0 B7R0.7 C=C(OCC)OCC IVSA07713 [0,0,0,0,0,0|3,0,0]=3 1 B7R0.7 C=C=CC(=O)OCC HR108306 [0,0,0,0,0,0|1,0,3]=4 2 B7R0.7 CC#CC(=O)OCC HR127977 [0,0,0,0,0,0|1,0,2]=3 3 B7R0.7 CC(CCO)CCO HR143828 [0,0,0,0,0,0|3,0,1]=4 4 B7R0.7 CCCC(=O)OCCl HR123267 [0,0,0,0,0,0|2,0,0]=2 5 B7R0.7 CCCC(=S)OCC HR130469 [0,0,0,0,0,0|1,1,0]=2 6 B7R0.7 CCCC(=S)OCC HR143387 [0,0,0,0,0,0|1,1,0]=2 7 B7R0.7 CCCC(Br)CCC HR101804 [0,0,0,0,0,0|1,0,1]=2 8 B7R0.7 CCCC(C)CCO HR101631 [0,0,0,0,0,0|2,0,1]=3 9 B7R0.7 CCCC(N)CCC HR105135 [0,0,0,0,0,0|1,0,1]=2 10 B7R0.7 CCCC(S)CCO HR131891 [0,0,0,0,0,0|1,1,1]=3 11 B7R0.7 CCNC(=O)NCC HR128759 [0,0,0,0,0,0|2,0,0]=2 12 B7R0.7 CCNC(=S)NCC HR122808 [0,0,0,0,0,0|2,1,0]=3 13 B7R0.7 CCOC(=O)CCBr HR132284 [0,0,0,0,0,0|2,0,0]=2 14 B7R0.7 CCOC(=O)CCCl HR147079 [0,0,0,0,0,0|2,0,0]=2 15 B7R0.7 CCOC(=O)CCI HR101944 [0,0,0,0,0,0|2,0,0]=2 16 B7R0.7 CCOC(=O)CCN HR129110 [0,0,0,0,0,0|2,0,0]=2 17 B7R0.7 CCOC(=O)CCS HR135162 [0,0,0,0,0,0|2,0,0]=2 18 B7R0.7 CCOC(=O)CNC HR138266 [0,0,0,0,0,0|2,0,0]=2 19 B7R0.7 CCOC(=O)CNN HR128003 [0,0,0,0,0,0|3,0,0]=3 20 B7R0.7 CCOC(=O)COC HR123443 [0,0,0,0,0,0|2,0,0]=2 21 B7R0.7 CCOC(=O)N=C=S FISA07802 [0,0,0,0,0,0|3,0,1]=4 22 B7R0.7 CCOC(=O)OCCl HR138904 [0,0,0,0,0,0|3,0,0]=3 23 B7R0.7 CCOC(=O)\C=C\I HR11670 [0,0,0,0,0,0|2,0,2]=4 24 B7R0.7 CCOC(C)OCC HR147572 [0,0,0,0,0,0|3,0,1]=4 25 B7R0.7 CCOC([SiH3])OCC HR133297 [0,0,0,0,0,0|3,0,1]=4 26 B7R0.7 CCOP(C)OCC HR102784 [0,0,0,0,0,0|4,0,0]=4 27 B7R0.7 CCOP(Cl)OCC HR111572 [0,0,0,0,0,0|4,0,0]=4 28 B7R0.7 CCOS(=O)OCC HR101466 [0,0,0,0,0,0|3,0,0]=3 29 B7R0.7 CCO[PH](=O)OCC HR109664 [0,0,0,0,0,0|3,0,0]=3 30 B7R0.7 CN(CCCl)CCCl HR125090 [0,0,0,0,0,0|4,0,0]=4 31 B7R0.7 CN(CCO)CCO HR128660 [0,0,0,0,0,0|4,0,0]=4 32 B7R0.7 COCC(N)COC HR110454 [0,0,0,0,0,0|3,0,1]=4 33 B7R0.7 COCC(O)COC HR132165 [0,0,0,0,0,0|2,0,2]=4 34 B7R0.7 O=C(CCCl)CCCl HR2482 [0,0,0,0,0,0|2,0,0]=2 35 B7R0.7 O=C(NCO)NCO HR129137 [0,0,0,0,0,0|4,0,0]=4 36 B7R0.7 [C-]#[N+]CC(=O)OCC HR146955 [0,0,0,0,0,0|2,0,1]=3 37 B6R0.1 C#CC(=O)NCC HR116239 [1,0,0,0,0,0|1,0,2]=4 38 B6R0.1 C#CC(=O)OCC HR132600 [1,0,0,0,0,0|1,0,2]=4 39 B6R0.1 C=CC(=O)CCC HR100488 [1,0,0,0,0,0|0,0,2]=3 40 B6R0.1 