0 B6R0.4 C#CCCC(=O)O HR101408 [0,0,0,0,0,0|0,0,2]=2 1 B6R0.4 C#CCOC(=O)Cl HR143650 [0,0,0,0,0,0|2,0,2]=4 2 B6R0.4 C=C(C)CNCC HR128262 [0,0,0,0,0,0|3,0,0]=3 3 B6R0.4 C=CCCC(=O)Cl HR106043 [0,0,0,0,0,0|1,0,2]=3 4 B6R0.4 C=CCCC(=O)O HR128583 [0,0,0,0,0,0|0,0,2]=2 5 B6R0.4 CC(=O)CCCBr HR147487 [0,0,0,0,0,0|2,0,0]=2 6 B6R0.4 CC(=O)CCCCl HR100024 [0,0,0,0,0,0|2,0,0]=2 7 B6R0.4 CC(=O)CCCO HR136959 [0,0,0,0,0,0|2,0,0]=2 8 B6R0.4 CC(=O)NCCN HR128075 [0,0,0,0,0,0|3,0,0]=3 9 B6R0.4 CC(=O)NCCO HR100613 [0,0,0,0,0,0|3,0,0]=3 10 B6R0.4 CC(=O)OCCBr HR131354 [0,0,0,0,0,0|3,0,0]=3 11 B6R0.4 CC(Br)CCCBr HR123815 [0,0,0,0,0,0|3,0,1]=4 12 B6R0.4 CC(C)CCCBr HR133659 [0,0,0,0,0,0|3,0,1]=4 13 B6R0.4 CC(O)CCCO HR139458 [0,0,0,0,0,0|2,0,1]=3 14 B6R0.4 CCC#CC(C)O HR138958 [0,0,0,0,0,0|1,0,3]=4 15 B6R0.4 CCCCB(O)O HR137738 [0,0,0,0,0,0|1,0,1]=2 16 B6R0.4 CCCCC(=O)Cl HR147689 [0,0,0,0,0,0|1,0,0]=1 17 B6R0.4 CCCCC(=O)[O-] HR143929 [0,0,0,0,0,0|0,0,1]=1 18 B6R0.4 CCCCC(C)N HR107080 [0,0,0,0,0,0|2,0,1]=3 19 B6R0.4 CCCCC(C)O HR113264 [0,0,0,0,0,0|1,0,1]=2 20 B6R0.4 CCCCC(C)O HR141634 [0,0,0,0,0,0|1,0,1]=2 21 B6R0.4 CCCCC(N)=O HR110039 [0,0,0,0,0,0|1,0,0]=1 22 B6R0.4 CCCCN(C)C HR124181 [0,0,0,0,0,0|3,0,0]=3 23 B6R0.4 CCCC[Sn](=O)O HR135371 [0,0,0,0,0,0|1,0,0]=1 24 B6R0.4 CCCNC(N)=S HR109524 [0,0,0,0,0,0|2,1,0]=3 25 B6R0.4 CCCSC(C)=O HR137881 [0,0,0,0,0,0|2,0,0]=2 26 B6R0.4 CCNCC(=O)O HR105131 [0,0,0,0,0,0|1,0,0]=1 27 B6R0.4 CCOCC(=O)O HR123178 [0,0,0,0,0,0|1,0,0]=1 28 B6R0.4 CC\C=C\B(O)O HR116587 [0,0,0,0,0,0|1,0,3]=4 29 B6R0.4 CN(C)CCCBr HR107607 [0,0,0,0,0,0|4,0,0]=4 30 B6R0.4 CN(C)CCCBr HR147342 [0,0,0,0,0,0|4,0,0]=4 31 B6R0.4 CN(C)CCCCl HR109407 [0,0,0,0,0,0|4,0,0]=4 32 B6R0.4 CN(C)CCCCl HR137097 [0,0,0,0,0,0|4,0,0]=4 33 B6R0.4 CN(C)CCCS HR107362 [0,0,0,0,0,0|4,0,0]=4 34 B6R0.4 CNCCC(=O)O HR100194 [0,0,0,0,0,0|1,0,0]=1 35 B6R0.4 COCCC(C)O HR129774 [0,0,0,0,0,0|2,0,1]=3 36 B6R0.4 COCCC(O)Br HR10478 [0,0,0,0,0,0|2,0,1]=3 37 B6R0.4 CO\C=C\C(C)=O HR138997 [0,0,0,0,0,0|2,0,2]=4 38 B6R0.4 CSCCC(C)=O HR133952 [0,0,0,0,0,0|2,0,0]=2 39 B6R0.4 N#CCCC(=O)O HR103469 [0,0,0,0,0,0|1,0,1]=2 40 B6R0.4 N#CCNC(N)=O HR145566 [0,0,0,0,0,0|3,0,1]=4 41 B6R0.4 N=C(N)SCCN HR128755 [0,0,0,0,0,0|4,0,0]=4 42 B6R0.4 NCCCC(=O)O HR130958 [0,0,0,0,0,0|1,0,0]=1 43 B6R0.4 O=C(Cl)CCCBr HR102428 [0,0,0,0,0,0|2,0,0]=2 44 B6R0.4 O=C(Cl)CCCCl HR129406 [0,0,0,0,0,0|2,0,0]=2 45 B6R0.4 O=C(Cl)OCCCl HR132842 [0,0,0,0,0,0|3,0,0]=3 46 B6R0.4 O=C(Cl)OCCCl HR17418 [0,0,0,0,0,0|3,0,0]=3 47 B6R0.4 O=C(O)C#CCO HR112666 [0,0,0,0,0,0|1,0,2]=3 48 B6R0.4 O=C(O)CCCBr HR131673 [0,0,0,0,0,0|1,0,0]=1 49 B6R0.4 O=C(O)CCCCl HR120152 [0,0,0,0,0,0|1,0,0]=1 50 B6R0.4 O=CCCC(=O)O HR134907 [0,0,0,0,0,0|1,0,1]=2 51 B6R0.4 O=CCC[N+](=O)[O-] HR114611 [0,0,0,0,0,0|2,0,2]=4 52 B5R0.1 C#CCC(=O)O HR107056 [1,0,0,0,0,0|0,0,2]=3 53 B5R0.1 C=C(C)CCO HR139358 [1,0,0,0,0,0|3,0,0]=4 54 B5R0.1 C=C(C)OCC HR135003 [1,0,0,0,0,0|3,0,0]=4 55 B5R0.1 C=CCC(=O)O HR124911 [1,0,0,0,0,0|0,0,2]=3 56 B5R0.1 CC#CC(=O)O HR16226 [1,0,0,0,0,0|0,0,2]=3 57 B5R0.1 CC(=O)CCCl HR106274 [1,0,0,0,0,0|2,0,0]=3 58 B5R0.1 CC(=O)CCO HR131203 [1,0,0,0,0,0|2,0,0]=3 59 B5R0.1 CC(=O)NCO HR105862 [1,0,0,0,0,0|3,0,0]=4 60 B5R0.1 CC(=O)OCBr HR127457 [1,0,0,0,0,0|3,0,0]=4 61 B5R0.1 CC(=O)OCCl HR101207 [1,0,0,0,0,0|3,0,0]=4 62 B5R0.1 CC(O)CCO HR109448 [1,0,0,0,0,0|2,0,1]=4 63 B5R0.1 CC(O)CCO HR135973 [1,0,0,0,0,0|2,0,1]=4 64 B5R0.1 CCCB(O)O HR138252 [1,0,0,0,0,0|1,0,1]=3 65 B5R0.1 CCCC(=N)N HR126811 [1,0,0,0,0,0|2,0,0]=3 66 B5R0.1 CCCC(=O)Cl HR147587 [1,0,0,0,0,0|1,0,0]=2 67 B5R0.1 CCCC(=O)[O-] HR129884 [1,0,0,0,0,0|0,0,1]=2 68 B5R0.1 CCCC(=O)[O-] HR137474 [1,0,0,0,0,0|0,0,1]=2 69 B5R0.1 CCCC(C)Cl HR139357 [1,0,0,0,0,0|2,0,1]=4 70 B5R0.1 CCCC(C)N HR107397 [1,0,0,0,0,0|2,0,1]=4 71 B5R0.1 CCCC(C)O HR136841 [1,0,0,0,0,0|1,0,1]=3 72 B5R0.1 CCCC(C)O HR137349 [1,0,0,0,0,0|1,0,1]=3 73 B5R0.1 CCCC(C)S HR128554 [1,0,0,0,0,0|1,1,1]=4 74 B5R0.1 CCCC(N)=O HR137715 [1,0,0,0,0,0|1,0,0]=2 75 B5R0.1 CCNC(C)=O HR100775 [1,0,0,0,0,0|2,0,0]=3 76 B5R0.1 CCNC(N)=O HR126748 [1,0,0,0,0,0|2,0,0]=3 77 B5R0.1 CCNC(N)=[NH2+] HR145586 [1,0,0,0,0,0|3,0,0]=4 78 B5R0.1 CCOC(=N)N HR110036 [1,0,0,0,0,0|3,0,0]=4 79 B5R0.1 CCOC(=O)Cl IVSA07702 [1,0,0,0,0,0|2,0,0]=3 80 B5R0.1 CCOC(=S)[S-] HR127593 [1,0,0,0,0,0|1,2,0]=4 81 B5R0.1 CCOC(C)=N HR126641 [1,0,0,0,0,0|3,0,0]=4 82 B5R0.1 CCOC(N)=O HR123919 [1,0,0,0,0,0|2,0,0]=3 83 B5R0.1 CCSC(C)=O HR138399 [1,0,0,0,0,0|2,0,0]=3 84 B5R0.1 CCSC(C)=S HR129552 [1,0,0,0,0,0|2,1,0]=4 85 B5R0.1 CNCC(=O)O HR132326 [1,0,0,0,0,0|1,0,0]=2 86 B5R0.1 CNCC(=O)[O-] HR133335 [1,0,0,0,0,0|1,0,1]=3 87 B5R0.1 COCC(=N)N HR105552 [1,0,0,0,0,0|3,0,0]=4 88 B5R0.1 COCC(=O)Cl HR138385 [1,0,0,0,0,0|2,0,0]=3 89 B5R0.1 COCC(=O)O HR137614 [1,0,0,0,0,0|1,0,0]=2 90 B5R0.1 COCC(C)=O HR124731 [1,0,0,0,0,0|2,0,0]=3 91 B5R0.1 COCC(C)O HR106636 [1,0,0,0,0,0|2,0,1]=4 92 B5R0.1 COCC(C)O HR128113 [1,0,0,0,0,0|2,0,1]=4 93 B5R0.1 COCC(C)O HR1904 [1,0,0,0,0,0|2,0,1]=4 94 B5R0.1 CSCC(C)=O HR104929 [1,0,0,0,0,0|2,0,0]=3 95 B5R0.1 CSCC(N)=O HR105921 [1,0,0,0,0,0|2,0,0]=3 96 B5R0.1 C\C=C\C(=O)Cl HR100850 [1,0,0,0,0,0|1,0,2]=4 97 B5R0.1 C\C=C\C(=O)Cl HR133043 [1,0,0,0,0,0|1,0,2]=4 98 B5R0.1 N#CCC(=O)O HR146964 [1,0,0,0,0,0|1,0,1]=3 99 B5R0.1 N#CCC(N)=O HR124127 [1,0,0,0,0,0|2,0,1]=4 100 B5R0.1 NC(=O)CCO HR101159 [1,0,0,0,0,0|2,0,0]=3 101 B5R0.1 NC(=O)NCO HR121643 [1,0,0,0,0,0|3,0,0]=4 102 B5R0.1 NCCC(=O)O HR120135 [1,0,0,0,0,0|1,0,0]=2 103 B5R0.1 NCCC(=O)O HR136538 [1,0,0,0,0,0|1,0,0]=2 104 B5R0.1 NCCC(N)=O HR123050 [1,0,0,0,0,0|2,0,0]=3 105 B5R0.1 NOCC(=O)O HR107090 [1,0,0,0,0,0|2,0,0]=3 106 B5R0.1 O=C(Cl)CCBr HR132550 [1,0,0,0,0,0|2,0,0]=3 107 B5R0.1 O=C(Cl)CCCl HR125686 [1,0,0,0,0,0|2,0,0]=3 108 B5R0.1 O=C(O)CCBr HR146768 [1,0,0,0,0,0|1,0,0]=2 109 B5R0.1 O=C(O)CCI HR118002 [1,0,0,0,0,0|1,0,0]=2 110 B5R0.1 O=C(O)CCO HR12598 [1,0,0,0,0,0|1,0,0]=2 111 B5R0.1 O=C(O)CCS BACQ02107 [1,0,0,0,0,0|1,0,0]=2 112 B5R0.1 O=C(O)\C=C\I HR145754 [1,0,0,0,0,0|1,0,2]=4 113 B5R0.1 O=[N+]([O-])CCO HR122802 [1,0,0,0,0,0|2,0,1]=4 114 B5R0.2 BrCCCCBr HR135783 [1,0,0,0,0,0|2,0,1]=4 115 B5R0.2 C#CCCCBr HR107694 [1,0,0,0,0,0|2,0,1]=4 116 B5R0.2 C#CCCCCl HR138891 [1,0,0,0,0,0|2,0,1]=4 117 B5R0.2 C#CCCCO VIJL03307 [1,0,0,0,0,0|0,0,3]=4 118 B5R0.2 C=CCCC=C HR145060 [1,0,0,0,0,0|1,0,2]=4 119 B5R0.2 C=CCCCBr HR138516 [1,0,0,0,0,0|2,0,0]=3 120 B5R0.2 C=CCCCN HR114551 [1,0,0,0,0,0|2,0,0]=3 121 B5R0.2 C=CCCCO HR127694 [1,0,0,0,0,0|2,0,0]=3 122 B5R0.2 C=CCC[Mg]Br HR117163 [1,0,0,0,0,0|3,0,0]=4 123 B5R0.2 C=CCSSC HR124486 [1,0,0,0,0,0|3,0,0]=4 124 B5R0.2 C=COCCC HR122922 [1,0,0,0,0,0|2,0,0]=3 125 B5R0.2 C=COCCO HR122391 [1,0,0,0,0,0|3,0,0]=4 126 B5R0.2 CCC#CCO HR139189 [1,0,0,0,0,0|0,0,3]=4 127 B5R0.2 CCCCSC HR128739 [1,0,0,0,0,0|2,0,0]=3 128 B5R0.2 CCCC[Mg]Cl HR114410 [1,0,0,0,0,0|2,0,0]=3 129 B5R0.2 CCCN=C=S HR101077 [1,0,0,0,0,0|1,1,1]=4 130 B5R0.2 CCCNCC HR129859 [1,0,0,0,0,0|2,0,1]=4 131 B5R0.2 CCCSC#N HR138481 [1,0,0,0,0,0|2,0,1]=4 132 B5R0.2 CCCSCC HR131098 [1,0,0,0,0,0|2,0,1]=4 133 B5R0.2 CCCSSC HR127587 [1,0,0,0,0,0|3,0,0]=4 134 B5R0.2 CCNCCN HR124923 [1,0,0,0,0,0|2,0,1]=4 135 B5R0.2 CCNCCO HR131326 [1,0,0,0,0,0|1,0,1]=3 136 B5R0.2 CCOCCBr HR147270 [1,0,0,0,0,0|2,0,1]=4 137 B5R0.2 CCOCCCl HR125621 [1,0,0,0,0,0|2,0,1]=4 138 B5R0.2 CCOCCN HR133098 [1,0,0,0,0,0|2,0,1]=4 139 B5R0.2 CCOCCN HR141597 [1,0,0,0,0,0|2,0,1]=4 140 B5R0.2 CCO\C=C\Br ATXF02514 [1,0,0,0,0,0|2,0,1]=4 141 B5R0.2 CCSCCCl HR138028 [1,0,0,0,0,0|2,0,1]=4 142 B5R0.2 CC\C=C\C=O HR111713 [1,0,0,0,0,0|0,0,2]=3 143 B5R0.2 CC\C=C\C=O HR139459 [1,0,0,0,0,0|0,0,2]=3 144 B5R0.2 CNCCC#N HR138081 [1,0,0,0,0,0|2,0,1]=4 145 B5R0.2 CNCCCN HR127543 [1,0,0,0,0,0|2,0,1]=4 146 B5R0.2 CNCCNC HR134870 [1,0,0,0,0,0|3,0,0]=4 147 B5R0.2 COCCC#N HR131327 [1,0,0,0,0,0|2,0,1]=4 148 B5R0.2 COCCCBr HR11240 [1,0,0,0,0,0|2,0,1]=4 149 B5R0.2 COCCCCl HR128474 [1,0,0,0,0,0|2,0,1]=4 150 B5R0.2 COCCCN HR131273 [1,0,0,0,0,0|2,0,1]=4 151 B5R0.2 COCCCO HR1936 [1,0,0,0,0,0|1,0,1]=3 152 B5R0.2 COCCOC HR147135 [1,0,0,0,0,0|3,0,0]=4 153 B5R0.2 CSCCCCl HR118093 [1,0,0,0,0,0|2,0,1]=4 154 B5R0.2 C\C=C\CCC HR121014 [1,0,0,0,0,0|1,0,1]=3 155 B5R0.2 C\C=C\OCC HR128979 [1,0,0,0,0,0|2,0,1]=4 156 B5R0.2 ClCCCCBr AZXF00302 [1,0,0,0,0,0|2,0,1]=4 157 B5R0.2 ClCCCCI HR102777 [1,0,0,0,0,0|2,0,1]=4 158 B5R0.2 ICCCCI HR127157 [1,0,0,0,0,0|2,0,1]=4 159 B5R0.2 N#CCCC=O HR111731 [1,0,0,0,0,0|1,0,1]=3 160 B5R0.2 N#CCCCBr HR128031 [1,0,0,0,0,0|2,0,1]=4 161 B5R0.2 N#CCCCCl HR129927 [1,0,0,0,0,0|2,0,1]=4 162 B5R0.2 NCCCCBr HR148711 [1,0,0,0,0,0|2,0,1]=4 163 B5R0.2 NCCCCN HR123185 [1,0,0,0,0,0|2,0,1]=4 164 B5R0.2 NCCCCO HR105259 [1,0,0,0,0,0|1,0,1]=3 165 B5R0.2 O=C=NCCCl HR134295 [1,0,0,0,0,0|2,0,1]=4 166 B5R0.2 O=CCCC=O HR100601 [1,0,0,0,0,0|1,0,1]=3 167 B5R0.2 O=COCCO HR145529 [1,0,0,0,0,0|2,0,0]=3 168 B5R0.2 OCCCCCl HR129662 [1,0,0,0,0,0|1,0,1]=3 169 B5R0.2 SCCCCS HR128290 [1,0,0,0,0,0|1,1,1]=4 170 B7R0.2 CC(=O)OC(Br)CBr HR133286 [0,1,0,0,0,0|3,0,0]=4 171 B7R0.2 CC(=O)OC(Cl)CCl HR133017 [0,1,0,0,0,0|3,0,0]=4 172 B7R0.2 CCC(=O)CC(C)=O HR133940 [0,1,0,0,0,0|1,0,1]=3 173 B7R0.2 CCC(C)CC(=O)O HR11273 [0,1,0,0,0,0|0,0,0]=1 174 B7R0.2 CCC(C)CC(=O)O HR135865 [0,1,0,0,0,0|0,0,0]=1 175 B7R0.2 CCC(C)CC(C)N HR121358 [0,1,0,0,0,0|2,0,1]=4 176 B7R0.2 CCC(C)CC(C)N HR123488 [0,1,0,0,0,0|2,0,1]=4 177 B7R0.2 CCC(C)NC(N)=O HR114250 [0,1,0,0,0,0|2,0,0]=3 178 B7R0.2 CCC(C)OC(=O)[O-] HR144165 [0,1,0,0,0,0|1,0,1]=3 179 B7R0.2 CCC(N)CC(=O)O HR114631 [0,1,0,0,0,0|0,0,0]=1 180 B7R0.2 CCC(N)CC(=O)O HR143295 [0,1,0,0,0,0|0,0,0]=1 181 B7R0.2 CCC(N)CC(=O)O HR147022 [0,1,0,0,0,0|0,0,0]=1 182 B7R0.2 CNC(=O)CC(C)=O HR100837 [0,1,0,0,0,0|2,0,1]=4 183 B7R0.2 COC(=O)CC(C)=O TECQ03701 [0,1,0,0,0,0|2,0,1]=4 184 B7R0.2 COC(=O)CC(N)=O HR118636 [0,1,0,0,0,0|2,0,1]=4 185 B7R0.2 NCC(O)CC(=O)O HR137304 [0,1,0,0,0,0|1,0,0]=2 186 B7R0.2 NCC(O)CC(=O)[O-] HR128768 [0,1,0,0,0,0|1,0,1]=3 187 B7R0.3 C=CC(=O)OCCC HR144889 [0,1,0,0,0,0|2,0,0]=3 188 B7R0.3 C=CC(=O)OCCO HR125757 [0,1,0,0,0,0|3,0,0]=4 189 B7R0.3 CC(CO)CCCO HR145878 [0,1,0,0,0,0|2,0,1]=4 190 B7R0.3 CCCCC(=O)NN HR113250 [0,1,0,0,0,0|1,0,0]=2 191 B7R0.3 CCCCC(Br)CBr HR101739 [0,1,0,0,0,0|2,0,1]=4 192 B7R0.3 CCCCC(O)CC HR100535 [0,1,0,0,0,0|1,0,1]=3 193 B7R0.3 CCCCC(O)CO HR100017 [0,1,0,0,0,0|0,0,2]=3 194 B7R0.3 CCCC\C(C)=N/O HR101112 [0,1,0,0,0,0|1,0,0]=2 195 B7R0.3 CCCOC(=O)CC HR127273 [0,1,0,0,0,0|2,0,0]=3 196 B7R0.3 COC(=O)CCC#N HR113384 [0,1,0,0,0,0|1,0,1]=3 197 B7R0.3 COC(=O)CCC=O HR116651 [0,1,0,0,0,0|1,0,1]=3 198 B7R0.3 COC(=O)CCCBr HR134912 [0,1,0,0,0,0|1,0,0]=2 199 B7R0.3 COC(=O)CCCCl HR131361 [0,1,0,0,0,0|1,0,0]=2 200 B7R0.3 COC(=O)CCCN HR105959 [0,1,0,0,0,0|1,0,0]=2 201 B7R0.3 COC(=O)CN=C=O DACQ01003 [0,1,0,0,0,0|2,0,1]=4 202 B7R0.3 COC(=O)\C=C\CBr HR131230 [0,1,0,0,0,0|1,0,2]=4 203 B7R0.3 COCCC(=O)OC HR130750 [0,1,0,0,0,0|1,0,0]=2 204 B7R0.3 COCCC(C)OC HR124557 [0,1,0,0,0,0|2,0,1]=4 205 B7R0.3 CO\C=C\C(=O)OC HR100409 [0,1,0,0,0,0|1,0,2]=4 206 B7R0.3 CO\C=C\C(=O)OC HR123737 [0,1,0,0,0,0|1,0,2]=4 207 B7R0.3 CSCCC(N)CO HR124191 [0,1,0,0,0,0|2,0,1]=4 208 B7R0.3 CSCCC(N)CO HR124440 [0,1,0,0,0,0|2,0,1]=4 209 B7R0.3 C\C=C\CC(=O)OC HR127455 [0,1,0,0,0,0|0,0,2]=3 210 B7R0.4 C#CCCCC(=O)O HR119998 [0,1,0,0,0,0|0,0,1]=2 211 B7R0.4 C=CCCCC(=O)O HR110118 [0,1,0,0,0,0|0,0,1]=2 212 B7R0.4 C=CCNCC(=O)O HR144457 [0,1,0,0,0,0|0,0,2]=3 213 B7R0.4 C=CCNCC(=O)O HR146187 [0,1,0,0,0,0|0,0,2]=3 214 B7R0.4 CC(=O)CCCCBr HR125447 [0,1,0,0,0,0|1,0,0]=2 215 B7R0.4 CC(=O)CCCCCl HR124124 [0,1,0,0,0,0|1,0,0]=2 216 B7R0.4 CC(=O)OCCCCl HR130837 [0,1,0,0,0,0|2,0,0]=3 217 B7R0.4 CC(C)CCCCBr HR119057 [0,1,0,0,0,0|2,0,1]=4 218 B7R0.4 CC(C)CCCCO HR145339 [0,1,0,0,0,0|2,0,1]=4 219 B7R0.4 CC(O)CCCCO HR100920 [0,1,0,0,0,0|1,0,1]=3 220 B7R0.4 CCCCCB(O)O HR142127 [0,1,0,0,0,0|1,0,1]=3 221 B7R0.4 CCCCCC(C)Br HR136114 [0,1,0,0,0,0|2,0,1]=4 222 B7R0.4 CCCCCC(C)O HR113580 [0,1,0,0,0,0|1,0,1]=3 223 B7R0.4 CCCCCC(C)O HR113894 [0,1,0,0,0,0|1,0,1]=3 224 B7R0.4 CCCCCC(C)O HR133526 [0,1,0,0,0,0|1,0,1]=3 225 B7R0.4 CCCCNC(N)=O HR125670 [0,1,0,0,0,0|1,0,0]=2 226 B7R0.4 CCCCOC(N)=O HR123655 [0,1,0,0,0,0|1,0,0]=2 227 B7R0.4 CCCCO[P+](=O)O HR109028 [0,1,0,0,0,0|1,0,0]=2 228 B7R0.4 CCCOCC(C)O HR142954 [0,1,0,0,0,0|1,0,1]=3 229 B7R0.4 CCC\C=C\C(C)=O HR30170 [0,1,0,0,0,0|1,0,1]=3 230 B7R0.4 CCOCC=C(C)C HR111947 [0,1,0,0,0,0|2,0,1]=4 231 B7R0.4 CCO\C=C\C(=O)Cl HR144705 [0,1,0,0,0,0|1,0,2]=4 232 B7R0.4 CCO\C=C\C(=O)O HR20958 [0,1,0,0,0,0|0,0,2]=3 233 B7R0.4 CC\C=C\CC(=O)O HR109903 [0,1,0,0,0,0|0,0,1]=2 234 B7R0.4 CN(C)CCCCN HR106772 [0,1,0,0,0,0|3,0,0]=4 235 B7R0.4 C\C=C\C=C\C(=O)O HR125524 [0,1,0,0,0,0|0,0,3]=4 236 B7R0.4 N#CCCCC(=O)O HR118843 [0,1,0,0,0,0|0,0,1]=2 237 B7R0.4 N#CCSCC(=O)O HR110059 [0,1,0,0,0,0|1,0,1]=3 238 B7R0.4 N#CCSCC(=O)[O-] HR136238 [0,1,0,0,0,0|1,0,2]=4 239 B7R0.4 NC(=O)COCCCl HR115417 [0,1,0,0,0,0|2,0,0]=3 240 B7R0.4 NCCCCC(=O)O HR127046 [0,1,0,0,0,0|0,0,0]=1 241 B7R0.4 NCCCCC(=O)O HR139651 [0,1,0,0,0,0|0,0,0]=1 242 B7R0.4 O=C(Cl)CCCCBr HR138251 [0,1,0,0,0,0|1,0,0]=2 243 B7R0.4 O=C(Cl)CCCCCl HR135830 [0,1,0,0,0,0|1,0,0]=2 244 B7R0.4 O=C(Cl)OCCCCl HR136628 [0,1,0,0,0,0|2,0,0]=3 245 B7R0.4 O=C(O)CCCCBr HR127598 [0,1,0,0,0,0|0,0,0]=1 246 B7R0.4 O=C(O)CCCCCl HR127871 [0,1,0,0,0,0|0,0,0]=1 247 B7R0.4 O=C(O)COCCCl HR100767 [0,1,0,0,0,0|1,0,0]=2 248 B7R0.4 O=S(Cl)OCCCF HR101826 [0,1,0,0,0,0|3,0,0]=4 249 B7R0.5 C#CCC(N)C(=O)O HR133685 [0,1,0,0,0,0|0,0,2]=3 250 B7R0.5 C#CCC(N)C(=O)O HR135675 [0,1,0,0,0,0|0,0,2]=3 251 B7R0.5 C#CCC(N)C(=O)O HR135939 [0,1,0,0,0,0|0,0,2]=3 252 B7R0.5 C=CCC(C)C(=O)O HR143156 [0,1,0,0,0,0|0,0,2]=3 253 B7R0.5 C=CCC(N)C(=O)O HR106860 [0,1,0,0,0,0|0,0,2]=3 254 B7R0.5 C=CCC(N)C(=O)O HR119232 [0,1,0,0,0,0|0,0,2]=3 255 B7R0.5 C=CCC(N)C(=O)O HR134381 [0,1,0,0,0,0|0,0,2]=3 256 B7R0.5 C=CCC(N)C(=O)O HR136466 [0,1,0,0,0,0|0,0,2]=3 257 B7R0.5 C=CCC(N)C(=O)O HR138518 [0,1,0,0,0,0|0,0,2]=3 258 B7R0.5 CCCC(=O)C(=O)O HR138596 [0,1,0,0,0,0|0,0,1]=2 259 B7R0.5 CCCC(=O)C(C)=O HR139186 [0,1,0,0,0,0|1,0,1]=3 260 B7R0.5 CCCC(Br)C(=O)Cl HR140278 [0,1,0,0,0,0|1,0,0]=2 261 B7R0.5 CCCC(Br)C(=O)O HR114924 [0,1,0,0,0,0|0,0,0]=1 262 B7R0.5 CCCC(C)C(=O)O HR131664 [0,1,0,0,0,0|0,0,0]=1 263 B7R0.5 CCCC(N)C(=O)O HR122649 [0,1,0,0,0,0|0,0,0]=1 264 B7R0.5 CCCC(N)C(=O)O HR136723 [0,1,0,0,0,0|0,0,0]=1 265 B7R0.5 CCCC(N)C(=O)O HR138486 [0,1,0,0,0,0|0,0,0]=1 266 B7R0.5 CCCC(O)C(C)C HR101888 [0,1,0,0,0,0|2,0,1]=4 267 B7R0.5 CCOC(=O)C(=O)Cl HR138954 [0,1,0,0,0,0|2,0,1]=4 268 B7R0.5 CCOC(=O)C(C)=O HR135005 [0,1,0,0,0,0|2,0,1]=4 269 B7R0.5 CCOC(=S)C(N)=O HR125905 [0,1,0,0,0,0|2,0,1]=4 270 B7R0.5 CC\C=C(\C)C(=O)O HR131305 [0,1,0,0,0,0|0,0,2]=3 271 B7R0.5 CC\C=C(\C)C(=O)O HR138938 [0,1,0,0,0,0|0,0,2]=3 272 B7R0.5 CNCC(N)C(=O)O HR146211 [0,1,0,0,0,0|1,0,0]=2 273 B7R0.5 COCC(N)C(=O)O HR108882 [0,1,0,0,0,0|1,0,0]=2 274 B7R0.5 COCC(N)C(=O)O HR109701 [0,1,0,0,0,0|1,0,0]=2 275 B7R0.5 COCC(N)C(=O)O HR110015 [0,1,0,0,0,0|1,0,0]=2 276 B7R0.5 COCC(N)C(=O)O HR115078 [0,1,0,0,0,0|1,0,0]=2 277 B7R0.5 COCC(N)C(=O)O HR115700 [0,1,0,0,0,0|1,0,0]=2 278 B7R0.5 CSCC(N)C(=O)O HR134174 [0,1,0,0,0,0|1,0,0]=2 279 B7R0.5 NC(CCBr)C(=O)O HR102483 [0,1,0,0,0,0|1,0,0]=2 280 B7R0.5 NC(CCO)C(=O)O HR122160 [0,1,0,0,0,0|1,0,0]=2 281 B7R0.5 NC(CCO)C(=O)O HR127129 [0,1,0,0,0,0|1,0,0]=2 282 B7R0.5 NC(CCO)C(=O)O HR129910 [0,1,0,0,0,0|1,0,0]=2 283 B7R0.5 NC(CCS)C(=O)O HR100636 [0,1,0,0,0,0|1,0,0]=2 284 B7R0.5 NC(CCS)C(=O)O HR137923 [0,1,0,0,0,0|1,0,0]=2 285 B7R0.5 NCCC(N)C(=O)O HR112825 [0,1,0,0,0,0|1,0,0]=2 286 B7R0.5 NCCC(N)C(=O)O HR14752 [0,1,0,0,0,0|1,0,0]=2 287 B7R0.5 O=C(Cl)C(Br)CCBr HR119984 [0,1,0,0,0,0|2,0,0]=3 288 B7R0.5 O=C(O)C(Br)CCBr HR138979 [0,1,0,0,0,0|1,0,0]=2 289 B7R0.6 C=C(C)COC(C)=O HR110682 [0,1,0,0,0,0|2,0,1]=4 290 B7R0.6 CC(=O)CCC(=O)O HR127576 [0,1,0,0,0,0|0,0,1]=2 291 B7R0.6 CC(=O)CCC(=O)[O-] HR143916 [0,1,0,0,0,0|0,0,2]=3 292 B7R0.6 CC(=O)CCC(C)=O HR125376 [0,1,0,0,0,0|1,0,1]=3 293 B7R0.6 CC(=O)CNC(C)=O HR146276 [0,1,0,0,0,0|2,0,1]=4 294 B7R0.6 CC(=O)COC(C)=O HR123551 [0,1,0,0,0,0|2,0,1]=4 295 B7R0.6 CC(=O)NCC(=O)O HR138579 [0,1,0,0,0,0|1,0,1]=3 296 B7R0.6 CC(=O)OCC(=O)Cl HR135462 [0,1,0,0,0,0|2,0,1]=4 297 B7R0.6 CC(=O)OCC(=O)O HR120464 [0,1,0,0,0,0|1,0,1]=3 298 B7R0.6 CC(=O)\C=C\C(C)C HR142759 [0,1,0,0,0,0|1,0,2]=4 299 B7R0.6 CC(Br)CCC(C)Br HR138142 [0,1,0,0,0,0|2,0,1]=4 300 B7R0.6 CC(C)=CCC(=O)O HR108591 [0,1,0,0,0,0|0,0,2]=3 301 B7R0.6 CC(C)CCB(O)O HR142030 [0,1,0,0,0,0|1,0,1]=3 302 B7R0.6 CC(C)CCC(=O)Cl HR101969 [0,1,0,0,0,0|1,0,0]=2 303 B7R0.6 CC(C)CCC(=O)O HR141883 [0,1,0,0,0,0|0,0,0]=1 304 B7R0.6 CC(C)CCC(C)N HR130987 [0,1,0,0,0,0|2,0,1]=4 305 B7R0.6 CC(C)\C=C\C(=O)[O-] HR107648 [0,1,0,0,0,0|0,0,3]=4 306 B7R0.6 CC(O)CCC(C)O HR127516 [0,1,0,0,0,0|1,0,1]=3 307 B7R0.6 CC(O)CCC(C)O HR141439 [0,1,0,0,0,0|1,0,1]=3 308 B7R0.6 CC(O)CCC(C)O HR141535 [0,1,0,0,0,0|1,0,1]=3 309 B7R0.6 CN(C)CCC(=O)O HR114553 [0,1,0,0,0,0|1,0,0]=2 310 B7R0.6 CN(C)CCC(=O)O HR147791 [0,1,0,0,0,0|1,0,0]=2 311 B7R0.6 C[S+](C)CCC(=O)O HR107679 [0,1,0,0,0,0|1,0,0]=2 312 B7R0.6 C[S+](C)CCC(=O)[O-] HR144459 [0,1,0,0,0,0|1,0,1]=3 313 B7R0.6 N=C(N)NCC(=O)O HR123411 [0,1,0,0,0,0|2,0,1]=4 314 B7R0.6 N=C(N)SCC(=O)O HR122670 [0,1,0,0,0,0|2,0,1]=4 315 B7R0.6 N=C(N)SCC(=O)O HR134877 [0,1,0,0,0,0|2,0,1]=4 316 B7R0.6 O=C(O)CCC(=O)O HR128111 [0,1,0,0,0,0|1,0,1]=3 317 B7R0.6 O=C(O)CCC(=O)O HR135208 [0,1,0,0,0,0|1,0,1]=3 318 B7R0.6 O=C(O)CC[N+](=O)[O-] HR32205 [0,1,0,0,0,0|2,0,0]=3 319 B7R0.6 O=C([O-])CCC(=O)[O-] HR137845 [0,1,0,0,0,0|1,0,2]=4 320 B7R0.6 O=C([O-])CCC(=O)[O-] HR138100 [0,1,0,0,0,0|1,0,2]=4 321 B7R0.6 O=C([O-])CCC(=O)[O-] HR138359 [0,1,0,0,0,0|1,0,2]=4 322 B7R0.6 O=C([O-])CSC(F)F HR116710 [0,1,0,0,0,0|2,0,1]=4 323 B7R0.8 CCCCS(=O)(=O)Cl HR127615 [0,1,0,0,0,0|1,0,1]=3 324 B7R0.8 CCCCS(=O)(=O)[O-] HR117571 [0,1,0,0,0,0|1,0,1]=3 325 B7R0.8 CCCC[Si](C)(C)Cl HR110960 [0,1,0,0,0,0|2,1,0]=4 326 B7R0.8 CCCC[Sn](Cl)(Cl)Cl HR136157 [0,1,0,0,0,0|3,0,0]=4 327 B7R0.8 CCCC[Sn](O)(O)Cl HR130661 [0,1,0,0,0,0|1,0,1]=3 328 B7R0.8 CCCNS(N)(=O)=O HR112584 [0,1,0,0,0,0|2,0,1]=4 