1.2 COC1CCC=CO1 M11192011P [0,0,0,1,0,0|3,0,0]=4 51 B8R1.2 ICC1CCOCC1 M10644856P [0,0,0,1,0,0|2,0,1]=4 52 B8R1.2 N#CC1=CCCCO1 M10214168P [0,0,0,1,0,0|1,0,1]=3 53 B8R1.2 NCC1CCCCC1 M10052360P [0,0,0,1,0,0|1,0,2]=4 54 B8R1.2 NCC1CCOCC1 M10871026P [0,0,0,1,0,0|2,0,1]=4 55 B8R1.2 OCC1=CCCCO1 M12277756P [0,0,0,1,0,0|1,0,0]=2 56 B8R1.2 OCC1CC=CCC1 M10034671P [0,0,0,1,0,0|0,0,0]=1 57 B8R1.2 OCC1CCCCO1 M10002840P [0,0,0,1,0,0|1,0,2]=4 58 B8R1.2 OCC1CNCCO1 M10649725P [0,0,0,1,0,0|2,0,1]=4 59 B8R1.2 OC[C@@H]1CNCCO1 M10129691P [0,0,0,1,0,0|2,0,1]=4 60 B8R1.2 OC[C@H]1CNCCO1 M10784747P [0,0,0,1,0,0|2,0,1]=4 61 B8R1.2 ONC1CCCCC1 M10041269P [0,0,0,1,0,0|1,0,2]=4 62 B8R1.2 ONC1CCCCC1 M10187793P [0,0,0,1,0,0|1,0,2]=4 63 B8R1.5 NC1C(C)CCCC1 M10100073P [0,0,0,1,0,0|1,0,2]=4 64 B8R1.5 O[C@@H]1[C@@H](N)CCCC1 M10123131P [0,0,0,1,0,0|1,0,2]=4 65 B8R1.5 O[C@@H]1[C@@H](O)CCCC1 M10297347P [0,0,0,1,0,0|1,0,2]=4 66 B8R1.5 O[C@H]1[C@@H](N)CCCC1 M10821370P [0,0,0,1,0,0|1,0,2]=4 67 B8R1.5 O[C@H]1[C@H](N)CCCC1 M10123132P [0,0,0,1,0,0|1,0,2]=4 68 B8R1.5 O[C@H]1[C@H](O)CCCC1 M10031116P [0,0,0,1,0,0|1,0,2]=4 69 B8R1.8 NCCC1CCCC1 M10080142P [0,0,0,1,0,0|1,0,2]=4 70 B8R1.8 NCCC1CCCC1 M10940920P [0,0,0,1,0,0|1,0,2]=4 71 B8R1.11 OC[C@@H]1N(C)CCC1 M10637872P [0,0,0,1,0,0|1,0,2]=4 72 B8R1.22 CC1NCCCNC1 M10416824P [0,0,0,1,0,0|2,0,1]=4 73 B8R1.22 OC1CCCCCC1 M10012473P [0,0,0,1,0,0|0,0,2]=3 74 B8R1.49 C/1=C/CC\C=C/CC1 M10118067P [0,0,0,1,0,0|1,0,1]=3 75 B8R1.49 C/1=C/CC\C=C/CC1 M10226197P [0,0,0,1,0,0|1,0,1]=3 76 B8R1.49 C/1=C/CC\C=C/CC1 M10256883P [0,0,0,1,0,0|1,0,1]=3 77 B5R0.2 BrC\C=C\CBr M10099734P [2,0,0,0,0,0|2,0,0]=4 78 B5R0.2 C=CCCCCl M10023281P [2,0,0,0,0,0|1,0,0]=3 79 B5R0.2 C=CCC[Mg]Br M10101008P [2,0,0,0,0,0|2,0,0]=4 80 B5R0.2 C=CCOCC M10014106P [2,0,0,0,0,0|2,0,0]=4 81 B5R0.2 C=COCCO M10020115P [2,0,0,0,0,0|1,0,0]=3 82 B5R0.2 CCC#CCO M10085562P [2,0,0,0,0,0|0,0,2]=4 83 B5R0.2 CCCOC=C M10020114P [2,0,0,0,0,0|1,0,1]=4 