C=COC(=O)CC HR145643 [1,0,0,0,0,0|1,0,2]=4 41 B6R0.1 CC#CC(=O)OC HR141249 [1,0,0,0,0,0|1,0,2]=4 42 B6R0.1 CCC(=O)CC#N HR104780 [1,0,0,0,0,0|1,0,1]=3 43 B6R0.1 CCC(=O)CSC HR123442 [1,0,0,0,0,0|1,0,0]=2 44 B6R0.1 CCC(C)CCO HR120273 [1,0,0,0,0,0|2,0,1]=4 45 B6R0.1 CCCC(=O)NN HR113429 [1,0,0,0,0,0|2,0,0]=3 46 B6R0.1 CCCC(=O)SC HR136352 [1,0,0,0,0,0|1,0,0]=2 47 B6R0.1 CCCC(=S)OC HR122832 [1,0,0,0,0,0|1,1,0]=3 48 B6R0.1 CCCC(Br)CBr HR132339 [1,0,0,0,0,0|2,0,1]=4 49 B6R0.1 CCCC(Br)CC HR118696 [1,0,0,0,0,0|1,0,1]=3 50 B6R0.1 CCCC(N)CO HR112281 [1,0,0,0,0,0|2,0,1]=4 51 B6R0.1 CCCC(O)CO HR126914 [1,0,0,0,0,0|1,0,2]=4 52 B6R0.1 CCOC(=N)CCl HR112327 [1,0,0,0,0,0|3,0,0]=4 53 B6R0.1 CCOC(=O)C=O HR130872 [1,0,0,0,0,0|2,0,1]=4 54 B6R0.1 CCOC(=O)CBr AMJB00601 [1,0,0,0,0,0|2,0,0]=3 55 B6R0.1 CCOC(=O)CCl HR147617 [1,0,0,0,0,0|2,0,0]=3 56 B6R0.1 CCOC(=O)CN HR134743 [1,0,0,0,0,0|2,0,0]=3 57 B6R0.1 CCOC(=O)CO HR127384 [1,0,0,0,0,0|2,0,0]=3 58 B6R0.1 CCOC(=O)CS HR136673 [1,0,0,0,0,0|2,0,0]=3 59 B6R0.1 CCOC(=O)NN HR102667 [1,0,0,0,0,0|3,0,0]=4 60 B6R0.1 CCOC(=O)NN HR138962 [1,0,0,0,0,0|3,0,0]=4 61 B6R0.1 CCOC(=O)OC HR138173 [1,0,0,0,0,0|2,0,0]=3 62 B6R0.1 CCSC(=O)CC HR138214 [1,0,0,0,0,0|1,0,0]=2 63 B6R0.1 CNC(=O)CC#N HR121877 [1,0,0,0,0,0|2,0,1]=4 64 B6R0.1 CNCC(=O)OC HR130436 [1,0,0,0,0,0|2,0,0]=3 65 B6R0.1 COC(=O)CC#N OLSA05202 [1,0,0,0,0,0|2,0,1]=4 66 B6R0.1 COC(=O)CCBr HR133552 [1,0,0,0,0,0|2,0,0]=3 67 B6R0.1 COC(=O)CCN HR135038 [1,0,0,0,0,0|2,0,0]=3 68 B6R0.1 COC(=O)CCS HR133169 [1,0,0,0,0,0|2,0,0]=3 69 B6R0.1 COCC(=O)OC HR147666 [1,0,0,0,0,0|2,0,0]=3 70 B6R0.1 C\C=C\C(=O)CC HR108073 [1,0,0,0,0,0|0,0,2]=3 71 B6R0.1 O=C(CCl)NCO HR124394 [1,0,0,0,0,0|3,0,0]=4 72 B6R0.1 [C-]#[N+]CC(=O)OC HR110956 [1,0,0,0,0,0|2,0,1]=4 73 B6R0.6 BrCCCCCBr BEJL02301 [1,0,0,0,0,0|2,0,1]=4 74 B6R0.6 BrCCNCCBr HR147578 [1,0,0,0,0,0|3,0,0]=4 75 B6R0.6 BrCCOCCBr HR134391 [1,0,0,0,0,0|3,0,0]=4 76 B6R0.6 C=CCSCCC HR130566 [1,0,0,0,0,0|1,0,2]=4 77 B6R0.6 CCCC#CCO HR100925 [1,0,0,0,0,0|1,0,2]=4 78 B6R0.6 CCCCCCI HR101787 [1,0,0,0,0,0|1,0,1]=3 79 B6R0.6 CCCCCCO HR108609 [1,0,0,0,0,0|1,0,1]=3 80 B6R0.6 CCCCCCO HR127298 [1,0,0,0,0,0|1,0,1]=3 81 B6R0.6 