329 B7R0.8 CNCCS(=O)(=O)O HR134537 [0,1,0,0,0,0|2,0,0]=3 330 B7R0.8 CNCCS(=O)(=O)[O-] HR134796 [0,1,0,0,0,0|2,0,1]=4 331 B7R0.8 NCCCP(=O)(O)O HR10325 [0,1,0,0,0,0|2,0,0]=3 332 B7R0.8 NCCCS(=O)(=O)O HR126402 [0,1,0,0,0,0|2,0,0]=3 333 B7R0.8 NCCCS(=O)(=O)[O-] HR106222 [0,1,0,0,0,0|2,0,1]=4 334 B7R0.8 NCCC[Si](O)(O)O HR111308 [0,1,0,0,0,0|1,1,1]=4 335 B7R0.8 NCCOP(=O)(O)O HR101683 [0,1,0,0,0,0|3,0,0]=4 336 B7R0.8 NCCOS(=O)(=O)O HR130159 [0,1,0,0,0,0|3,0,0]=4 337 B7R0.8 O=P(O)(O)CCCBr HR129695 [0,1,0,0,0,0|2,0,0]=3 338 B7R0.8 O=S(=O)(Cl)CCCCl HR124188 [0,1,0,0,0,0|2,0,1]=4 339 B7R0.8 O=S(=O)(O)CCCO HR123153 [0,1,0,0,0,0|2,0,0]=3 340 B7R0.8 O=S(=O)([O-])CCCBr HR131954 [0,1,0,0,0,0|2,0,1]=4 341 B7R0.8 O=S(=O)([O-])CCCS HR122116 [0,1,0,0,0,0|2,0,1]=4 342 B7R1.2 CC1=CC(=O)CC1 HR137516 [0,0,0,1,0,0|1,0,1]=3 343 B7R1.2 CC1=CC(=O)CO1 HR119186 [0,0,0,1,0,0|2,0,1]=4 344 B7R1.2 CC1=CC(=O)OC1 HR118210 [0,0,0,1,0,0|2,0,1]=4 345 B7R1.2 CC1=CCC(=O)O1 HR136942 [0,0,0,1,0,0|0,0,2]=3 346 B7R1.2 CC1=NNC(=O)O1 HR134101 [0,0,0,1,0,0|2,0,1]=4 347 B7R1.2 CC1CCC(=O)O1 HR126256 [0,0,0,1,0,0|0,0,0]=1 348 B7R1.2 CC1CCC(N)C1 HR109161 [0,0,0,1,0,0|2,0,1]=4 349 B7R1.2 CC1CNC(=O)C1 HR146359 [0,0,0,1,0,0|2,0,0]=3 350 B7R1.2 CC1CNC(=O)C1 HR146360 [0,0,0,1,0,0|2,0,0]=3 351 B7R1.2 CC1CNC(=O)C1 HR146369 [0,0,0,1,0,0|2,0,0]=3 352 B7R1.2 CC1COC(=O)O1 HR125363 [0,0,0,1,0,0|1,0,0]=2 353 B7R1.2 CC1COC(=O)O1 HR128407 [0,0,0,1,0,0|1,0,0]=2 354 B7R1.2 CC1COC(=O)O1 HR129273 [0,0,0,1,0,0|1,0,0]=2 355 B7R1.2 CC1COC(C)O1 HR111400 [0,0,0,1,0,0|2,0,1]=4 356 B7R1.2 CN1CCC(=O)C1 HR102484 [0,0,0,1,0,0|2,0,0]=3 357 B7R1.2 CN1CCC(O)C1 HR127095 [0,0,0,1,0,0|2,0,1]=4 358 B7R1.2 CN1CCC(O)C1 HR138502 [0,0,0,1,0,0|2,0,1]=4 359 B7R1.2 CN1CCC(O)C1 HR138762 [0,0,0,1,0,0|2,0,1]=4 360 B7R1.2 NC1CCC(=O)C1 HR145995 [0,0,0,1,0,0|2,0,0]=3 361 B7R1.2 NC1CCC(O)C1 HR146093 [0,0,0,1,0,0|2,0,1]=4 362 B7R1.2 NC1CCC(O)C1 HR146099 [0,0,0,1,0,0|2,0,1]=4 363 B7R1.2 NC1CCC(O)C1 HR146100 [0,0,0,1,0,0|2,0,1]=4 364 B7R1.2 NC1CCC(O)C1 HR146101 [0,0,0,1,0,0|2,0,1]=4 365 B7R1.2 NC1CCC(O)C1 HR146102 [0,0,0,1,0,0|2,0,1]=4 366 B7R1.2 NC1CCC(O)C1 HR146103 [0,0,0,1,0,0|2,0,1]=4 367 B7R1.2 NC1CCC(O)C1 HR146104 [0,0,0,1,0,0|2,0,1]=4 368 B7R1.2 NC1CCC(O)C1 HR146105 [0,0,0,1,0,0|2,0,1]=4 369 B7R1.2 NC1CCC(O)C1 HR148648 [0,0,0,1,0,0|2,0,1]=4 370 B7R1.2 NC1CCC(O)C1 HR30204 [0,0,0,1,0,0|2,0,1]=4 371 B7R1.2 NC1COC(=O)C1 HR14757 [0,0,0,1,0,0|3,0,0]=4 372 B7R1.2 NC1COC(=O)C1 HR14758 [0,0,0,1,0,0|3,0,0]=4 373 B7R1.2 O=C1CC(O)CN1 HR138458 [0,0,0,1,0,0|3,0,0]=4 374 B7R1.2 O=C1CC(O)CN1 HR138722 [0,0,0,1,0,0|3,0,0]=4 375 B7R1.2 O=C1CC(O)CN1 HR145864 [0,0,0,1,0,0|3,0,0]=4 376 B7R1.2 O=C1CC(O)CO1 HR126625 [0,0,0,1,0,0|3,0,0]=4 377 B7R1.2 O=C1CC(O)CO1 HR127054 [0,0,0,1,0,0|3,0,0]=4 378 B7R1.2 O=C1CC(S)CN1 HR112550 [0,0,0,1,0,0|3,0,0]=4 379 B7R1.2 O=C1CCC(=O)C1 HR130125 [0,0,0,1,0,0|2,0,1]=4 380 B7R1.2 O=C1CCC(=O)N1 HR135734 [0,0,0,1,0,0|2,0,1]=4 381 B7R1.2 O=C1CCC(=O)O1 HR135468 [0,0,0,1,0,0|1,0,1]=3 382 B7R1.2 O=C1OCC(Cl)O1 HR123970 [0,0,0,1,0,0|2,0,0]=3 383 B7R1.2 O=C1OCC(F)O1 HR135652 [0,0,0,1,0,0|2,0,0]=3 384 B7R1.3 BrC1=CCCCC1 HR156605 [0,0,0,1,0,0|2,0,0]=3 385 B7R1.3 BrC1CCCCC1 HR130726 [0,0,0,1,0,0|2,0,1]=4 386 B7R1.3 C=C1CCNCC1 HR142260 [0,0,0,1,0,0|3,0,0]=4 387 B7R1.3 CC1=CCCCC1 HR143913 [0,0,0,1,0,0|2,0,0]=3 388 B7R1.3 CC1CCCCN1 HR103733 [0,0,0,1,0,0|2,0,1]=4 389 B7R1.3 CC1CCCCN1 HR128173 [0,0,0,1,0,0|2,0,1]=4 390 B7R1.3 CC1CCCCN1 HR149767 [0,0,0,1,0,0|2,0,1]=4 391 B7R1.3 CC1CCCCN1 ROXF00402 [0,0,0,1,0,0|2,0,1]=4 392 B7R1.3 CC1CNCCO1 HR108818 [0,0,0,1,0,0|2,0,1]=4 393 B7R1.3 CC1CNCCO1 HR116772 [0,0,0,1,0,0|2,0,1]=4 394 B7R1.3 CC1CNCCO1 HR145331 [0,0,0,1,0,0|2,0,1]=4 395 B7R1.3 CC1CNCCO1 HR17028 [0,0,0,1,0,0|2,0,1]=4 396 B7R1.3 CC1CNCCO1 HR17029 [0,0,0,1,0,0|2,0,1]=4 397 B7R1.3 CC1OCCCO1 HR144647 [0,0,0,1,0,0|2,0,1]=4 398 B7R1.3 ClC1=CCCCC1 HR129641 [0,0,0,1,0,0|2,0,0]=3 399 B7R1.3 ClC1CCCCC1 HR135558 [0,0,0,1,0,0|2,0,1]=4 400 B7R1.3 NC1=NCCCN1 HR113903 [0,0,0,1,0,0|3,0,0]=4 401 B7R1.3 NC1CCCCC1 HR124720 [0,0,0,1,0,0|2,0,1]=4 402 B7R1.3 NC1CCCCC1 HR128823 [0,0,0,1,0,0|2,0,1]=4 403 B7R1.3 NC1CCCCC1 HR144083 [0,0,0,1,0,0|2,0,1]=4 404 B7R1.3 NC1CCCCC1 HR145293 [0,0,0,1,0,0|2,0,1]=4 405 B7R1.3 NC1CCCCN1 HR113207 [0,0,0,1,0,0|2,0,1]=4 406 B7R1.3 NN1CCCCC1 HR126890 [0,0,0,1,0,0|3,0,0]=4 407 B7R1.3 NN1CCCCC1 HR127151 [0,0,0,1,0,0|3,0,0]=4 408 B7R1.3 O=C1C=CCCC1 HR146309 [0,0,0,1,0,0|1,0,1]=3 409 B7R1.3 O=C1CCCCC1 SIJL01002 [0,0,0,1,0,0|1,0,0]=2 410 B7R1.3 O=C1CCCCN1 HR126393 [0,0,0,1,0,0|1,0,0]=2 411 B7R1.3 O=C1CCCCO1 HR128412 [0,0,0,1,0,0|0,0,0]=1 412 B7R1.3 O=C1CCCNC1 HR108093 [0,0,0,1,0,0|2,0,0]=3 413 B7R1.3 O=C1CCCNC1 HR116769 [0,0,0,1,0,0|2,0,0]=3 414 B7R1.3 O=C1CCCOC1 HR104744 [0,0,0,1,0,0|2,0,0]=3 415 B7R1.3 O=C1CCNCC1 CESA03001 [0,0,0,1,0,0|2,0,0]=3 416 B7R1.3 O=C1CCNCC1 HR105315 [0,0,0,1,0,0|2,0,0]=3 417 B7R1.3 O=C1CCNCC1 HR7756 [0,0,0,1,0,0|2,0,0]=3 418 B7R1.3 O=C1CCOCC1 HR9557 [0,0,0,1,0,0|2,0,0]=3 419 B7R1.3 O=C1CCSCC1 HR123861 [0,0,0,1,0,0|2,0,0]=3 420 B7R1.3 O=C1CC[NH2+]CC1 HR127185 [0,0,0,1,0,0|2,0,0]=3 421 B7R1.3 O=C1CNCCN1 HR132423 [0,0,0,1,0,0|2,0,0]=3 422 B7R1.3 O=C1CNCCO1 HR30209 [0,0,0,1,0,0|1,0,0]=2 423 B7R1.3 O=C1COCCN1 HR115059 [0,0,0,1,0,0|2,0,0]=3 424 B7R1.3 O=C1COCCO1 HR127683 [0,0,0,1,0,0|1,0,0]=2 425 B7R1.3 O=C1CSCCN1 HR147732 [0,0,0,1,0,0|2,0,0]=3 426 B7R1.3 O=C1NCCCN1 HR123216 [0,0,0,1,0,0|2,0,0]=3 427 B7R1.3 O=S1OCCCO1 HR134327 [0,0,0,1,0,0|2,0,0]=3 428 B7R1.3 OC1C=CCCC1 HR108292 [0,0,0,1,0,0|1,0,2]=4 429 B7R1.3 OC1CCCCC1 HR122340 [0,0,0,1,0,0|1,0,1]=3 430 B7R1.3 OC1CCCNC1 HR11310 [0,0,0,1,0,0|2,0,1]=4 431 B7R1.3 OC1CCCNC1 HR122384 [0,0,0,1,0,0|2,0,1]=4 432 B7R1.3 OC1CCCNC1 HR128253 [0,0,0,1,0,0|2,0,1]=4 433 B7R1.3 OC1CCCNC1 HR138469 [0,0,0,1,0,0|2,0,1]=4 434 B7R1.3 OC1CCCOC1 HR105061 [0,0,0,1,0,0|2,0,1]=4 435 B7R1.3 OC1CCNCC1 ACSA02513 [0,0,0,1,0,0|2,0,1]=4 436 B7R1.3 OC1CCNCC1 HR132750 [0,0,0,1,0,0|2,0,1]=4 437 B7R1.3 OC1CCOCC1 HR10170 [0,0,0,1,0,0|2,0,1]=4 438 B7R1.3 OC1CCSCC1 HR117672 [0,0,0,1,0,0|2,0,1]=4 439 B7R1.3 ON1CCCCC1 HR106287 [0,0,0,1,0,0|2,0,0]=3 440 B7R1.3 PC1CCCCC1 HR119652 [0,0,0,1,0,0|2,0,1]=4 441 B7R1.3 SC1CCCCC1 HR119141 [0,0,0,1,0,0|1,1,1]=4 442 B7R1.10 COC1CC(=O)C1 HR114228 [0,0,0,1,0,0|2,0,0]=3 443 B7R1.10 N#CC1CC(=O)C1 HR121457 [0,0,0,1,0,0|2,0,1]=4 444 B7R1.10 O=C1CC(CBr)C1 HR119561 [0,0,0,1,0,0|2,0,0]=3 445 B7R1.10 O=C1CC(CCl)C1 HR119882 [0,0,0,1,0,0|2,0,0]=3 446 B7R1.10 O=C1CC(CO)C1 HR103458 [0,0,0,1,0,0|2,0,0]=3 447 B7R1.14 CC1(O)CCCC1 HR125170 [0,0,0,1,0,0|1,0,1]=3 448 B7R1.14 CC1(O)CCNC1 HR149014 [0,0,0,1,0,0|2,0,1]=4 449 B7R1.14 C[Si]1(C)CCCC1 HR102186 [0,0,0,1,0,0|2,1,0]=4 450 B7R1.14 O=S1(=O)CCCC1 HR100013 [0,0,0,1,0,0|1,0,1]=3 451 B7R1.14 O=S1(=O)CCCO1 HR136793 [0,0,0,1,0,0|2,0,1]=4 452 B7R1.18 CC(=O)C1CCC1 HR143826 [0,0,0,1,0,0|1,0,0]=2 453 B7R1.18 CC(O)C1CCC1 HR147156 [0,0,0,1,0,0|1,0,1]=3 454 B7R1.18 NC(=O)C1CCN1 HR115575 [0,0,0,1,0,0|2,0,0]=3 455 B7R1.18 O=C(Cl)C1CCC1 HR129809 [0,0,0,1,0,0|1,0,0]=2 456 B7R1.18 O=C(O)C1CCC1 HR136661 [0,0,0,1,0,0|0,0,0]=1 457 B7R1.18 O=C(O)C1CCN1 HR103406 [0,0,0,1,0,0|1,0,0]=2 458 B7R1.18 O=C(O)C1CCN1 HR106573 [0,0,0,1,0,0|1,0,0]=2 459 B7R1.18 O=C(O)C1CCN1 HR118789 [0,0,0,1,0,0|1,0,0]=2 460 B7R1.18 O=C(O)C1CCN1 HR127792 [0,0,0,1,0,0|1,0,0]=2 461 B7R1.18 O=C(O)C1CCN1 HR132187 [0,0,0,1,0,0|1,0,0]=2 462 B7R1.18 O=C(O)C1CCN1 HR138860 [0,0,0,1,0,0|1,0,0]=2 463 B7R1.18 O=C(O)C1CCO1 HR109624 [0,0,0,1,0,0|1,0,0]=2 464 B7R1.18 O=C(O)C1CNC1 SIJL01006 [0,0,0,1,0,0|1,0,0]=2 465 B7R1.18 O=C(O)C1COC1 HR111082 [0,0,0,1,0,0|1,0,0]=2 466 B7R1.20 O=C(O)CC1CC1 HR136745 [0,0,0,1,0,0|0,0,0]=1 467 B4R0.1 C=CC(=O)O HR147507 [2,0,0,0,0,0|0,0,2]=4 468 B4R0.1 CC(=O)CBr HR147584 [2,0,0,0,0,0|2,0,0]=4 469 B4R0.1 CC(=O)CCl HR146994 [2,0,0,0,0,0|2,0,0]=4 470 B4R0.1 CC(=O)CN HR103911 [2,0,0,0,0,0|2,0,0]=4 471 B4R0.1 CC(=O)CN HR120199 [2,0,0,0,0,0|2,0,0]=4 472 B4R0.1 CC(=O)CO HR130889 [2,0,0,0,0,0|2,0,0]=4 473 B4R0.1 CCB(O)O HR132210 [2,0,0,0,0,0|1,0,1]=4 474 B4R0.1 CCC(=N)N HR124081 [2,0,0,0,0,0|2,0,0]=4 475 B4R0.1 CCC(=O)[O-] HR100550 [2,0,0,0,0,0|0,0,1]=3 476 B4R0.1 CCC(=O)[O-] HR104439 [2,0,0,0,0,0|0,0,1]=3 477 B4R0.1 CCC(=O)[O-] HR133146 [2,0,0,0,0,0|0,0,1]=3 478 B4R0.1 CCC(=O)[O-] HR133686 [2,0,0,0,0,0|0,0,1]=3 479 B4R0.1 CCC(=O)[O-] HR140520 [2,0,0,0,0,0|0,0,1]=3 480 B4R0.1 CCC(=O)[O-] HR145618 [2,0,0,0,0,0|0,0,1]=3 481 B4R0.1 CCC(C)O HR134477 [2,0,0,0,0,0|1,0,1]=4 482 B4R0.1 CCC(C)O HR138640 [2,0,0,0,0,0|1,0,1]=4 483 B4R0.1 CCC(N)=O HR135085 [2,0,0,0,0,0|1,0,0]=3 484 B4R0.1 CCC(N)=S HR103772 [2,0,0,0,0,0|1,1,0]=4 485 B4R0.1 CCS(=O)[O-] HR107475 [2,0,0,0,0,0|1,0,1]=4 486 B4R0.1 CC[N+](=O)[O-] ANSA06411 [2,0,0,0,0,0|1,0,1]=4 487 B4R0.1 CNC(=O)Cl HR124675 [2,0,0,0,0,0|2,0,0]=4 488 B4R0.1 CNC(C)=O HR133410 [2,0,0,0,0,0|2,0,0]=4 489 B4R0.1 CNC(N)=O HR130491 [2,0,0,0,0,0|2,0,0]=4 490 B4R0.1 COC(=O)Cl ANSA06440 [2,0,0,0,0,0|2,0,0]=4 491 B4R0.1 COC(N)=O HR124182 [2,0,0,0,0,0|2,0,0]=4 492 B4R0.1 CSC(C)=O HR129778 [2,0,0,0,0,0|2,0,0]=4 