84 B5R0.2 CCOCCCl M10016975P [2,0,0,0,0,0|2,0,0]=4 85 B5R0.2 CCSCCCl M10018543P [2,0,0,0,0,0|2,0,0]=4 86 B5R0.2 CCSCCO M10003744P [2,0,0,0,0,0|1,0,0]=3 87 B5R0.2 CC[Se][Se]CC M10016980P [2,0,0,0,0,0|2,0,0]=4 88 B5R0.2 C\C=C\OCC M10023285P [2,0,0,0,0,0|1,0,0]=3 89 B5R0.2 Cl[Mg]CCCC M10018540P [2,0,0,0,0,0|2,0,0]=4 90 B5R0.2 ICCCCI M10016968P [2,0,0,0,0,0|2,0,0]=4 91 B5R0.2 OCCCCBr M10196369P [2,0,0,0,0,0|1,0,0]=3 92 B5R0.2 OCCCCBr M10219049P [2,0,0,0,0,0|1,0,0]=3 93 B5R0.2 OCCCCCl M10030203P [2,0,0,0,0,0|1,0,0]=3 94 B5R0.2 OC\C=C\CCl M10033040P [2,0,0,0,0,0|1,0,0]=3 95 B7R0.3 O=C(OC)CCCN M10119950P [1,1,0,0,0,0|2,0,0]=4 96 B7R0.3 O=C(OCCC)CBr M10226573P [1,1,0,0,0,0|2,0,0]=4 97 B7R0.4 CC(CCCCBr)=O M10113189P [1,1,0,0,0,0|1,0,1]=4 98 B7R0.4 CC(N)CCCCC M10004600P [1,1,0,0,0,0|0,0,2]=4 99 B7R0.4 CCCCCB(O)O M10065828P [1,1,0,0,0,0|1,0,1]=4 100 B7R0.4 O=C(O)CCCCO M10123275P [1,1,0,0,0,0|1,0,1]=4 101 B7R0.4 O=C(O)CCOCC M10062024P [1,1,0,0,0,0|1,0,1]=4 102 B7R0.4 O=C([O-])CCCCO M10233260P [1,1,0,0,0,0|1,0,1]=4 103 B7R0.7 C=C(OCC)OCC M10046654P [1,1,0,0,0,0|2,0,0]=4 104 B7R0.7 CCCC(OCCl)=O M10221194P [1,1,0,0,0,0|2,0,0]=4 105 B7R0.7 C\C=C\C(OCC)=O M10116065P [1,1,0,0,0,0|1,0,1]=4 106 B7R0.7 O=C(OCC)CCS M10076471P [1,1,0,0,0,0|1,1,0]=4 107 B9R0.5 O=C(OCC)COCCCl M10148096P [0,2,0,0,0,0|2,0,0]=4 108 B9R0.18 O=C(CCCCl)CCCCl M10243374P [0,2,0,0,0,0|1,0,1]=4 109 B9R0.34 O=C(OCC)CC(O)CCl M10115530P [0,2,0,0,0,0|2,0,0]=4 110 B9R0.35 CCCC(C(O)CCC)=O M10012297P [0,2,0,0,0,0|1,0,1]=4 111 B9R0.48 CC(C)CCC(OCC)=O M10189485P [0,2,0,0,0,0|2,0,0]=4 112 B9R0.45 COCCOCCOCC M10024868P [0,2,0,0,0,0|1,0,1]=4 113 B9R0.45 ClCCOCCOCCO M10069568P [0,2,0,0,0,0|1,0,1]=4 114 B9R0.45 NCCOCCOCCO M10090455P [0,2,0,0,0,0|1,0,1]=4 115 B9R0.45 OCCCCCCCCBr M10256068P [0,2,0,0,0,0|0,0,2]=4 116 B9R0.45 OCCNCCNCCO M10063304P [0,2,0,0,0,0|1,0,1]=4 117 B9R0.46 O=C(OC)CCCCCO M10064340P [0,2,0,0,0,0|1,0,1]=4 118 B9R0.24 SCC(OCC(CO)O)=O