CCCCCC[SiH3] HR107072 [1,0,0,0,0,0|0,1,1]=3 82 B6R0.6 CCCCCNC HR128731 [1,0,0,0,0,0|1,0,1]=3 83 B6R0.6 CCCCC[Mg]Br HR116206 [1,0,0,0,0,0|2,0,1]=4 84 B6R0.6 CCCCC[Mg]Cl HR115571 [1,0,0,0,0,0|2,0,1]=4 85 B6R0.6 CCCCNCC HR125662 [1,0,0,0,0,0|1,0,1]=3 86 B6R0.6 CCCCOCCl HR132357 [1,0,0,0,0,0|2,0,1]=4 87 B6R0.6 CCCC[Mg]CC HR115887 [1,0,0,0,0,0|1,0,1]=3 88 B6R0.6 CCCOCCCl HR126380 [1,0,0,0,0,0|2,0,0]=3 89 B6R0.6 CCCOCCO HR123698 [1,0,0,0,0,0|2,0,0]=3 90 B6R0.6 CCCSSCC HR130845 [1,0,0,0,0,0|2,0,0]=3 91 B6R0.6 CCCSSSC HR130630 [1,0,0,0,0,0|3,0,0]=4 92 B6R0.6 CCC\C=C\C=O HR127670 [1,0,0,0,0,0|1,0,2]=4 93 B6R0.6 CCC\C=C\CO HR127397 [1,0,0,0,0,0|1,0,1]=3 94 B6R0.6 CCNCCCN HR100502 [1,0,0,0,0,0|2,0,1]=4 95 B6R0.6 CCOCCCCl HR124824 [1,0,0,0,0,0|2,0,1]=4 96 B6R0.6 CCOCCCN HR100101 [1,0,0,0,0,0|2,0,1]=4 97 B6R0.6 CCOCCCO HR128209 [1,0,0,0,0,0|2,0,1]=4 98 B6R0.6 CCOCOCC HR147607 [1,0,0,0,0,0|2,0,1]=4 99 B6R0.6 CCO[Mg]OCC HR128992 [1,0,0,0,0,0|3,0,0]=4 100 B6R0.6 CCO[SiH2]OCC HR117502 [1,0,0,0,0,0|2,1,0]=4 101 B6R0.6 CC\C=C\CCO HR100849 [1,0,0,0,0,0|1,0,1]=3 102 B6R0.6 CC\C=C\CCO HR130305 [1,0,0,0,0,0|1,0,1]=3 103 B6R0.6 CNCCCNC HR133916 [1,0,0,0,0,0|2,0,1]=4 104 B6R0.6 COCCCCBr HR131929 [1,0,0,0,0,0|2,0,1]=4 105 B6R0.6 COCCCCCl HR130420 [1,0,0,0,0,0|2,0,1]=4 106 B6R0.6 COCCCCN HR141637 [1,0,0,0,0,0|2,0,1]=4 107 B6R0.6 COCCCCO HR129257 [1,0,0,0,0,0|2,0,1]=4 108 B6R0.6 COCCCOC HR127938 [1,0,0,0,0,0|2,0,1]=4 109 B6R0.6 C\C=C\CCCC HR145495 [1,0,0,0,0,0|0,0,3]=4 110 B6R0.6 ClCCCCCBr HR125269 [1,0,0,0,0,0|2,0,1]=4 111 B6R0.6 ClCCNCCCl HR127646 [1,0,0,0,0,0|3,0,0]=4 112 B6R0.6 FCCCCCBr HR120213 [1,0,0,0,0,0|2,0,1]=4 113 B6R0.6 NCCCCCN HR146969 [1,0,0,0,0,0|2,0,1]=4 114 B6R0.6 NCCCCCO HR139094 [1,0,0,0,0,0|2,0,1]=4 115 B6R0.6 NCCNCCO HR129715 [1,0,0,0,0,0|3,0,0]=4 116 B6R0.6 NCCOCCN HR105600 [1,0,0,0,0,0|3,0,0]=4 117 B6R0.6 NCCSCCO HR131001 [1,0,0,0,0,0|3,0,0]=4 118 B6R0.6 OCCCCCBr HR102868 [1,0,0,0,0,0|2,0,1]=4 119 B6R0.6 OCCCCCCl HR134047 [1,0,0,0,0,0|2,0,1]=4 120 B6R0.6 OCCCCCO HR136505 [1,0,0,0,0,0|2,0,1]=4 121 B6R0.6 OCCOCCCl HR126550 [1,0,0,0,0,0|3,0,0]=4 122 B6R0.6 OCCOCCO HR128647 [1,0,0,0,0,0|3,0,0]=4 123 B6R0.6 OCCSCCO