493 B4R0.1 NC(=O)CBr HR101040 [2,0,0,0,0,0|2,0,0]=4 494 B4R0.1 NC(=O)CBr HR132005 [2,0,0,0,0,0|2,0,0]=4 495 B4R0.1 NC(=O)CCl HR138619 [2,0,0,0,0,0|2,0,0]=4 496 B4R0.1 NC(=O)CI HR127038 [2,0,0,0,0,0|2,0,0]=4 497 B4R0.1 NCC(=O)O HR123103 [2,0,0,0,0,0|1,0,0]=3 498 B4R0.1 NCC(=O)O HR134482 [2,0,0,0,0,0|1,0,0]=3 499 B4R0.1 NCC(=O)[O-] HR100672 [2,0,0,0,0,0|1,0,1]=4 500 B4R0.1 NCC(=O)[O-] HR132852 [2,0,0,0,0,0|1,0,1]=4 501 B4R0.1 NCC(=O)[O-] HR132860 [2,0,0,0,0,0|1,0,1]=4 502 B4R0.1 NCC(=O)[O-] HR134278 [2,0,0,0,0,0|1,0,1]=4 503 B4R0.1 NCC(=O)[O-] HR136299 [2,0,0,0,0,0|1,0,1]=4 504 B4R0.1 NCC(=O)[O-] HR9921 [2,0,0,0,0,0|1,0,1]=4 505 B4R0.1 NCC(N)=O HR123368 [2,0,0,0,0,0|2,0,0]=4 506 B4R0.1 NCC(N)=O SESA01801 [2,0,0,0,0,0|2,0,0]=4 507 B4R0.1 O=C(Br)CBr POCQ01902 [2,0,0,0,0,0|2,0,0]=4 508 B4R0.1 O=C(Cl)CBr POCQ01905 [2,0,0,0,0,0|2,0,0]=4 509 B4R0.1 O=C(Cl)CCl SQJB01602 [2,0,0,0,0,0|2,0,0]=4 510 B4R0.1 O=C(Cl)CF HR102086 [2,0,0,0,0,0|2,0,0]=4 511 B4R0.1 O=C(O)CBr HR147062 [2,0,0,0,0,0|1,0,0]=3 512 B4R0.1 O=C(O)CCl HR147508 [2,0,0,0,0,0|1,0,0]=3 513 B4R0.1 O=C(O)CO HR128939 [2,0,0,0,0,0|1,0,0]=3 514 B4R0.1 O=C(O)CS HR128237 [2,0,0,0,0,0|1,0,0]=3 515 B4R0.1 O=C([O-])CBr HR116499 [2,0,0,0,0,0|1,0,1]=4 516 B4R0.1 O=C([O-])CI HR131471 [2,0,0,0,0,0|1,0,1]=4 517 B4R0.1 O=C([O-])CO HR134522 [2,0,0,0,0,0|1,0,1]=4 518 B4R0.1 O=C([O-])CS HR135616 [2,0,0,0,0,0|1,0,1]=4 519 B4R0.1 O=C([O-])CS HR135882 [2,0,0,0,0,0|1,0,1]=4 520 B4R0.1 O=C([O-])CS HR136156 [2,0,0,0,0,0|1,0,1]=4 521 B4R0.1 O=C([O-])CS HR137167 [2,0,0,0,0,0|1,0,1]=4 522 B4R0.1 O=CC(=O)O APSA07202 [2,0,0,0,0,0|1,0,1]=4 523 B4R0.1 O=CC(=O)O HR136448 [2,0,0,0,0,0|1,0,1]=4 524 B4R0.1 O=CC(=O)O HR136846 [2,0,0,0,0,0|1,0,1]=4 525 B4R0.2 BrCCCBr HR137338 [2,0,0,0,0,0|2,0,0]=4 526 B4R0.2 C#CCCO HR126889 [2,0,0,0,0,0|0,0,2]=4 527 B4R0.2 C=CCCBr HR124734 [2,0,0,0,0,0|1,0,1]=4 528 B4R0.2 C=CCCN HR116389 [2,0,0,0,0,0|1,0,1]=4 529 B4R0.2 C=CCCO HR127635 [2,0,0,0,0,0|0,0,2]=4 530 B4R0.2 C=CCOC HR111200 [2,0,0,0,0,0|1,0,1]=4 531 B4R0.2 C=CCSC HR122911 [2,0,0,0,0,0|1,0,1]=4 532 B4R0.2 C=COCC CESA03009 [2,0,0,0,0,0|1,0,1]=4 533 B4R0.2 CC#CCO HR131453 [2,0,0,0,0,0|0,0,2]=4 534 B4R0.2 CCCCN HR105634 [2,0,0,0,0,0|1,0,0]=3 535 B4R0.2 CCCCO HR138784 [2,0,0,0,0,0|0,0,0]=2 536 B4R0.2 CCCC[O-] HR125276 [2,0,0,0,0,0|0,0,1]=3 537 B4R0.2 CCCC[Si] HR100255 [2,0,0,0,0,0|0,1,0]=3 538 B4R0.2 CCCNC HR109098 [2,0,0,0,0,0|1,0,1]=4 539 B4R0.2 CCCSC HR128481 [2,0,0,0,0,0|1,0,1]=4 540 B4R0.2 CCC[Mg]Br HR101998 [2,0,0,0,0,0|2,0,0]=4 541 B4R0.2 CCC[Mg]Cl HR101421 [2,0,0,0,0,0|2,0,0]=4 542 B4R0.2 CCNC=O HR104364 [2,0,0,0,0,0|1,0,0]=3 543 B4R0.2 CCNCC HR101857 [2,0,0,0,0,0|1,0,1]=4 544 B4R0.2 CCNCC HR127000 [2,0,0,0,0,0|1,0,1]=4 545 B4R0.2 CCNCC HR132573 [2,0,0,0,0,0|1,0,1]=4 546 B4R0.2 CCOC=N HR105865 [2,0,0,0,0,0|2,0,0]=4 547 B4R0.2 CCPCC HR117135 [2,0,0,0,0,0|1,0,1]=4 548 B4R0.2 CCSCC HR120777 [2,0,0,0,0,0|1,0,1]=4 549 B4R0.2 CCSCC HR127285 [2,0,0,0,0,0|1,0,1]=4 550 B4R0.2 CC\C=C\Br HR114361 [2,0,0,0,0,0|1,0,1]=4 551 B4R0.2 CNCCO HR131851 [2,0,0,0,0,0|1,0,0]=3 552 B4R0.2 COCCBr HR2138 [2,0,0,0,0,0|2,0,0]=4 553 B4R0.2 COCCCl HR130902 [2,0,0,0,0,0|2,0,0]=4 554 B4R0.2 COCCN HR101134 [2,0,0,0,0,0|2,0,0]=4 555 B4R0.2 CSCC=O HR129243 [2,0,0,0,0,0|1,0,0]=3 556 B4R0.2 CSCCN HR110636 [2,0,0,0,0,0|2,0,0]=4 557 B4R0.2 CSCCO HR125294 [2,0,0,0,0,0|1,0,0]=3 558 B4R0.2 C\C=C\CC HR121335 [2,0,0,0,0,0|1,0,1]=4 559 B4R0.2 C\C=C\CC HR121956 [2,0,0,0,0,0|1,0,1]=4 560 B4R0.2 FCCCBr HR109590 [2,0,0,0,0,0|2,0,0]=4 561 B4R0.2 ICCCI HR100197 [2,0,0,0,0,0|2,0,0]=4 562 B4R0.2 N#CCC=O HR116464 [2,0,0,0,0,0|1,0,1]=4 563 B4R0.2 N#CCCO HR132067 [2,0,0,0,0,0|1,0,1]=4 564 B4R0.2 NCCCBr CEJL02001 [2,0,0,0,0,0|2,0,0]=4 565 B4R0.2 NCCCBr HR133137 [2,0,0,0,0,0|2,0,0]=4 566 B4R0.2 NCCCCl HR125166 [2,0,0,0,0,0|2,0,0]=4 567 B4R0.2 NCCCN HR147138 [2,0,0,0,0,0|2,0,0]=4 568 B4R0.2 NCCCO HR117078 [2,0,0,0,0,0|1,0,0]=3 569 B4R0.2 NNCCO HR125238 [2,0,0,0,0,0|2,0,0]=4 570 B4R0.2 OCCCBr HR133755 [2,0,0,0,0,0|1,0,0]=3 571 B4R0.2 OCCCCl HR147346 [2,0,0,0,0,0|1,0,0]=3 572 B4R0.2 OCCCF HR128996 [2,0,0,0,0,0|1,0,0]=3 573 B4R0.2 OCCCI HR117054 [2,0,0,0,0,0|1,0,0]=3 574 B4R0.2 OCCCO HR129726 [2,0,0,0,0,0|1,0,0]=3 575 B4R0.2 OCCCS HR131625 [2,0,0,0,0,0|1,0,0]=3 576 B4R0.2 SCCCBr HR118175 [2,0,0,0,0,0|1,1,0]=4 577 B4R0.2 SCCCS HR124438 [2,0,0,0,0,0|1,1,0]=4 578 B4R0.2 [Li]CCCC HR138942 [2,0,0,0,0,0|1,0,0]=3 579 B6R0.1 C#CC(=O)NCC HR116239 [1,1,0,0,0,0|2,0,0]=4 580 B6R0.1 C#CC(=O)OCC HR132600 [1,1,0,0,0,0|2,0,0]=4 581 B6R0.1 C=CC(=O)CCC HR100488 [1,1,0,0,0,0|1,0,0]=3 582 B6R0.1 C=CC(O)CCC HR128085 [1,1,0,0,0,0|1,0,1]=4 583 B6R0.1 CC#CC(=O)OC HR141249 [1,1,0,0,0,0|0,0,2]=4 584 B6R0.1 CCC(=O)CSC HR123442 [1,1,0,0,0,0|2,0,0]=4 585 B6R0.1 CCCC(=O)NN HR113429 [1,1,0,0,0,0|1,0,0]=3 586 B6R0.1 CCCC(=O)SC HR136352 [1,1,0,0,0,0|0,1,0]=3 587 B6R0.1 CCCC(=S)OC HR122832 [1,1,0,0,0,0|0,1,0]=3 588 B6R0.1 CCCC(N)CO HR112281 [1,1,0,0,0,0|1,0,1]=4 589 B6R0.1 CCCC(O)CO HR126914 [1,1,0,0,0,0|0,0,2]=4 590 B6R0.1 CCOC(=O)C=O HR130872 [1,1,0,0,0,0|1,0,1]=4 591 B6R0.1 CCOC(=O)CBr AMJB00601 [1,1,0,0,0,0|2,0,0]=4 592 B6R0.1 CCOC(=O)CCl HR147617 [1,1,0,0,0,0|2,0,0]=4 593 B6R0.1 CCOC(=O)CN HR134743 [1,1,0,0,0,0|2,0,0]=4 594 B6R0.1 CCOC(=O)CO HR127384 [1,1,0,0,0,0|1,0,0]=3 595 B6R0.1 CCOC(=O)CS HR136673 [1,1,0,0,0,0|1,1,0]=4 596 B6R0.1 CCOC(=O)NN HR102667 [1,1,0,0,0,0|2,0,0]=4 597 B6R0.1 CCOC(=O)NN HR138962 [1,1,0,0,0,0|2,0,0]=4 598 B6R0.1 CCOC(=O)OC HR138173 [1,1,0,0,0,0|1,0,0]=3 599 B6R0.1 CCO\C(C)=N/O SIJL01004 [1,1,0,0,0,0|2,0,0]=4 600 B6R0.1 CCSC(=O)CC HR138214 [1,1,0,0,0,0|2,0,0]=4 601 B6R0.1 CNCC(=O)OC HR130436 [1,1,0,0,0,0|1,0,0]=3 602 B6R0.1 COC(=O)CC#N OLSA05202 [1,1,0,0,0,0|1,0,1]=4 603 B6R0.1 COC(=O)CCBr HR133552 [1,1,0,0,0,0|1,0,0]=3 604 B6R0.1 COC(=O)CCN HR135038 [1,1,0,0,0,0|1,0,0]=3 605 B6R0.1 COC(=O)CCS HR133169 [1,1,0,0,0,0|1,0,0]=3 606 B6R0.1 COCC(=O)OC HR147666 [1,1,0,0,0,0|1,0,0]=3 607 B6R0.1 [C-]#[N+]CC(=O)OC HR110956 [1,1,0,0,0,0|1,0,1]=4 608 B6R0.2 CC(=O)CC(=O)[O-] HR126081 [1,1,0,0,0,0|0,0,2]=4 609 B6R0.2 CC(=O)CC(C)=O AVJB01201 [1,1,0,0,0,0|1,0,1]=4 610 B6R0.2 CC(=O)CC(C)=O CUSA07105 [1,1,0,0,0,0|1,0,1]=4 611 B6R0.2 CC(=O)CC(C)=O HR108604 [1,1,0,0,0,0|1,0,1]=4 612 B6R0.2 CC(=O)CC(N)=O HR125580 [1,1,0,0,0,0|1,0,1]=4 613 B6R0.2 CC(=O)NC(C)C ABSA04901 [1,1,0,0,0,0|2,0,0]=4 614 B6R0.2 CC(=O)OC(C)Br HR115050 [1,1,0,0,0,0|2,0,0]=4 615 B6R0.2 CC(C)=CC(=O)O HR21295 [1,1,0,0,0,0|0,0,2]=4 616 B6R0.2 CC(C)CB(O)O HR137992 [1,1,0,0,0,0|1,0,1]=4 617 B6R0.2 CC(C)CC(=O)O HR123359 [1,1,0,0,0,0|0,0,0]=2 618 B6R0.2 CC(C)CC(N)=O HR109732 [1,1,0,0,0,0|1,0,0]=3 619 B6R0.2 CC(N)CC(=O)O HR103780 [1,1,0,0,0,0|0,0,0]=2 620 B6R0.2 CC(N)CC(=O)O HR116211 [1,1,0,0,0,0|0,0,0]=2 621 B6R0.2 CC(N)CC(=O)O HR120488 [1,1,0,0,0,0|0,0,0]=2 622 B6R0.2 CC(N)CC(=O)O HR124863 [1,1,0,0,0,0|0,0,0]=2 623 B6R0.2 CC(O)CC(=O)[O-] HR147106 [1,1,0,0,0,0|0,0,1]=3 624 B6R0.2 CN(C)CC(=O)O HR127289 [1,1,0,0,0,0|1,0,0]=3 625 B6R0.2 CN(C)CC(=O)[O-] HR134057 [1,1,0,0,0,0|1,0,1]=4 626 B6R0.2 C[S+](C)CC(=O)[O-] HR107996 [1,1,0,0,0,0|1,0,1]=4 627 B6R0.2 O=C(O)CC(=O)O DACQ01002 [1,1,0,0,0,0|1,0,1]=4 628 B6R0.2 O=C(O)CC(=O)O HR144418 [1,1,0,0,0,0|1,0,1]=4 629 B6R0.2 OC(=S)CC(F)F HR125326 [1,1,0,0,0,0|1,1,0]=4 630 B6R0.3 C=C(CC)C(=O)O HR118672 [1,1,0,0,0,0|0,0,1]=3 631 B6R0.3 C=CC(N)C(=O)O HR139947 [1,1,0,0,0,0|0,0,2]=4 632 B6R0.3 C=CC(N)C(=O)O HR146204 [1,1,0,0,0,0|0,0,2]=4 633 B6R0.3 CC(CN)C(=O)O HR133030 [1,1,0,0,0,0|1,0,0]=3 634 B6R0.3 CCC(=O)C(=O)O HR128819 [1,1,0,0,0,0|0,0,1]=3 635 B6R0.3 CCC(=O)C(C)=O HR131826 [1,1,0,0,0,0|1,0,1]=4 636 B6R0.3 CCC(Br)C(=O)Cl HR115509 [1,1,0,0,0,0|1,0,0]=3 637 B6R0.3 CCC(Br)C(=O)O HR123595 [1,1,0,0,0,0|0,0,0]=2 638 B6R0.3 CCC(C)C(=O)Cl HR144038 [1,1,0,0,0,0|1,0,0]=3 639 B6R0.3 CCC(C)C(=O)O HR124401 [1,1,0,0,0,0|0,0,0]=2 640 B6R0.3 CCC(C)C(=O)O HR124666 [1,1,0,0,0,0|0,0,0]=2 641 B6R0.3 CCC(C)C(N)=O HR115534 [1,1,0,0,0,0|1,0,0]=3 642 B6R0.3 CCC(Cl)C(=O)O HR104193 [1,1,0,0,0,0|0,0,0]=2 643 B6R0.3 CCC(Cl)C(=O)O HR104505 [1,1,0,0,0,0|0,0,0]=2 644 B6R0.3 CCC(N)B(O)O HR32532 [1,1,0,0,0,0|1,0,1]=4 645 B6R0.3 CCC(N)B(O)O HR32533 [1,1,0,0,0,0|1,0,1]=4 646 B6R0.3 CCC(N)C(=O)O HR100731 [1,1,0,0,0,0|0,0,0]=2 647 B6R0.3 CCC(N)C(=O)O HR128531 [1,1,0,0,0,0|0,0,0]=2 648 B6R0.3 CCC(N)C(=O)O HR128797 [1,1,0,0,0,0|0,0,0]=2 649 B6R0.3 CCC(N)C(=O)O HR130831 [1,1,0,0,0,0|0,0,0]=2 650 B6R0.3 CCC(N)C(=O)O VOJL00901 [1,1,0,0,0,0|0,0,0]=2 651 B6R0.3 CCC(N)C(N)=O HR113889 [1,1,0,0,0,0|1,0,0]=3 652 B6R0.3 CCC(N)C(N)=O HR133280 [1,1,0,0,0,0|1,0,0]=3 653 B6R0.3 CCC(O)C(=O)O HR145745 [1,1,0,0,0,0|0,0,0]=2 654 B6R0.3 CCC(O)C(=O)O HR8265 [1,1,0,0,0,0|0,0,0]=2 655 B6R0.3 CCC(S)C(C)=O HR124234 [1,1,0,0,0,0|1,0,0]=3 656 B6R0.3 CCN(C)C(=O)Cl HR16066 [1,1,0,0,0,0|2,0,0]=4 657 B6R0.3 CNC(C)C(=O)O HR126490 [1,1,0,0,0,0|1,0,0]=3 658 B6R0.3 CNC(C)C(=O)O HR131233 [1,1,0,0,0,0|1,0,0]=3 659 B6R0.3 CNC(C)C(=O)O HR138734 [1,1,0,0,0,0|1,0,0]=3 660 B6R0.3 CNC(C)C(=O)[O-] HR145674 [1,1,0,0,0,0|1,0,1]=4 661 