M10210839P [0,2,0,0,0,0|2,0,0]=4 119 B9R0.47 C[C@H](O)C(OCCCC)=O M10223932P [0,2,0,0,0,0|2,0,0]=4 120 B7R1.1 BrCC1CCCC1 M10057867P [1,0,0,1,0,0|1,0,1]=4 121 B7R1.1 CCC1=NCCO1 M10115051P [1,0,0,1,0,0|1,0,0]=3 122 B7R1.1 NCC1CCCC1 M10302882P [1,0,0,1,0,0|1,0,1]=4 123 B7R1.1 NCC1COCC1 M10794275P [1,0,0,1,0,0|2,0,0]=4 124 B7R1.1 NCC1COCC1 M10812914P [1,0,0,1,0,0|2,0,0]=4 125 B7R1.1 NCC1OCCC1 M10066380P [1,0,0,1,0,0|1,0,1]=4 126 B7R1.1 NC[C@@H]1OCCC1 M10102346P [1,0,0,1,0,0|1,0,1]=4 127 B7R1.1 NC[C@H]1OCCC1 M10102169P [1,0,0,1,0,0|1,0,1]=4 128 B7R1.1 O=CC1OCCC1 M10109701P [1,0,0,1,0,0|1,0,1]=4 129 B7R1.1 OCC1COCC1 M10138830P [1,0,0,1,0,0|1,0,0]=3 130 B7R1.1 OC[C@@H]1CNCC1 M10673087P [1,0,0,1,0,0|1,0,0]=3 131 B7R1.1 OC[C@H]1CNCC1 M10673086P [1,0,0,1,0,0|1,0,0]=3 132 B7R1.3 CC1CNCCO1 M10198590P [1,0,0,1,0,0|1,0,1]=4 133 B7R1.3 C[C@H]1CNCCC1 M10841057P [1,0,0,1,0,0|1,0,1]=4 134 B7R1.3 C[C@H]1CNCCO1 M10456369P [1,0,0,1,0,0|1,0,1]=4 135 B7R1.3 C[C@H]1CNCCO1 M11103989P [1,0,0,1,0,0|1,0,1]=4 136 B7R1.3 C[C@H]1NCCCC1 M10035322P [1,0,0,1,0,0|1,0,1]=4 137 B7R1.3 ClC1=CCCCC1 M10208207P [1,0,0,1,0,0|2,0,0]=4 138 B7R1.3 ClC1CCCCO1 M10051478P [1,0,0,1,0,0|1,0,1]=4 139 B7R1.3 ClC1CCNCC1 M10072346P [1,0,0,1,0,0|2,0,0]=4 140 B7R1.3 NC1CCCCC1 M10067868P [1,0,0,1,0,0|1,0,1]=4 141 B7R1.3 NC1CCCCC1 M10164877P [1,0,0,1,0,0|1,0,1]=4 142 B7R1.3 NC1CCCCC1 M10192982P [1,0,0,1,0,0|1,0,1]=4 143 B7R1.3 NC1CCCCC1 M10222576P [1,0,0,1,0,0|1,0,1]=4 144 B7R1.3 NC1CCNCC1 M10227998P [1,0,0,1,0,0|2,0,0]=4 145 B7R1.3 NC1CCSCC1 M10172428P [1,0,0,1,0,0|2,0,0]=4 146 B7R1.3 NC1CCSCC1 M10842884P [1,0,0,1,0,0|2,0,0]=4 147 B7R1.3 ON1CCCCC1 M10066414P [1,0,0,1,0,0|1,0,1]=4 148 B7R1.4 CC1=CCCC1=O M10027183P [1,0,0,1,0,0|0,0,2]=4 149 B7R1.4 O=C1NCCC1O M10135336P [1,0,0,1,0,0|2,0,0]=4 150 B7R1.4 O=C1NCC[C@H]1O M10468150P [1,0,0,1,0,0|2,0,0]=4 151 B7R1.4 O[C@@H]1[C@@H](N)CCC1 M10430095P [1,0,0,1,0,0|1,0,1]=4 152 B7R1.4 O[C@@H]1[C@H](N)CCC1 