B6R0.3 CSC(C)C(C)=O HR133684 [1,1,0,0,0,0|2,0,0]=4 662 B6R0.3 C\C=C(/C)C(=O)O HR127692 [1,1,0,0,0,0|0,0,2]=4 663 B6R0.3 C\C=C(/C)C(=O)O HR140908 [1,1,0,0,0,0|0,0,2]=4 664 B6R0.3 NC(=O)C(Br)CBr HR125555 [1,1,0,0,0,0|2,0,0]=4 665 B6R0.3 NC(=O)C(N)CO HR115072 [1,1,0,0,0,0|2,0,0]=4 666 B6R0.3 NC(CO)C(=O)O HR10704 [1,1,0,0,0,0|1,0,0]=3 667 B6R0.3 NC(CO)C(=O)O HR11003 [1,1,0,0,0,0|1,0,0]=3 668 B6R0.3 NC(CO)C(=O)O HR136009 [1,1,0,0,0,0|1,0,0]=3 669 B6R0.3 NC(CS)C(=O)O HR125082 [1,1,0,0,0,0|1,0,0]=3 670 B6R0.3 NC(CS)C(=O)O HR125295 [1,1,0,0,0,0|1,0,0]=3 671 B6R0.3 NC(CS)C(=O)O HR125344 [1,1,0,0,0,0|1,0,0]=3 672 B6R0.3 NC(CS)C(=O)O HR129167 [1,1,0,0,0,0|1,0,0]=3 673 B6R0.3 NC(CS)C(=O)O HR129315 [1,1,0,0,0,0|1,0,0]=3 674 B6R0.3 NC(CS)C(=O)O HR129684 [1,1,0,0,0,0|1,0,0]=3 675 B6R0.3 NC(CS)C(=O)O HR135781 [1,1,0,0,0,0|1,0,0]=3 676 B6R0.3 NC(CS)C(=O)O HR136316 [1,1,0,0,0,0|1,0,0]=3 677 B6R0.3 NC(C[SeH])C(=O)O HR101211 [1,1,0,0,0,0|1,0,0]=3 678 B6R0.3 NCC(N)C(=O)O HR101827 [1,1,0,0,0,0|1,0,0]=3 679 B6R0.3 NCC(N)C(=O)O HR120379 [1,1,0,0,0,0|1,0,0]=3 680 B6R0.3 NCC(N)C(=O)O HR130162 [1,1,0,0,0,0|1,0,0]=3 681 B6R0.3 NCC(N)C(=O)O HR137268 [1,1,0,0,0,0|1,0,0]=3 682 B6R0.3 NCC(O)C(=O)O HR126827 [1,1,0,0,0,0|1,0,0]=3 683 B6R0.3 NCC(O)C(=O)O HR145757 [1,1,0,0,0,0|1,0,0]=3 684 B6R0.3 NCC(O)C(=O)O HR145758 [1,1,0,0,0,0|1,0,0]=3 685 B6R0.3 O=C(Cl)C(Br)CBr HR128333 [1,1,0,0,0,0|2,0,0]=4 686 B6R0.3 O=C(O)C(=O)CBr HR129820 [1,1,0,0,0,0|1,0,1]=4 687 B6R0.3 O=C(O)C(Br)CBr HR128067 [1,1,0,0,0,0|1,0,0]=3 688 B6R0.3 O=C(O)C(Br)CO HR121810 [1,1,0,0,0,0|1,0,0]=3 689 B6R0.3 O=C(O)C(Cl)CCl HR102337 [1,1,0,0,0,0|1,0,0]=3 690 B6R0.5 CCCS(=O)(=O)Cl HR129518 [1,1,0,0,0,0|1,0,1]=4 691 B6R0.5 CCCS(=O)(=O)O HR120663 [1,1,0,0,0,0|1,0,0]=3 692 B6R0.5 CCCS(N)(=O)=O HR138225 [1,1,0,0,0,0|1,0,1]=4 693 B6R0.5 NCCS(=O)(=O)O HR103110 [1,1,0,0,0,0|2,0,0]=4 694 B6R0.5 NCCS(=O)(=O)O HR135062 [1,1,0,0,0,0|2,0,0]=4 695 B6R0.5 O=P(O)(O)CCCl HR126263 [1,1,0,0,0,0|2,0,0]=4 696 B6R0.5 O=S(=O)(O)CCBr HR131005 [1,1,0,0,0,0|2,0,0]=4 697 B6R0.5 O=S(=O)(O)CCO HR135585 [1,1,0,0,0,0|2,0,0]=4 698 B6R0.6 BrCCCCCBr BEJL02301 [1,1,0,0,0,0|1,0,1]=4 699 B6R0.6 C#CCCCC=O VIJL03309 [1,1,0,0,0,0|0,0,1]=3 700 B6R0.6 C#CCCCCO HR141440 [1,1,0,0,0,0|0,0,2]=4 701 B6R0.6 C=CCCCC#N HR140662 [1,1,0,0,0,0|1,0,1]=4 702 B6R0.6 C=CCCCCBr HR137464 [1,1,0,0,0,0|1,0,0]=3 703 B6R0.6 C=CCCCCCl HR113553 [1,1,0,0,0,0|1,0,0]=3 704 B6R0.6 C=CCCCCN HR143196 [1,1,0,0,0,0|1,0,0]=3 705 B6R0.6 C=CCCCCO HR120838 [1,1,0,0,0,0|1,0,0]=3 706 B6R0.6 C=CCOCCO HR133981 [1,1,0,0,0,0|2,0,0]=4 707 B6R0.6 C=CCSCCC HR130566 [1,1,0,0,0,0|1,0,0]=3 708 B6R0.6 C=CCSSCC HR131362 [1,1,0,0,0,0|2,0,0]=4 709 B6R0.6 C=COCCCC PAJB01004 [1,1,0,0,0,0|1,0,0]=3 710 B6R0.6 CCCC#CCO HR100925 [1,1,0,0,0,0|0,0,2]=4 711 B6R0.6 CCCCCCI HR101787 [1,1,0,0,0,0|1,0,1]=4 712 B6R0.6 CCCCCCO HR108609 [1,1,0,0,0,0|0,0,1]=3 713 B6R0.6 CCCCCCO HR127298 [1,1,0,0,0,0|0,0,1]=3 714 B6R0.6 CCCCCC[SiH3] HR107072 [1,1,0,0,0,0|1,0,1]=4 715 B6R0.6 CCCCCNC HR128731 [1,1,0,0,0,0|1,0,1]=4 716 B6R0.6 CCCCC[Mg]Br HR116206 [1,1,0,0,0,0|1,0,1]=4 717 B6R0.6 CCCCC[Mg]Cl HR115571 [1,1,0,0,0,0|1,0,1]=4 718 B6R0.6 CCCCN=C=S HR144405 [1,1,0,0,0,0|0,1,1]=4 719 B6R0.6 CCCCNCC HR125662 [1,1,0,0,0,0|1,0,1]=4 720 B6R0.6 CCCCOCCl HR132357 [1,1,0,0,0,0|1,0,1]=4 721 B6R0.6 CCCCSC#N HR137924 [1,1,0,0,0,0|1,0,1]=4 722 B6R0.6 CCCCS[SnH]=O HR100704 [1,1,0,0,0,0|1,0,0]=3 723 B6R0.6 CCCC[Mg]CC HR115887 [1,1,0,0,0,0|1,0,1]=4 724 B6R0.6 CCCOCCCl HR126380 [1,1,0,0,0,0|1,0,1]=4 725 B6R0.6 CCCOCCO HR123698 [1,1,0,0,0,0|0,0,1]=3 726 B6R0.6 CCC\C=C\C=O HR127670 [1,1,0,0,0,0|0,0,1]=3 727 B6R0.6 CCC\C=C\CO HR127397 [1,1,0,0,0,0|0,0,1]=3 728 B6R0.6 CCNCCCN HR100502 [1,1,0,0,0,0|1,0,1]=4 729 B6R0.6 CCOCCC#N HR132950 [1,1,0,0,0,0|1,0,1]=4 730 B6R0.6 CCOCCCCl HR124824 [1,1,0,0,0,0|1,0,1]=4 731 B6R0.6 CCOCCCN HR100101 [1,1,0,0,0,0|1,0,1]=4 732 B6R0.6 CCOCCCO HR128209 [1,1,0,0,0,0|0,0,1]=3 733 B6R0.6 CC\C=C\CCO HR100849 [1,1,0,0,0,0|0,0,2]=4 734 B6R0.6 CC\C=C\CCO HR130305 [1,1,0,0,0,0|0,0,2]=4 735 B6R0.6 CNCCCNC HR133916 [1,1,0,0,0,0|2,0,0]=4 736 B6R0.6 COCCCCBr HR131929 [1,1,0,0,0,0|1,0,1]=4 737 B6R0.6 COCCCCCl HR130420 [1,1,0,0,0,0|1,0,1]=4 738 B6R0.6 COCCCCN HR141637 [1,1,0,0,0,0|1,0,1]=4 739 B6R0.6 COCCCCO HR129257 [1,1,0,0,0,0|0,0,1]=3 740 B6R0.6 COCCCOC HR127938 [1,1,0,0,0,0|1,0,1]=4 741 B6R0.6 C\C=C\CCCC HR145495 [1,1,0,0,0,0|1,0,0]=3 742 B6R0.6 C\C=C\CCCO HR110400 [1,1,0,0,0,0|0,0,2]=4 743 B6R0.6 C\C=C\CCCO HR111291 [1,1,0,0,0,0|0,0,2]=4 744 B6R0.6 ClCCCCCBr HR125269 [1,1,0,0,0,0|1,0,1]=4 745 B6R0.6 FCCCCCBr HR120213 [1,1,0,0,0,0|1,0,1]=4 746 B6R0.6 N#CCCCCBr HR114079 [1,1,0,0,0,0|1,0,1]=4 747 B6R0.6 N#CCCCCCl HR122521 [1,1,0,0,0,0|1,0,1]=4 748 B6R0.6 NCCCCCN HR146969 [1,1,0,0,0,0|1,0,1]=4 749 B6R0.6 NCCCCCO HR139094 [1,1,0,0,0,0|0,0,1]=3 750 B6R0.6 NCCNCCO HR129715 [1,1,0,0,0,0|1,0,1]=4 751 B6R0.6 NCCSCCO HR131001 [1,1,0,0,0,0|1,0,1]=4 752 B6R0.6 O=C=NCCCCl HR108117 [1,1,0,0,0,0|1,0,1]=4 753 B6R0.6 O=CCCCC=O HR141217 [1,1,0,0,0,0|0,0,1]=3 754 B6R0.6 O=CCCCCCl HR119509 [1,1,0,0,0,0|0,0,0]=2 755 B6R0.6 O=CCCCCO HR116282 [1,1,0,0,0,0|0,0,0]=2 756 B6R0.6 O=CCOCCO HR117228 [1,1,0,0,0,0|1,0,0]=3 757 B6R0.6 OCCCCCBr HR102868 [1,1,0,0,0,0|0,0,1]=3 758 B6R0.6 OCCCCCCl HR134047 [1,1,0,0,0,0|0,0,1]=3 759 B6R0.6 OCCCCCO HR136505 [1,1,0,0,0,0|0,0,1]=3 760 B6R0.6 OCCOCCCl HR126550 [1,1,0,0,0,0|1,0,1]=4 761 B6R0.6 OCCOCCO HR128647 [1,1,0,0,0,0|1,0,1]=4 762 B6R0.6 OCCSCCO HR124597 [1,1,0,0,0,0|1,0,1]=4 763 B6R0.6 SCCCCCS HR128025 [1,1,0,0,0,0|0,1,1]=4 764 B6R0.6 [Li]CCCCCC HR142102 [1,1,0,0,0,0|1,0,1]=4 765 B8R0.2 CCC(C)C(=O)C(=O)O HR136223 [0,2,0,0,0,0|0,0,1]=3 766 B8R0.2 CCC(C)C(=O)C(=O)[O-] HR105983 [0,2,0,0,0,0|0,0,2]=4 767 B8R0.2 CCC(C)C(Cl)C(=O)O HR103573 [0,2,0,0,0,0|0,0,0]=2 768 B8R0.2 CCC(C)C(N)C(=O)O HR122107 [0,2,0,0,0,0|0,0,0]=2 769 B8R0.2 CCC(C)C(N)C(=O)O HR126392 [0,2,0,0,0,0|0,0,0]=2 770 B8R0.2 CCC(C)C(N)C(=O)O HR126596 [0,2,0,0,0,0|0,0,0]=2 771 B8R0.2 CCC(C)C(N)C(=O)O HR129264 [0,2,0,0,0,0|0,0,0]=2 772 B8R0.2 CCC(C)C(N)C(=O)O HR134488 [0,2,0,0,0,0|0,0,0]=2 773 B8R0.2 CCC(C)C(N)C(N)=O HR114403 [0,2,0,0,0,0|1,0,0]=3 774 B8R0.2 COC(=O)C(C)C(=O)O HR103977 [0,2,0,0,0,0|1,0,1]=4 775 B8R0.2 COC(C)C(N)C(=O)O HR109877 [0,2,0,0,0,0|1,0,0]=3 776 B8R0.2 COC(C)C(N)C(=O)O HR143103 [0,2,0,0,0,0|1,0,0]=3 777 B8R0.2 O=C(O)C(O)C(O)CO HR18483 [0,2,0,0,0,0|1,0,0]=3 778 B8R0.2 O=C([O-])C(O)C(O)CO HR106059 [0,2,0,0,0,0|1,0,1]=4 779 B8R0.2 O=C([O-])C(O)C(O)CO HR124090 [0,2,0,0,0,0|1,0,1]=4 780 B8R0.5 C#CCC(N)CC(=O)O HR107806 [0,2,0,0,0,0|0,0,1]=3 781 B8R0.5 C#CCC(N)CC(=O)O HR108120 [0,2,0,0,0,0|0,0,1]=3 782 B8R0.5 CCOC(=O)CC(=O)Cl HR105395 [0,2,0,0,0,0|1,0,1]=4 783 B8R0.5 CCOC(=O)CC(=O)O HR125762 [0,2,0,0,0,0|0,0,1]=3 784 B8R0.5 CCOC(=O)CC(C)=O BRSA08315 [0,2,0,0,0,0|1,0,1]=4 785 B8R0.5 CCOC(=O)CC(C)=O HR134952 [0,2,0,0,0,0|1,0,1]=4 786 B8R0.5 CCOC(=O)CC(N)=O HR32504 [0,2,0,0,0,0|1,0,1]=4 787 B8R0.5 CCOC(C)OC(C)=O HR121743 [0,2,0,0,0,0|2,0,0]=4 788 B8R0.5 COCC(=O)CC(C)=O HR134533 [0,2,0,0,0,0|1,0,1]=4 789 B8R0.5 COCC(C)OC(C)=O HR138591 [0,2,0,0,0,0|2,0,0]=4 790 B8R0.16 COC(CC(C)=O)OC HR122907 [0,2,0,0,0,0|2,0,0]=4 791 B8R0.19 CCC(=O)CC(=O)CC HR138277 [0,2,0,0,0,0|1,0,1]=4 792 B8R0.19 CCC(=O)CC(=O)OC HR126248 [0,2,0,0,0,0|0,0,1]=3 793 B8R0.19 CCC(C)CC(O)CC HR124313 [0,2,0,0,0,0|1,0,1]=4 794 B8R0.19 CCC(O)CC(=O)OC HR111480 [0,2,0,0,0,0|0,0,0]=2 795 B8R0.19 COC(=O)CC(=O)CCl HR131628 [0,2,0,0,0,0|1,0,1]=4 796 B8R0.19 COC(=O)CC(=O)OC HR129679 [0,2,0,0,0,0|1,0,1]=4 797 B8R0.19 COC(=O)CC(O)CCl HR103451 [0,2,0,0,0,0|1,0,0]=3 798 B8R0.19 COC(=O)CC(O)CCl HR106667 [0,2,0,0,0,0|1,0,0]=3 799 B8R0.19 COC(=O)CC(O)CCl HR123616 [0,2,0,0,0,0|1,0,0]=3 800 B8R0.19 COC(=O)NC(C)CN ENSA06712 [0,2,0,0,0,0|2,0,0]=4 801 B8R0.23 C=C(CC(C)C)C(C)=O HR119288 [0,2,0,0,0,0|1,0,1]=4 802 B8R0.23 CC(=O)NC(C)C(=O)O HR123754 [0,2,0,0,0,0|1,0,1]=4 803 B8R0.23 CC(=O)NC(C)C(=O)O HR130455 [0,2,0,0,0,0|1,0,1]=4 804 B8R0.23 CC(=O)NC(C)C(=O)O HR139475 [0,2,0,0,0,0|1,0,1]=4 805 B8R0.23 CC(=O)OC(C)C(=O)O HR114068 [0,2,0,0,0,0|1,0,1]=4 806 B8R0.23 CC(=O)OC(C)C(=O)O HR117573 [0,2,0,0,0,0|1,0,1]=4 807 B8R0.23 CC(C)C(N)CC(=O)O HR115576 [0,2,0,0,0,0|0,0,0]=2 808 B8R0.23 CC(C)C(N)CC(=O)O HR119755 [0,2,0,0,0,0|0,0,0]=2 809 B8R0.23 CC(C)CC(=O)C(=O)O HR122104 [0,2,0,0,0,0|0,0,1]=3 810 B8R0.23 CC(C)CC(=O)C(=O)[O-] HR105375 [0,2,0,0,0,0|0,0,2]=4 811 B8R0.23 CC(C)CC(=O)C(=O)[O-] HR138461 [0,2,0,0,0,0|0,0,2]=4 812 B8R0.23 CC(C)CC(=O)C(=O)[O-] HR138724 [0,2,0,0,0,0|0,0,2]=4 813 B8R0.23 CC(C)CC(Br)C(=O)O HR148644 [0,2,0,0,0,0|0,0,0]=2 814 B8R0.23 CC(C)CC(Cl)C(=O)O HR103256 [0,2,0,0,0,0|0,0,0]=2 815 B8R0.23 CC(C)CC(N)B(O)O HR32490 [0,2,0,0,0,0|1,0,1]=4 816 B8R0.23 CC(C)CC(N)B(O)O HR32534 [0,2,0,0,0,0|1,0,1]=4 817 B8R0.23 CC(C)CC(N)B(O)O HR32540 [0,2,0,0,0,0|1,0,1]=4 818 B8R0.23 CC(C)CC(N)B(O)O HR32541 [0,2,0,0,0,0|1,0,1]=4 819 B8R0.23 CC(C)CC(N)C(=O)O HR120455 [0,2,0,0,0,0|0,0,0]=2 820 B8R0.23 CC(C)CC(N)C(=O)O HR133560 [0,2,0,0,0,0|0,0,0]=2 821 B8R0.23 