M10841437P [1,0,0,1,0,0|1,0,1]=4 153 B7R1.4 O[C@H]1[C@@H](N)CCC1 M10743008P [1,0,0,1,0,0|1,0,1]=4 154 B7R1.4 O[C@H]1[C@H](N)CCC1 M10215039P [1,0,0,1,0,0|1,0,1]=4 155 B7R1.4 O[C@H]1[C@H](N)CCC1 M10430096P [1,0,0,1,0,0|1,0,1]=4 156 B7R1.4 O[C@H]1[C@H](O)CCC1 M10192705P [1,0,0,1,0,0|1,0,1]=4 157 B7R1.6 OCCC1COC1 M10845630P [1,0,0,1,0,0|1,0,1]=4 158 B7R1.7 CCCCC1OC1 M10030748P [1,0,0,1,0,0|0,0,1]=3 159 B7R1.24 N1CCNCCC1 M10012608P [1,0,0,1,0,0|2,0,0]=4 160 B7R1.24 O1CCNCCC1 M10806668P [1,0,0,1,0,0|1,0,0]=3 161 B9R1.2 OC1CN(CC)CCC1 M10123727P [0,1,0,1,0,0|1,0,1]=4 162 B9R1.8 BrCCC1OCCCO1 M10221972P [0,1,0,1,0,0|1,0,1]=4 163 B9R1.8 CCOC1CCC=CO1 M10003099P [0,1,0,1,0,0|2,0,0]=4 164 B9R1.8 N#CCC1=CCCCC1 M10099831P [0,1,0,1,0,0|1,0,1]=4 165 B9R1.8 OCCC1CCCCC1 M10063359P [0,1,0,1,0,0|0,0,2]=4 166 B9R1.8 OCCC1CCNCC1 M10599588P [0,1,0,1,0,0|0,0,2]=4 167 B9R1.8 OCCC1CNCCC1 M10145092P [0,1,0,1,0,0|0,0,2]=4 168 B9R1.8 OCCC1NCCNC1 M10053975P [0,1,0,1,0,0|1,0,1]=4 169 B9R1.8 OCCC1NCCOC1 M10873035P [0,1,0,1,0,0|1,0,1]=4 170 B9R1.8 OCC[C@@H]1NCCNC1 M11121589P [0,1,0,1,0,0|1,0,1]=4 171 B9R1.12 OCCCN1CCCC1 M10162297P [0,1,0,1,0,0|0,0,2]=4 172 B9R1.15 O[C@H]1[C@H](NC)CCCC1 M10171206P [0,1,0,1,0,0|0,0,2]=4 173 B9R1.33 CN1[C@H](CCO)CCC1 M10348642P [0,1,0,1,0,0|0,0,2]=4 174 B9R1.50 O=C1NCCCCCC1 M10018116P [0,1,0,1,0,0|2,0,0]=4 175 B9R1.73 O=C(C1CCC1)OCC M10133979P [0,1,0,1,0,0|2,0,0]=4 176 B9R1.89 COC1CCNCCC1 M10098596P [0,1,0,1,0,0|1,0,1]=4 177 B9R1.1 O=C1NCC(CO)CC1 M10769348P [0,1,0,1,0,0|1,0,0]=3 178 B9R1.1 OCC1CCN(C)CC1 M10167002P [0,1,0,1,0,0|1,0,1]=4 179 B9R1.11 O=C(C1=CCCC1)OC M10190686P [0,1,0,1,0,0|2,0,0]=4 180 B9R1.11 O=C(C1OCCC1)OC M10233304P [0,1,0,1,0,0|1,0,1]=4 181 B9R1.6 O=C(C1=CCCCO1)O M10214169P [0,1,0,1,0,0|1,0,1]=4 182 B9R2.65 OCC1[C@H]2CNC[C@@H]12 M10852316P [0,0,0,2,0,0|1,0,1]=4 183 B9R2.174 O1CC12CCCCC2 M10005989P [0,0,0,2,0,0|0,0,2]=4 184 B9R2.7 O=C1C2CC=CC2C1 M10121503P [0,0,0,2,0,0|0,0,2]=4