CC(C)CC(N)C(=O)O HR134259 [0,2,0,0,0,0|0,0,0]=2 822 B8R0.23 CC(C)CC(N)C(=O)O TYJB00201 [0,2,0,0,0,0|0,0,0]=2 823 B8R0.23 CC(C)CC(N)C(N)=O HR116634 [0,2,0,0,0,0|1,0,0]=3 824 B8R0.23 CC(C)CC(O)C(=O)O HR104232 [0,2,0,0,0,0|0,0,0]=2 825 B8R0.23 CC(C)CC(O)C(=O)O HR121662 [0,2,0,0,0,0|0,0,0]=2 826 B8R0.23 CC(CC(=O)O)C(=O)O HR106543 [0,2,0,0,0,0|1,0,1]=4 827 B8R0.23 CC(CC(=O)O)C(=O)O HR134361 [0,2,0,0,0,0|1,0,1]=4 828 B8R0.23 CC(O)C(N)CC(=O)O HR146732 [0,2,0,0,0,0|0,0,0]=2 829 B8R0.23 CS(=O)CC(N)C(=O)O HR134447 [0,2,0,0,0,0|1,0,0]=3 830 B8R0.23 NC(=O)C(N)CC(=O)O HR124658 [0,2,0,0,0,0|1,0,1]=4 831 B8R0.23 NC(=O)CC(N)C(=O)O HR128740 [0,2,0,0,0,0|1,0,1]=4 832 B8R0.23 NC(=O)CC(N)C(=O)O HR129004 [0,2,0,0,0,0|1,0,1]=4 833 B8R0.23 NC(=O)CC(N)C(=O)O HR129935 [0,2,0,0,0,0|1,0,1]=4 834 B8R0.23 NC(=O)CC(N)C(=O)O HR133228 [0,2,0,0,0,0|1,0,1]=4 835 B8R0.23 NC(=O)CC(N)C(=O)O HR133501 [0,2,0,0,0,0|1,0,1]=4 836 B8R0.23 NC(CC(=O)O)C(=O)O HR126814 [0,2,0,0,0,0|1,0,1]=4 837 B8R0.23 NC(CC(=O)O)C(=O)O HR135475 [0,2,0,0,0,0|1,0,1]=4 838 B8R0.23 NC(CC(=O)O)C(=O)O TECQ02802 [0,2,0,0,0,0|1,0,1]=4 839 B8R0.23 NC(CC(=O)[O-])C(=O)O HR125029 [0,2,0,0,0,0|1,0,1]=4 840 B8R0.23 O=C(O)CC(Br)C(=O)O HR127726 [0,2,0,0,0,0|1,0,1]=4 841 B8R0.23 O=C(O)CC(Br)C(=O)O HR127823 [0,2,0,0,0,0|1,0,1]=4 842 B8R0.23 O=C(O)CC(Cl)C(=O)O HR109410 [0,2,0,0,0,0|1,0,1]=4 843 B8R0.23 O=C(O)CC(O)C(=O)O HR129431 [0,2,0,0,0,0|1,0,1]=4 844 B8R0.23 O=C(O)CC(O)C(=O)O HR131010 [0,2,0,0,0,0|1,0,1]=4 845 B8R0.23 O=C(O)CC(O)C(=O)O HR135274 [0,2,0,0,0,0|1,0,1]=4 846 B8R0.23 O=C(O)CC(O)C(=O)O HR7917 [0,2,0,0,0,0|1,0,1]=4 847 B8R0.23 O=C(O)CC(S)C(=O)O HR123669 [0,2,0,0,0,0|1,0,1]=4 848 B8R0.24 CCC(C)CS(=O)(=O)[O-] HR116952 [0,2,0,0,0,0|1,0,1]=4 849 B8R0.24 O=S(=O)(O)CC(S)CS HR127839 [0,2,0,0,0,0|2,0,0]=4 850 B8R0.34 CSC(C)(C)CC(C)=O HR124751 [0,2,0,0,0,0|2,0,0]=4 851 B8R0.1 CCCOC(=O)CCS HR117505 [0,2,0,0,0,0|1,1,0]=4 852 B8R0.1 CCOC(=O)CCCBr HR133499 [0,2,0,0,0,0|1,0,0]=3 853 B8R0.1 CCOC(=O)CCCN HR142861 [0,2,0,0,0,0|1,0,0]=3 854 B8R0.1 CCOC(=O)CCC[Zn+] HR140860 [0,2,0,0,0,0|1,0,0]=3 855 B8R0.1 CCOC(=O)NCCCl HR139857 [0,2,0,0,0,0|2,0,0]=4 856 B8R0.1 C\C=C\C(=O)CCCC HR108746 [0,2,0,0,0,0|1,0,0]=3 857 B8R0.1 C\C=C\CC(=O)OCC HR142218 [0,2,0,0,0,0|0,0,2]=4 858 B8R0.3 CCCC(Br)C(=O)OC HR135374 [0,2,0,0,0,0|0,0,0]=2 859 B8R0.3 CCCC(N)C(=O)OC HR141930 [0,2,0,0,0,0|0,0,0]=2 860 B8R0.3 COC(=O)C(Br)CCBr HR133814 [0,2,0,0,0,0|1,0,0]=3 861 B8R0.6 C#CC(O)CCCCC HR131985 [0,2,0,0,0,0|1,0,1]=4 862 B8R0.6 C=CC(=O)CCCCC HR128010 [0,2,0,0,0,0|1,0,0]=3 863 B8R0.6 C=CC(=O)OCCOC HR136408 [0,2,0,0,0,0|2,0,0]=4 864 B8R0.6 C=CC(O)CCCCC HR133074 [0,2,0,0,0,0|1,0,1]=4 865 B8R0.6 CCCCCC(=O)CI HR120235 [0,2,0,0,0,0|1,0,0]=3 866 B8R0.6 CCCCCC(=O)SC HR105293 [0,2,0,0,0,0|0,1,0]=3 867 B8R0.6 CCCCCC(O)CC HR112896 [0,2,0,0,0,0|1,0,1]=4 868 B8R0.6 CCCCCC(O)CC HR113840 [0,2,0,0,0,0|1,0,1]=4 869 B8R0.6 CCCCNC(=O)CCl HR147680 [0,2,0,0,0,0|1,0,0]=3 870 B8R0.6 CCCCOC(=O)CO HR135884 [0,2,0,0,0,0|0,0,0]=2 871 B8R0.6 CCCCOC(=O)CS HR123589 [0,2,0,0,0,0|0,1,0]=3 872 B8R0.6 CCC\C=C\C(=O)OC HR101945 [0,2,0,0,0,0|0,0,1]=3 873 B8R0.6 CCC\C=C\C(=O)OC HR138885 [0,2,0,0,0,0|0,0,1]=3 874 B8R0.6 COC(=O)CCCCBr HR132792 [0,2,0,0,0,0|0,0,0]=2 875 B8R0.6 COC(=O)CCCCCl HR117426 [0,2,0,0,0,0|0,0,0]=2 876 B8R0.6 COC(=O)CCN=C=S HR117775 [0,2,0,0,0,0|1,0,1]=4 877 B8R0.6 COC(=O)COCCCl HR118852 [0,2,0,0,0,0|1,0,0]=3 878 B8R0.6 COCCCC(=O)OC HR115734 [0,2,0,0,0,0|0,0,0]=2 879 B8R0.6 OCCCCC(O)CO HR123795 [0,2,0,0,0,0|0,0,2]=4 880 B8R0.8 C=C(C)C(=O)OCCC HR115069 [0,2,0,0,0,0|2,0,0]=4 881 B8R0.8 CCCCC(=O)C(C)=O HR133012 [0,2,0,0,0,0|0,0,1]=3 882 B8R0.8 CCCCC(Br)C(=O)O HR127260 [0,2,0,0,0,0|0,0,0]=2 883 B8R0.8 CCCCC(C)C(=O)O HR121647 [0,2,0,0,0,0|0,0,0]=2 884 B8R0.8 CCCCC(N)B(O)O HR32491 [0,2,0,0,0,0|1,0,1]=4 885 B8R0.8 CCCCC(N)C(=O)O HR133839 [0,2,0,0,0,0|0,0,0]=2 886 B8R0.8 CCCCC(N)C(=O)O HR134634 [0,2,0,0,0,0|0,0,0]=2 887 B8R0.8 CCCCC(N)C(=O)O HR134894 [0,2,0,0,0,0|0,0,0]=2 888 B8R0.8 CCCOC(=O)C(C)O HR104314 [0,2,0,0,0,0|1,0,0]=3 889 B8R0.8 CCCOC(=O)C(C)O HR143626 [0,2,0,0,0,0|1,0,0]=3 890 B8R0.8 CSCCC(N)C(=O)O HR100026 [0,2,0,0,0,0|0,0,0]=2 891 B8R0.8 CSCCC(N)C(=O)O HR123144 [0,2,0,0,0,0|0,0,0]=2 892 B8R0.8 CSCCC(N)C(=O)O HR123406 [0,2,0,0,0,0|0,0,0]=2 893 B8R0.8 CSCCC(N)C(=O)O HR132929 [0,2,0,0,0,0|0,0,0]=2 894 B8R0.8 CSCCC(N)C(=O)O HR137287 [0,2,0,0,0,0|0,0,0]=2 895 B8R0.8 CSCCC(N)C(N)=O HR114117 [0,2,0,0,0,0|1,0,0]=3 896 B8R0.8 CSCCC(N)C(O)=[Se] HR126623 [0,2,0,0,0,0|0,1,0]=3 897 B8R0.8 CSCCC(N)[13C](=O)O HR140512 [0,2,0,0,0,0|0,0,0]=2 898 B8R0.8 CSCCC(O)C(=O)O HR136742 [0,2,0,0,0,0|0,0,0]=2 899 B8R0.8 CSCCC(O)C(=O)[O-] HR118219 [0,2,0,0,0,0|0,0,1]=3 900 B8R0.8 C[35S]CCC(N)C(=O)O HR143199 [0,2,0,0,0,0|0,0,0]=2 901 B8R0.8 C[Se]CCC(N)C(=O)O HR129810 [0,2,0,0,0,0|0,0,0]=2 902 B8R0.8 NC(CCCO)C(=O)O HR114281 [0,2,0,0,0,0|0,0,0]=2 903 B8R0.8 NCCCC(N)C(=O)O HR123396 [0,2,0,0,0,0|0,0,0]=2 904 B8R0.8 NCCCC(N)C(=O)O HR123926 [0,2,0,0,0,0|0,0,0]=2 905 B8R0.8 NCCCC(N)C(=O)O HR124308 [0,2,0,0,0,0|0,0,0]=2 906 B8R0.8 NCCCC(N)C(=O)O HR135672 [0,2,0,0,0,0|0,0,0]=2 907 B8R0.8 NCCCC(N)C(=O)O HR142321 [0,2,0,0,0,0|0,0,0]=2 908 B8R0.8 NCCCC(N)C(=O)O HR143440 [0,2,0,0,0,0|0,0,0]=2 909 B8R0.8 NCCCC(N)C(=O)O ORJL01301 [0,2,0,0,0,0|0,0,0]=2 910 B8R0.9 C#CC(C)CNC(C)=O HR123193 [0,2,0,0,0,0|2,0,0]=4 911 B8R0.9 C=CC(N)CCC(=O)O HR134815 [0,2,0,0,0,0|0,0,1]=3 912 B8R0.9 CC(=O)OCC(O)CO HR119576 [0,2,0,0,0,0|2,0,0]=4 913 B8R0.9 CCC(=O)CCC(C)=O HR121178 [0,2,0,0,0,0|1,0,0]=3 914 B8R0.9 CCC(C)COC(=O)Cl HR143745 [0,2,0,0,0,0|1,0,0]=3 915 B8R0.9 CCC(C)COC(C)=O HR104042 [0,2,0,0,0,0|1,0,0]=3 916 B8R0.9 CCC(C)COC(C)=O HR112686 [0,2,0,0,0,0|1,0,0]=3 917 B8R0.9 COC(=O)CCC(=O)Cl HR123462 [0,2,0,0,0,0|1,0,1]=4 918 B8R0.9 COC(=O)CCC(=O)[O-] HR138200 [0,2,0,0,0,0|0,0,2]=4 919 B8R0.9 COC(=O)CCC(C)O HR125584 [0,2,0,0,0,0|0,0,0]=2 920 B8R0.9 COC(=O)CCS(=O)[O-] HR113144 [0,2,0,0,0,0|2,0,0]=4 921 B8R0.9 COC(C)COC(C)=O HR143173 [0,2,0,0,0,0|2,0,0]=4 922 B8R0.9 C\C(CCC(C)C)=N/O HR100835 [0,2,0,0,0,0|1,0,0]=3 923 B8R0.9 NCC(=O)CCC(=O)O HR115792 [0,2,0,0,0,0|0,0,1]=3 924 B8R0.9 NCC(=O)CCC(=O)O HR124289 [0,2,0,0,0,0|0,0,1]=3 925 B8R0.9 NCC(=O)NCC(=O)O HR100015 [0,2,0,0,0,0|1,0,1]=4 926 B8R0.11 CCCCC(CC)CO HR130189 [0,2,0,0,0,0|1,0,1]=4 927 B8R0.11 CCCCC(CO)CO HR120381 [0,2,0,0,0,0|0,0,2]=4 928 B8R0.11 CCC\C=C(/C=O)CC HR103170 [0,2,0,0,0,0|1,0,1]=4 929 B8R0.25 CCCCC(C)(O)CC HR138812 [0,2,0,0,0,0|1,0,1]=4 930 B8R0.25 CCCC[Si](C)(C)OC HR101504 [0,2,0,0,0,0|1,1,0]=4 931 B8R0.7 C#CCCCCC(=O)O HR102532 [0,2,0,0,0,0|0,0,0]=2 932 B8R0.7 C=CCCCOC(C)=O HR143247 [0,2,0,0,0,0|1,0,1]=4 933 B8R0.7 CC(=O)NCCCCN HR118654 [0,2,0,0,0,0|1,0,0]=3 934 B8R0.7 CC(=O)OCCCCBr HR131090 [0,2,0,0,0,0|1,0,0]=3 935 B8R0.7 CC(=O)OCCCCCl HR122635 [0,2,0,0,0,0|1,0,0]=3 936 B8R0.7 CCCCCCB(O)O HR124554 [0,2,0,0,0,0|1,0,1]=4 937 B8R0.7 CCCCCCC(=O)Cl HR135566 [0,2,0,0,0,0|1,0,0]=3 938 B8R0.7 CCCCCCC(=O)[O-] HR123614 [0,2,0,0,0,0|0,0,1]=3 939 B8R0.7 CCCCCCC(C)=O HR138624 [0,2,0,0,0,0|1,0,0]=3 940 B8R0.7 CCCCCCC(C)O HR125954 [0,2,0,0,0,0|1,0,1]=4 941 B8R0.7 CCCCCCC(C)O HR128561 [0,2,0,0,0,0|1,0,1]=4 942 B8R0.7 CCCCCCC(C)O HR132915 [0,2,0,0,0,0|1,0,1]=4 943 B8R0.7 CCCCCCC(C)O HR133230 [0,2,0,0,0,0|1,0,1]=4 944 B8R0.7 CCCCCOC(=O)Cl HR137197 [0,2,0,0,0,0|1,0,0]=3 945 B8R0.7 CCCCOCC(=O)O HR124559 [0,2,0,0,0,0|0,0,0]=2 946 B8R0.7 CCCCOCC(C)O HR132803 [0,2,0,0,0,0|1,0,1]=4 947 B8R0.7 CCCC\C=C\B(O)O HR110117 [0,2,0,0,0,0|1,0,1]=4 948 B8R0.7 CCOCCOC(=O)Cl HR139845 [0,2,0,0,0,0|1,0,0]=3 949 B8R0.7 COCCOCC(=O)O HR131950 [0,2,0,0,0,0|0,0,0]=2 950 B8R0.7 CSCCCOC(C)=O HR130302 [0,2,0,0,0,0|1,0,0]=3 951 B8R0.7 N=C(N)NCCCCN HR135389 [0,2,0,0,0,0|2,0,0]=4 952 B8R0.7 NCCCCCC(=O)O HR123389 [0,2,0,0,0,0|0,0,0]=2 953 B8R0.7 NCCCCCC(=O)O HR140316 [0,2,0,0,0,0|0,0,0]=2 954 B8R0.7 O=C(Cl)CCCCCBr HR130949 [0,2,0,0,0,0|1,0,0]=3 955 B8R0.7 O=C(Cl)CCCCCCl HR101723 [0,2,0,0,0,0|1,0,0]=3 956 B8R0.7 O=C(O)CCCCCBr HR131936 [0,2,0,0,0,0|0,0,0]=2 957 B8R0.7 O=C(O)CCCCCCl HR131336 [0,2,0,0,0,0|0,0,0]=2 958 B8R0.21 CCCCCS(=O)(=O)Cl HR110757 [0,2,0,0,0,0|1,0,1]=4 959 B8R0.21 CCCCCS(=O)(=O)[O-] HR127418 [0,2,0,0,0,0|1,0,1]=4 960 B8R0.21 CCCCCS(=O)(=O)[O-] HR134915 [0,2,0,0,0,0|1,0,1]=4 961 B8R0.21 CCCCOS(C)(=O)=O HR131554 [0,2,0,0,0,0|1,0,1]=4 962 B8R0.28 CC(=O)CCC=C(C)C HR127537 [0,2,0,0,0,0|1,0,1]=4 963 B8R0.28 CC(=O)CCCC(C)C HR145408 [0,2,0,0,0,0|1,0,0]=3 964 B8R0.28 CC(=O)C\C=C\C(=O)O HR110909 [0,2,0,0,0,0|0,0,2]=4 965 B8R0.28 CC(C)CCOC(=O)Cl HR143844 [0,2,0,0,0,0|1,0,0]=3 966 B8R0.28 CC(O)CCCC(C)O HR143862 [0,2,0,0,0,0|1,0,1]=4 967 B8R0.28 CC(O)COCC(C)O HR133846 [0,2,0,0,0,0|1,0,1]=4 968 B8R0.28 CN(C)CCCC(=O)O HR125161 [0,2,0,0,0,0|0,0,0]=2 969 B8R0.28 CN(C)C\C=C\C(=O)O HR112008 [0,2,0,0,0,0|0,0,2]=4 970 B8R0.28 CN(C)C\C=C\C(=O)O HR138898 [0,2,0,0,0,0|0,0,2]=4 971 B8R0.28 N=C(N)NCCC(=O)O HR123675 [0,2,0,0,0,0|1,0,1]=4 972 B8R0.28 N=C(S)NCCC(=O)O HR129341 [0,2,0,0,0,0|1,0,1]=4 973 B8R0.28 O=C(Cl)CCCC(=O)Cl HR142561 [0,2,0,0,0,0|1,0,1]=4 974 B8R0.28 O=C(O)CCCC(=O)O HR132258 [0,2,0,0,0,0|0,0,1]=3 975 B8R0.28 O=C(O)CNCC(=O)O HR138649 [0,2,0,0,0,0|1,0,1]=4 976 B8R0.28 O=C(O)COCC(=O)O HR121403 [0,2,0,0,0,0|1,0,1]=4 977 B8R0.28 O=C(O)CSCC(=O)O HR124866 [0,2,0,0,0,0|1,0,1]=4 978 B8R0.28 O=C([O-])CCCC(=O)[O-] HR145446 [0,2,0,0,0,0|0,0,2]=4 979 B8R0.12 C=CCC(C)(C)C(=O)O HR12797 [0,2,0,0,0,0|0,0,2]=4 980 B8R0.12 C=CCC(C)(N)C(=O)O HR119366 [0,2,0,0,0,0|0,0,2]=4 981 B8R0.12 C=CCC(C)(N)C(=O)O HR139311 [0,2,0,0,0,0|0,0,2]=4 982 B8R0.12 C=CCC(F)(F)C(=O)O HR118411 [0,2,0,0,0,0|0,0,2]=4 983 B8R0.12 CC(C)(CCN)C(=O)O HR32699 [0,2,0,0,0,0|1,0,0]=3 984 B8R0.12 CCCC(C)(C)C(=O)O HR112968 [0,2,0,0,0,0|0,0,0]=2 985 B8R0.12 CCOC(C)(C)C(=O)O HR118727 [0,2,0,0,0,0|1,0,0]=3 986 B8R0.29 CC(C)(C)CCC(=O)Cl HR140153 [0,2,0,0,0,0|1,0,0]=3 987 B8R0.29 CC(C)(C)NCC(=O)Cl HR111711 [0,2,0,0,0,0|2,0,0]=4 988 B8R0.29 CC(C)(C)NCC(=O)O HR107503 [0,2,0,0,0,0|1,0,0]=3 989 B8R0.29 CC(C)(C)NCC(=O)O HR143867 [0,2,0,0,0,0|1,0,0]=3 990 B8R0.29 CC(C)(C)OCC(=O)O HR143671 [0,2,0,0,0,0|1,0,0]=3 991 B8R0.29 CS(=O)(=O)CCC(=O)O HR112123 [0,2,0,0,0,0|1,0,0]=3 992 B8R0.29 C[Si](C)(C)CCC(=O)O HR106616 [0,2,0,0,0,0|0,1,0]=3 993 B8R0.29 NS(=O)(=O)CCC(=O)O HR113934 [0,2,0,0,0,0|2,0,0]=4 994 B8R0.29 O=C(O)CCC(F)(F)F HR127213 [0,2,0,0,0,0|1,0,0]=3 995 B8R0.29 O=C(O)CCP(=O)(O)O HR121966 [0,2,0,0,0,0|2,0,0]=4 996 B6R1.2 CC1=NCCC1 HR128050 [1,0,0,1,0,0|2,0,0]=4 997 B6R1.2 CC1CCCO1 HR10841 [1,0,0,1,0,0|1,0,1]=4 998 B6R1.2 ClC1=CCCC1 HR140861 [1,0,0,1,0,0|2,0,0]=4 999 B6R1.2 NC1=NCCC1 HR112379 [1,0,0,1,0,0|2,0,0]=4 1000 B6R1.2 NC1=NCCC1 HR112697 [1,0,0,1,0,0|2,0,0]=4 1001 B6R1.2 O=C1C=CCC1 HR136753 [1,0,0,1,0,0|1,0,1]=4 1002 B6R1.2 O=C1C=CCO1 HR119486 [1,0,0,1,0,0|0,0,2]=4 1003 B6R1.2 O=C1CCCC1 HR147576 [1,0,0,1,0,0|1,0,0]=3 1004 B6R1.2 O=C1CCCN1 HR144424 [1,0,0,1,0,0|1,0,0]=3 1005 B6R1.2 O=C1CCCN1 HR147307 [1,0,0,1,0,0|1,0,0]=3 1006 B6R1.2 O=C1CCNC1 HR126926 [1,0,0,1,0,0|2,0,0]=4 1007 B6R1.2 O=C1CCNC1 HR127189 [1,0,0,1,0,0|2,0,0]=4 1008 B6R1.2 O=C1CCNN1 HR146471 [1,0,0,1,0,0|2,0,0]=4 1009 B6R1.2 O=C1CCOC1 HR109194 [1,0,0,1,0,0|2,0,0]=4 1010 B6R1.2 O=C1CCSC1 HR5575 [1,0,0,1,0,0|2,0,0]=4 1011 B6R1.2 O=C1CNCN1 HR114619 [1,0,0,1,0,0|2,0,0]=4 1012 B6R1.2 O=C1CO[Pt]O1 HR131319 [1,0,0,1,0,0|2,0,0]=4 1013 B6R1.2 O=C1NCCN1 HR124833 [1,0,0,1,0,0|2,0,0]=4 1014 B6R1.2 O=C1NCCN1 HR138382 [1,0,0,1,0,0|2,0,0]=4 1015 B6R1.2 O=C1NCCO1 HR134554 [1,0,0,1,0,0|1,0,0]=3 1016 B6R1.2 O=C1NCCS1 HR14582 [1,0,0,1,0,0|1,1,0]=4 1017 B6R1.2 O=C1OCCO1 APSA06102 [1,0,0,1,0,0|1,0,0]=3 1018 B6R1.2 O=S1OCCO1 HR134061 [1,0,0,1,0,0|2,0,0]=4 1019 B6R1.3 CCCC1CO1 HR102110 [1,0,0,1,0,0|1,0,1]=4 1020 B6R1.5 CC1CC(=O)C1 HR121137 [1,0,0,1,0,0|1,0,0]=3 1021 B6R1.5 NC1CC(=O)C1 HR145979 [1,0,0,1,0,0|2,0,0]=4 1022 B6R1.5 O=C1CC(Br)C1 HR120509 [1,0,0,1,0,0|2,0,0]=4 1023 B6R1.5 O=C1CC(O)C1 HR119245 [1,0,0,1,0,0|2,0,0]=4 1024 B6R1.11 CC(=O)C1CC1 HR134464 [1,0,0,1,0,0|1,0,0]=3 1025 B6R1.11 CC(O)C1CC1 HR101733 [1,0,0,1,0,0|1,0,1]=4 1026 B6R1.11 N=C(N)C1CC1 HR137003 [1,0,0,1,0,0|2,0,0]=4 1027 B6R1.11 NC(=O)C1CC1 HR21401 [1,0,0,1,0,0|1,0,0]=3 1028 B6R1.11 O=C(Cl)C1CC1 FISA07805 [1,0,0,1,0,0|1,0,0]=3 1029 B6R1.11 O=C(O)C1CC1 HR133116 [1,0,0,1,0,0|0,0,0]=2 1030 B6R1.11 O=S([O-])C1CC1 HR105027 [1,0,0,1,0,0|1,0,1]=4 1031 B6R1.11 OB(O)C1CC1 HR4014 [1,0,0,1,0,0|1,0,1]=4 1032 B6R1.1 C1=COCCC1 HR126451 [1,0,0,1,0,0|0,0,1]=3 1033 B6R1.1 C1CCCCC1 HR106893 [1,0,0,1,0,0|1,0,1]=4 1034 B6R1.1 C1CCCCC1 HR147601 [1,0,0,1,0,0|1,0,1]=4 1035 B6R1.1 C1CCNCC1 ARJL02201 [1,0,0,1,0,0|1,0,1]=4 1036 B6R1.1 C1CCNCC1 HR101018 [1,0,0,1,0,0|1,0,1]=4 1037 B6R1.1 C1CCNCC1 HR131157 [1,0,0,1,0,0|1,0,1]=4 1038 B6R1.1 C1CCNCC1 HR132491 [1,0,0,1,0,0|1,0,1]=4 1039 B6R1.1 C1CCNCC1 HR149186 [1,0,0,1,0,0|1,0,1]=4 1040 B6R1.1 C1CCNNC1 HR103533 [1,0,0,1,0,0|2,0,0]=4 1041 B6R1.1 C1CCNNC1 HR104595 [1,0,0,1,0,0|2,0,0]=4 1042 B6R1.1 C1CCSCC1 HR125674 [1,0,0,1,0,0|0,1,1]=4 1043 B6R1.1 C1CC[NH2+]CC1 HR106637 [1,0,0,1,0,0|1,0,1]=4 1044 B6R1.1 C1COCCN1 FAXM00202 [1,0,0,1,0,0|1,0,1]=4 1045 B6R1.1 C1COCCN1 HR113929 [1,0,0,1,0,0|1,0,1]=4 1046 B6R1.1 C1COCCN1 HR122525 [1,0,0,1,0,0|1,0,1]=4 1047 B6R1.1 C1COCCN1 HR15002 [1,0,0,1,0,0|1,0,1]=4 1048 B6R1.6 BrCC1CCC1 HR23272 [1,0,0,1,0,0|1,0,1]=4 1049 B6R1.6 BrCC1CCO1 HR114702 [1,0,0,1,0,0|1,0,1]=4 1050 B6R1.6 ICC1CCC1 HR122084 [1,0,0,1,0,0|1,0,1]=4 1051 B6R1.6 ICC1CCO1 HR118583 [1,0,0,1,0,0|1,0,1]=4 1052 B6R1.6 N#CC1CCC1 HR112436 [1,0,0,1,0,0|1,0,1]=4 1053 B6R1.6 NCC1CCC1 HR100695 [1,0,0,1,0,0|1,0,1]=4 1054 B6R1.6 NCC1CCC1 HR102822 [1,0,0,1,0,0|1,0,1]=4 1055 B6R1.6 NNC1CCC1 HR103247 [1,0,0,1,0,0|2,0,0]=4 1056 B6R1.6 NNC1CCC1 HR146851 [1,0,0,1,0,0|2,0,0]=4 1057 B6R1.6 O=CC1CCC1 HR128795 [1,0,0,1,0,0|0,0,0]=2 1058 B6R1.6 OCC1CCC1 HR133510 [1,0,0,1,0,0|0,0,1]=3 1059 B6R1.6 OCC1CCN1 HR145899 [1,0,0,1,0,0|1,0,1]=4 1060 B6R1.6 OCC1CNC1 HR118895 [1,0,0,1,0,0|1,0,1]=4 1061 B6R1.6 OCC1COC1 HR110451 [1,0,0,1,0,0|1,0,1]=4 1062 B8R1.1 C=CC1CCC(=O)N1 HR117010 [0,1,0,1,0,0|1,0,1]=4 1063 B8R1.1 C=CC1CCC(=O)O1 HR127408 [0,1,0,1,0,0|0,0,1]=3 1064 B8R1.1 C=CC1COC(=O)O1 HR135385 [0,1,0,1,0,0|0,0,2]=4 1065 B8R1.1 CCC1CCC(=O)O1 HR137195 [0,1,0,1,0,0|0,0,0]=2 1066 B8R1.1 CCN1CCC(=O)C1 HR113880 [0,1,0,1,0,0|1,0,0]=3 1067 B8R1.1 CCN1CCC(O)C1 HR103620 [0,1,0,1,0,0|1,0,1]=4 1068 B8R1.1 O=C1C=CC(CO)O1 HR108465 [0,1,0,1,0,0|0,0,2]=4 1069 B8R1.1 O=C1C=CC(CO)O1 HR7063 [0,1,0,1,0,0|0,0,2]=4 1070 B8R1.1 O=C1CCC(CBr)N1 HR147112 [0,1,0,1,0,0|1,0,0]=3 1071 B8R1.1 O=C1CCC(CO)N1 HR107754 [0,1,0,1,0,0|1,0,0]=3 1072 B8R1.1 O=C1CCC(CO)N1 HR126441 [0,1,0,1,0,0|1,0,0]=3 1073 B8R1.1 O=C1CCC(CO)N1 HR130096 [0,1,0,1,0,0|1,0,0]=3 1074 B8R1.1 O=C1CCC(CO)O1 HR113766 [0,1,0,1,0,0|0,0,0]=2 1075 B8R1.1 O=C1CCC(CO)O1 HR145842 [0,1,0,1,0,0|0,0,0]=2 1076 B8R1.1 O=C1CCC(CO)O1 HR145872 [0,1,0,1,0,0|0,0,0]=2 1077 B8R1.1 O=C1NC(CI)CO1 HR146345 [0,1,0,1,0,0|2,0,0]=4 1078 B8R1.1 O=C1NCC(CCl)O1 HR101243 [0,1,0,1,0,0|1,0,0]=3 1079 B8R1.1 O=C1NCC(CCl)O1 HR105324 [0,1,0,1,0,0|1,0,0]=3 1080 B8R1.1 O=C1OCC(CO)O1 HR107356 [0,1,0,1,0,0|1,0,0]=3 1081 B8R1.4 CC1=CC(=O)CCC1 HR142178 [0,1,0,1,0,0|1,0,0]=3 1082 B8R1.4 CC1CC(=O)CCN1 HR120677 [0,1,0,1,0,0|1,0,0]=3 1083 B8R1.4 CC1CC(=O)CCN1 HR140081 [0,1,0,1,0,0|1,0,0]=3 1084 B8R1.4 CC1CC(O)CCO1 HR120725 [0,1,0,1,0,0|1,0,1]=4 1085 B8R1.4 CC1CC(O)CCO1 HR121039 [0,1,0,1,0,0|1,0,1]=4 1086 B8R1.4 CC1CCCC(=O)C1 HR143817 [0,1,0,1,0,0|1,0,0]=3 1087 B8R1.4 CC1CNCC(C)O1 HR130869 [0,1,0,1,0,0|1,0,1]=4 1088 B8R1.4 CC1CNCC(C)O1 HR133276 [0,1,0,1,0,0|1,0,1]=4 1089 B8R1.4 CC1CNCC(C)O1 HR145914 [0,1,0,1,0,0|1,0,1]=4 1090 B8R1.4 CC1CNCC(C)O1 HR145915 [0,1,0,1,0,0|1,0,1]=4 1091 B8R1.4 CN1CCCC(=O)C1 HR120165 [0,1,0,1,0,0|1,0,0]=3 1092 B8R1.4 CN1CCCC(O)C1 HR119067 [0,1,0,1,0,0|1,0,1]=4 1093 B8R1.4 CN1CCNC(=O)C1 HR119613 [0,1,0,1,0,0|2,0,0]=4 1094 B8R1.4 NC1=CC(=O)CCC1 HR114131 [0,1,0,1,0,0|1,0,1]=4 1095 B8R1.4 NC1CCCC(O)C1 HR12673 [0,1,0,1,0,0|1,0,1]=4 1096 B8R1.4 NC1CCNC(=O)C1 HR107374 [0,1,0,1,0,0|1,0,0]=3 1097 B8R1.4 NC1CCNC(=O)C1 HR113606 [0,1,0,1,0,0|1,0,0]=3 1098 B8R1.4 O=C1CC(O)CCN1 HR110819 [0,1,0,1,0,0|1,0,0]=3 1099 B8R1.4 O=C1CCCC(=O)C1 HR129932 [0,1,0,1,0,0|1,0,1]=4 1100 B8R1.4 O=C1CCCC(=O)N1 HR139848 [0,1,0,1,0,0|1,0,1]=4 1101 B8R1.4 O=C1CCCC(=O)O1 ZOCQ02609 [0,1,0,1,0,0|0,0,1]=3 1102 B8R1.4 O=C1CCNC(=O)C1 HR127778 [0,1,0,1,0,0|1,0,1]=4 1103 B8R1.4 O=C1COCC(=O)O1 HR104159 [0,1,0,1,0,0|1,0,1]=4 1104 B8R1.4 O=C1CSCC(=O)O1 HR100358 [0,1,0,1,0,0|1,0,1]=4 1105 B8R1.4 OC1CCCC(O)C1 HR133806 [0,1,0,1,0,0|1,0,1]=4 1106 B8R1.18 CC1CC(=O)N(C)C1 HR102594 [0,1,0,1,0,0|2,0,0]=4 1107 B8R1.18 NC1CC(=O)OC1=O HR110338 [0,1,0,1,0,0|1,0,1]=4 1108 B8R1.18 O=C1OC(Cl)C(Cl)O1 HR113790 [0,1,0,1,0,0|2,0,0]=4 1109 B8R1.34 O=C(O)CC1CCC1 HR133624 [0,1,0,1,0,0|0,0,0]=2 1110 B8R1.34 O=C(O)CC1COC1 HR145748 [0,1,0,1,0,0|0,0,0]=2 1111 B8R1.40 NCC(=O)NC1CC1 HR145980 [0,1,0,1,0,0|2,0,0]=4 1112 B8R1.51 CC1(C)CCC(=O)N1 HR104854 [0,1,0,1,0,0|1,0,0]=3 1113 B8R1.51 CC1(C)CNC(=O)C1 HR121474 [0,1,0,1,0,0|2,0,0]=4 1114 B8R1.51 CC1(C)CNC(=O)N1 HR33167 [0,1,0,1,0,0|2,0,0]=4 1115 B8R1.51 CC1COS(=O)(=O)O1 HR135126 [0,1,0,1,0,0|2,0,0]=4 1116 B8R1.2 COC1=CCCCC1 HR108356 [0,1,0,1,0,0|1,0,0]=3 1117 B8R1.2 COC1=CCOCC1 HR148879 [0,1,0,1,0,0|2,0,0]=4 1118 B8R1.2 COC1=NCCCC1 HR140176 [0,1,0,1,0,0|1,0,0]=3 1119 B8R1.2 N#CC1=CCCCO1 HR120057 [0,1,0,1,0,0|1,0,1]=4 1120 B8R1.2 NCC1CCCCO1 HR109315 [0,1,0,1,0,0|1,0,1]=4 1121 B8R1.2 NOC1CCCCO1 HR123792 [0,1,0,1,0,0|0,0,2]=4 1122 B8R1.2 O=CC1=CCCCC1 HR124654 [0,1,0,1,0,0|1,0,0]=3 1123 B8R1.2 O=CC1=CCCOC1 HR106218 [0,1,0,1,0,0|2,0,0]=4 1124 B8R1.2 O=CC1CCCCC1 HR3082 [0,1,0,1,0,0|1,0,1]=4 1125 B8R1.2 O=CN1CCCCC1 HR135142 [0,1,0,1,0,0|2,0,0]=4 1126 B8R1.2 OCC1CCCCC1 HR3098 [0,1,0,1,0,0|1,0,1]=4 1127 B8R1.2 OCC1CCCCN1 HR129497 [0,1,0,1,0,0|1,0,1]=4 1128 B8R1.2 OCC1CCCCN1 HR150905 [0,1,0,1,0,0|1,0,1]=4 1129 B8R1.2 OCC1CCCCN1 HR150906 [0,1,0,1,0,0|1,0,1]=4 1130 B8R1.2 OCC1CCCCO1 HR9734 [0,1,0,1,0,0|0,0,2]=4 1131 B8R1.2 ON=C1CCCCC1 HR136101 [0,1,0,1,0,0|1,0,0]=3 1132 B8R1.3 CC1=CCC(=O)CC1 HR105835 [0,1,0,1,0,0|1,0,1]=4 1133 B8R1.3 CC1=NNC(=O)CC1 HR117768 [0,1,0,1,0,0|1,0,1]=4 1134 B8R1.3 CC1CCC(=O)CC1 HR123899 [0,1,0,1,0,0|1,0,0]=3 1135 B8R1.3 CC1CCC(O)CC1 HR102432 [0,1,0,1,0,0|1,0,1]=4 1136 B8R1.3 CC1CCC(O)CC1 HR142762 [0,1,0,1,0,0|1,0,1]=4 1137 B8R1.3 CC1CNC(=O)CO1 HR148882 [0,1,0,1,0,0|1,0,0]=3 1138 B8R1.3 CN1CCC(=O)CC1 HR128468 [0,1,0,1,0,0|2,0,0]=4 1139 B8R1.3 NC1CCC(=O)CC1 HR108450 [0,1,0,1,0,0|1,0,0]=3 1140 B8R1.3 NC1CCC(=O)NC1 HR114241 [0,1,0,1,0,0|1,0,0]=3 1141 B8R1.3 NC1CCC(O)CC1 HR106375 [0,1,0,1,0,0|1,0,1]=4 1142 B8R1.3 NC1CCC(O)CC1 HR108164 [0,1,0,1,0,0|1,0,1]=4 1143 B8R1.3 NC1CCC(O)CC1 HR111079 [0,1,0,1,0,0|1,0,1]=4 1144 B8R1.3 NC1CCC(O)CC1 HR146550 [0,1,0,1,0,0|1,0,1]=4 1145 B8R1.3 NC1CCC(O)CC1 VOJL00905 [0,1,0,1,0,0|1,0,1]=4 1146 B8R1.3 O=C1CCC(=O)CC1 HR123033 [0,1,0,1,0,0|1,0,1]=4 1147 B8R1.3 O=C1CCC(=O)NC1 HR110594 [0,1,0,1,0,0|1,0,1]=4 1148 B8R1.3 O=C1CCC(O)CC1 HR132671 [0,1,0,1,0,0|1,0,0]=3 1149 B8R1.3 O=C1CCC(O)CN1 HR104378 [0,1,0,1,0,0|1,0,0]=3 1150 B8R1.3 OC1CCC(Cl)CC1 HR140569 [0,1,0,1,0,0|1,0,1]=4 1151 B8R1.3 OC1CCC(O)CC1 HR124198 [0,1,0,1,0,0|1,0,1]=4 1152 B8R1.3 OC1CCC(O)CC1 HR143769 [0,1,0,1,0,0|1,0,1]=4 1153 B8R1.5 C=C1CCCCC1=C HR100430 [0,1,0,1,0,0|2,0,0]=4 1154 B8R1.5 CC1CCCCC1=O HR128184 [0,1,0,1,0,0|1,0,0]=3 1155 B8R1.5 CC1CCCCC1O HR10840 [0,1,0,1,0,0|1,0,1]=4 1156 B8R1.5 CC1CNCCC1=O HR102395 [0,1,0,1,0,0|2,0,0]=4 1157 B8R1.5 CC1CNCCC1=O HR144741 [0,1,0,1,0,0|2,0,0]=4 1158 B8R1.5 CC1COCCC1=O HR108661 [0,1,0,1,0,0|2,0,0]=4 1159 B8R1.5 CC1NCCNC1=O HR149053 [0,1,0,1,0,0|2,0,0]=4 1160 B8R1.5 CC1OCCNC1=O HR148881 [0,1,0,1,0,0|2,0,0]=4 1161 B8R1.5 CN1CCNCC1=O HR121878 [0,1,0,1,0,0|2,0,0]=4 1162 B8R1.5 NC1CCCCC1O HR105750 [0,1,0,1,0,0|1,0,1]=4 1163 B8R1.5 NC1CCCCC1O HR106708 [0,1,0,1,0,0|1,0,1]=4 1164 B8R1.5 NC1CCCCC1O HR106746 [0,1,0,1,0,0|1,0,1]=4 1165 B8R1.5 NC1CCCCC1O HR108115 [0,1,0,1,0,0|1,0,1]=4 1166 B8R1.5 NC1CCCCC1O HR14514 [0,1,0,1,0,0|1,0,1]=4 1167 B8R1.5 NC1CCCCC1O HR146109 [0,1,0,1,0,0|1,0,1]=4 1168 B8R1.5 NC1CCCCC1O HR146110 [0,1,0,1,0,0|1,0,1]=4 1169 B8R1.5 NC1CCCCC1O HR146111 [0,1,0,1,0,0|1,0,1]=4 1170 B8R1.5 NC1CCCCC1O HR146112 [0,1,0,1,0,0|1,0,1]=4 1171 B8R1.5 NC1CCCCC1O HR148126 [0,1,0,1,0,0|1,0,1]=4 1172 B8R1.5 NC1CCCNC1=O HR103141 [0,1,0,1,0,0|1,0,0]=3 1173 B8R1.5 NC1CCCNC1=O HR109690 [0,1,0,1,0,0|1,0,0]=3 1174 B8R1.5 NC1CCCNC1=O HR143772 [0,1,0,1,0,0|1,0,0]=3 1175 B8R1.5 NN1CCCCC1=O HR128047 [0,1,0,1,0,0|1,0,0]=3 1176 B8R1.5 O=C1CCCCC1=O HR133849 [0,1,0,1,0,0|0,0,1]=3 1177 B8R1.5 O=C1CCCCC1Br HR121776 [0,1,0,1,0,0|1,0,0]=3 1178 B8R1.5 O=C1CCCCC1Cl HR133138 [0,1,0,1,0,0|1,0,0]=3 1179 B8R1.5 O=C1CCCCC1F HR150360 [0,1,0,1,0,0|1,0,0]=3 1180 B8R1.5 O=C1CCNCC1Br HR118186 [0,1,0,1,0,0|2,0,0]=4 1181 B8R1.5 O=C1CCNCC1F HR115169 [0,1,0,1,0,0|2,0,0]=4 1182 B8R1.5 O=C1CCNCC1F HR149775 [0,1,0,1,0,0|2,0,0]=4 1183 B8R1.5 O=C1CCOCC1F HR150373 [0,1,0,1,0,0|2,0,0]=4 1184 B8R1.5 O=C1NCCCC1F HR149509 [0,1,0,1,0,0|1,0,0]=3 1185 B8R1.5 O=C1NCCCC1O HR147038 [0,1,0,1,0,0|1,0,0]=3 1186 B8R1.5 OC1CCCCC1Cl HR136648 [0,1,0,1,0,0|1,0,1]=4 1187 B8R1.5 OC1CCCCC1O HR136389 [0,1,0,1,0,0|0,0,2]=4 1188 B8R1.5 OC1CCCCC1O HR140132 [0,1,0,1,0,0|0,0,2]=4 1189 B8R1.22 O=C1C=CCCCC1 HR146270 [0,1,0,1,0,0|1,0,0]=3 1190 B8R1.22 O=C1CCCCCN1 HR129512 [0,1,0,1,0,0|1,0,0]=3 1191 B8R1.22 O=C1CCCCCO1 HR107144 [0,1,0,1,0,0|0,0,0]=2 1192 B8R1.22 O=C1CCCCCO1 HR120205 [0,1,0,1,0,0|0,0,0]=2 1193 B8R1.22 O=C1CCCNCC1 HR107777 [0,1,0,1,0,0|1,0,0]=3 1194 B8R1.22 O=C1CCCNCC1 HR136701 [0,1,0,1,0,0|1,0,0]=3 1195 B8R1.22 O=C1CCNCCN1 HR101958 [0,1,0,1,0,0|1,0,0]=3 1196 B8R1.22 O=C1CCNCCN1 HR113359 [0,1,0,1,0,0|1,0,0]=3 1197 B8R1.22 OC1CCCCCC1 HR122711 [0,1,0,1,0,0|1,0,1]=4 1198 B8R1.22 OC1CCCNCC1 HR110756 [0,1,0,1,0,0|1,0,1]=4 1199 B8R1.38 COC(=O)C1CCC1 HR141345 [0,1,0,1,0,0|0,0,0]=2 1200 B8R1.38 COC(=O)C1CCN1 HR105944 [0,1,0,1,0,0|1,0,0]=3 1201 B8R1.38 COC(=O)C1CNC1 HR118307 [0,1,0,1,0,0|1,0,0]=3 1202 B8R1.38 COC(=O)C1CNC1 HR138569 [0,1,0,1,0,0|1,0,0]=3 1203 B8R1.50 CC1=C(O)C(=O)CC1 HR129501 [0,1,0,1,0,0|0,0,1]=3 1204 B8R1.50 CC1=C(O)C(=O)CO1 HR125202 [0,1,0,1,0,0|1,0,1]=4 1205 B8R1.50 CC1CCC(=O)C1=O HR129446 [0,1,0,1,0,0|0,0,1]=3 1206 B8R1.50 CC1CCC(=O)N1C HR142184 [0,1,0,1,0,0|1,0,0]=3 1207 B8R1.50 O=C1CCC(=O)N1O HR135012 [0,1,0,1,0,0|1,0,1]=4 1208 B8R1.50 O=C1OCC(O)C1O HR120212 [0,1,0,1,0,0|2,0,0]=4 1209 B8R1.52 C#CC1(O)CCCC1 HR107247 [0,1,0,1,0,0|1,0,1]=4 1210 B8R1.52 CCC1(O)CCCC1 HR128504 [0,1,0,1,0,0|1,0,1]=4 1211 B8R1.52 NC1(CO)CCCC1 HR105910 [0,1,0,1,0,0|1,0,1]=4 1212 B8R1.52 NCC1(O)CCCC1 HR102657 [0,1,0,1,0,0|1,0,1]=4 1213 B8R1.52 OCC1(F)CCCC1 HR34071 [0,1,0,1,0,0|1,0,1]=4 1214 B8R1.7 CC(=O)C1CCCC1 HR120520 [0,1,0,1,0,0|1,0,0]=3 1215 B8R1.7 NC(=O)C1CCCN1 HR112229 [0,1,0,1,0,0|1,0,0]=3 1216 B8R1.7 NC(=O)C1CCCN1 HR120776 [0,1,0,1,0,0|1,0,0]=3 1217 B8R1.7 NC(=O)C1CCCN1 HR125014 [0,1,0,1,0,0|1,0,0]=3 1218 B8R1.7 NC(=O)C1CCCN1 HR125279 [0,1,0,1,0,0|1,0,0]=3 1219 B8R1.7 NC(=O)C1CCCN1 HR133421 [0,1,0,1,0,0|1,0,0]=3 1220 B8R1.7 NC(=O)C1CCCN1 HR145038 [0,1,0,1,0,0|1,0,0]=3 1221 B8R1.7 NC(=O)C1CCNC1 HR105323 [0,1,0,1,0,0|1,0,0]=3 1222 B8R1.7 O=C(Cl)C1CCCC1 HR129546 [0,1,0,1,0,0|1,0,0]=3 1223 B8R1.7 O=C(Cl)N1CCCC1 HR142080 [0,1,0,1,0,0|1,0,0]=3 1224 B8R1.7 O=C(O)C1C=CCN1 HR105555 [0,1,0,1,0,0|0,0,2]=4 1225 B8R1.7 O=C(O)C1C=CCN1 HR117236 [0,1,0,1,0,0|0,0,2]=4 1226 B8R1.7 O=C(O)C1CC=CC1 HR137833 [0,1,0,1,0,0|0,0,1]=3 1227 B8R1.7 O=C(O)C1CCCC1 HR124454 [0,1,0,1,0,0|0,0,0]=2 1228 B8R1.7 O=C(O)C1CCCN1 HR122958 [0,1,0,1,0,0|0,0,0]=2 1229 B8R1.7 O=C(O)C1CCCN1 HR136921 [0,1,0,1,0,0|0,0,0]=2 1230 B8R1.7 O=C(O)C1CCCN1 HR142963 [0,1,0,1,0,0|0,0,0]=2 1231 B8R1.7 O=C(O)C1CCCN1 SASA03107 [0,1,0,1,0,0|0,0,0]=2 1232 B8R1.7 O=C(O)C1CCCO1 HR129714 [0,1,0,1,0,0|0,0,0]=2 1233 B8R1.7 O=C(O)C1CCCO1 HR135878 [0,1,0,1,0,0|0,0,0]=2 1234 B8R1.7 O=C(O)C1CCCO1 HR136153 [0,1,0,1,0,0|0,0,0]=2 1235 B8R1.7 O=C(O)C1CCNC1 HR110045 [0,1,0,1,0,0|0,0,0]=2 1236 B8R1.7 O=C(O)C1CCNC1 HR124075 [0,1,0,1,0,0|0,0,0]=2 1237 B8R1.7 O=C(O)C1CCNC1 HR139411 [0,1,0,1,0,0|0,0,0]=2 1238 B8R1.7 O=C(O)C1CCNC1 HR16223 [0,1,0,1,0,0|0,0,0]=2 1239 B8R1.7 O=C(O)C1CCOC1 HR109306 [0,1,0,1,0,0|0,0,0]=2 1240 B8R1.7 O=C(O)C1CCOC1 HR110235 [0,1,0,1,0,0|0,0,0]=2 1241 B8R1.7 O=C(O)C1CCOC1 HR111915 [0,1,0,1,0,0|0,0,0]=2 1242 B8R1.7 O=C(O)C1CSCN1 HR136394 [0,1,0,1,0,0|1,0,0]=3 1243 B8R1.7 O=C(O)C1CSCN1 HR137574 [0,1,0,1,0,0|1,0,0]=3 1244 B8R1.7 O=C(O)C1NCCS1 HR146541 [0,1,0,1,0,0|1,0,0]=3 1245 B8R1.7 OB(O)C1CCCC1 HR125876 [0,1,0,1,0,0|1,0,1]=4 1246 B8R1.7 OB(O)C1CCOC1 HR114876 [0,1,0,1,0,0|1,0,1]=4 1247 B8R1.7 S=C([S-])N1CCCC1 HR129801 [0,1,0,1,0,0|0,2,0]=4 1248 B8R1.19 CC1CCOS1(=O)=O HR121223 [0,1,0,1,0,0|1,0,1]=4 1249 B8R1.35 O=C(O)CCC1CC1 HR105458 [0,1,0,1,0,0|0,0,0]=2 1250 B8R1.36 BrCCCCC1CO1 HR120937 [0,1,0,1,0,0|1,0,1]=4 1251 B8R1.36 CCCCCC1CO1 HR111230 [0,1,0,1,0,0|1,0,1]=4 1252 B8R1.36 CCCCCC1CO1 HR111540 [0,1,0,1,0,0|1,0,1]=4 1253 B8R1.72 CC1(O)CCCCC1 HR107824 [0,1,0,1,0,0|1,0,1]=4 1254 B8R1.72 CC1(O)CCNCC1 TOSA04610 [0,1,0,1,0,0|1,0,1]=4 1255 B8R1.72 CC1(O)CCOCC1 HR148162 [0,1,0,1,0,0|1,0,1]=4 1256 B8R1.72 C[Si]1(C)CCCCO1 HR105989 [0,1,0,1,0,0|1,1,0]=4 1257 B8R1.72 O=S1(=O)CCCCN1 HR32664 [0,1,0,1,0,0|1,0,1]=4 1258 B8R1.72 O=S1(=O)CCNCC1 FISA07810 [0,1,0,1,0,0|1,0,1]=4 1259 B8R1.72 O=S1(=O)CCNCC1 HR10420 [0,1,0,1,0,0|1,0,1]=4 1260 B8R1.72 O=S1(=O)OCCCO1 HR134600 [0,1,0,1,0,0|2,0,0]=4 1261 B8R1.23 C=C1CC(C(=O)O)C1 HR113918 [0,1,0,1,0,0|0,0,1]=3 1262 B8R1.23 CC(=O)N1CC(O)C1 HR102223 [0,1,0,1,0,0|2,0,0]=4 1263 B8R1.23 CC1CC(C(=O)O)C1 HR111453 [0,1,0,1,0,0|0,0,0]=2 1264 B8R1.23 CN1CC(C(=O)O)C1 HR148501 [0,1,0,1,0,0|1,0,0]=3 1265 B8R1.23 NC1CC(C(=O)O)C1 HR109482 [0,1,0,1,0,0|0,0,0]=2 1266 B8R1.23 NC1CC(C(=O)O)C1 HR146903 [0,1,0,1,0,0|0,0,0]=2 1267 B8R1.23 O=C(O)C1CC(F)C1 HR107590 [0,1,0,1,0,0|0,0,0]=2 1268 B8R1.23 O=C(O)C1CC(O)C1 HR139037 [0,1,0,1,0,0|0,0,0]=2 1269 B8R1.23 O=C(O)C1CC(O)C1 HR148529 [0,1,0,1,0,0|0,0,0]=2 1270 B8R1.23 O=C1CC(C(=O)O)C1 HR14220 [0,1,0,1,0,0|0,0,1]=3 1271 B8R1.54 NC(C(=O)O)C1CC1 HR125656 [0,1,0,1,0,0|0,0,0]=2 1272 B8R1.54 NC(C(=O)O)C1CC1 HR126714 [0,1,0,1,0,0|0,0,0]=2 1273 B8R1.78 CC1(C(=O)O)CCC1 HR114206 [0,1,0,1,0,0|0,0,0]=2 1274 B8R1.78 CC1(C(=O)O)COC1 HR120334 [0,1,0,1,0,0|1,0,0]=3 1275 B8R1.78 NC1(C(=O)O)CCC1 HR117609 [0,1,0,1,0,0|0,0,0]=2 1276 B8R1.78 NC1(C(=O)O)CCC1 HR127410 [0,1,0,1,0,0|0,0,0]=2 1277 B8R1.78 NC1(C(=O)O)CNC1 HR115538 [0,1,0,1,0,0|1,0,0]=3 1278 B8R1.78 NC1(C(=O)O)COC1 HR113214 [0,1,0,1,0,0|1,0,0]=3 1279 B8R1.78 NC1(C(=O)O)CSC1 HR112269 [0,1,0,1,0,0|1,0,0]=3 1280 B8R1.77 CC1(C)CC1C(=O)O HR125256 [0,1,0,1,0,0|0,0,0]=2 1281 B8R1.77 CC1(C)CC1C(=O)O HR138282 [0,1,0,1,0,0|0,0,0]=2 1282 B8R1.77 CC1(C)CC1C(N)=O HR124986 [0,1,0,1,0,0|1,0,0]=3 1283 B8R1.77 O=C(O)C1CC1(F)F HR110979 [0,1,0,1,0,0|1,0,0]=3 1284 B8R1.21 CC1OC1P(=O)(O)O HR131849 [0,1,0,1,0,0|2,0,0]=4 1285 B8R1.21 CC1OC1P(=O)(O)O HR137952 [0,1,0,1,0,0|2,0,0]=4 1286 B8R1.21 CC1OC1P(=O)([O-])O HR131582 [0,1,0,1,0,0|2,0,0]=4 1287 B8R2.18 OC1CC2CC2C1 HR145840 [0,0,0,2,0,0|1,0,1]=4