HR124597 [1,0,0,0,0,0|3,0,0]=4 124 B6R0.6 SCCCCCS HR128025 [1,0,0,0,0,0|2,0,1]=4 125 B6R0.6 SCCSCCS HR130413 [1,0,0,0,0,0|3,0,0]=4 126 B6R0.6 [Li]CCCCCC HR142102 [1,0,0,0,0,0|1,0,1]=3 127 B8R0.1 CCCC(=O)OCSC HR128277 [0,1,0,0,0,0|1,0,0]=2 128 B8R0.1 CCCCC(Br)CCC HR120549 [0,1,0,0,0,0|1,0,1]=3 129 B8R0.1 CCCOC(=O)CCS HR117505 [0,1,0,0,0,0|1,0,0]=2 130 B8R0.1 CCOC(=O)CCCBr HR133499 [0,1,0,0,0,0|1,0,0]=2 131 B8R0.1 CCOC(=O)CCCN HR142861 [0,1,0,0,0,0|1,0,0]=2 132 B8R0.1 CCOC(=O)CCC[Zn+] HR140860 [0,1,0,0,0,0|1,0,0]=2 133 B8R0.1 CCOC(=O)CN=C=O DASA02404 [0,1,0,0,0,0|2,0,1]=4 134 B8R0.1 CCOC(=O)CN=C=S HR127339 [0,1,0,0,0,0|2,0,1]=4 135 B8R0.1 CCOC(=O)CNC=O HR110895 [0,1,0,0,0,0|2,0,1]=4 136 B8R0.1 CCOC(=O)NCCCl HR139857 [0,1,0,0,0,0|2,0,0]=3 137 B8R0.1 CCOC(=O)\C=C\CBr HR131502 [0,1,0,0,0,0|1,0,2]=4 138 B8R0.1 CN(CCO)CCCN HR138901 [0,1,0,0,0,0|3,0,0]=4 139 B8R0.1 C\C=C\C(=O)CCCC HR108746 [0,1,0,0,0,0|0,0,2]=3 140 B8R0.1 C\C=C\CC(=O)OCC HR142218 [0,1,0,0,0,0|1,0,1]=3 141 B8R0.3 C=C(CBr)C(=O)OCC HR109438 [0,1,0,0,0,0|2,0,1]=4 142 B8R0.3 C=C(CCl)C(=O)OCC HR112979 [0,1,0,0,0,0|2,0,1]=4 143 B8R0.3 C=C(CO)C(=O)OCC HR110396 [0,1,0,0,0,0|2,0,1]=4 144 B8R0.3 CCOC(=O)C(=O)CBr NSJB02101 [0,1,0,0,0,0|2,0,1]=4 145 B8R0.3 CCOC(=O)C(=O)CC HR105760 [0,1,0,0,0,0|1,0,1]=3 146 B8R0.3 CCOC(=O)C(Br)CBr HR129498 [0,1,0,0,0,0|2,0,0]=3 147 B8R0.3 CCOC(=O)C(Br)CC HR135114 [0,1,0,0,0,0|1,0,0]=2 148 B8R0.3 CCOC(=O)C(C)C#N HR121152 [0,1,0,0,0,0|2,0,1]=4 149 B8R0.3 CCOC(=O)C(C)C=O HR112338 [0,1,0,0,0,0|2,0,1]=4 150 B8R0.3 CCOC(=O)C(C)CC HR129683 [0,1,0,0,0,0|1,0,0]=2 151 B8R0.3 CCOC(=O)C(C)CC HR138244 [0,1,0,0,0,0|1,0,0]=2 152 B8R0.3 CCOC(=O)C(C)CN HR117532 [0,1,0,0,0,0|2,0,0]=3 153 B8R0.3 CCOC(=O)C(Cl)CCl HR119653 [0,1,0,0,0,0|2,0,0]=3 154 B8R0.3 CCOC(=O)C(N)CC HR103721 [0,1,0,0,0,0|1,0,0]=2 155 B8R0.3 CCOC(=O)C(N)CO HR127361 [0,1,0,0,0,0|2,0,0]=3 156 B8R0.3 CCOC(=O)C(N)CO HR142606 [0,1,0,0,0,0|2,0,0]=3 157 B8R0.3 CCOC(=O)C(N)CS HR136050 [0,1,0,0,0,0|2,0,0]=3 158 B8R0.3 CCOC(=O)C(S)CC HR118467 [0,1,0,0,0,0|1,0,0]=2 159 B8R0.3 C\C=C(\C)C(=O)OCC HR128479 [0,1,0,0,0,0|1,0,2]=4 160 B8R0.3 C\C=C\C(=O)C(C)CC HR137024 [0,1,0,0,0,0|0,0,2]=3 161 B8R0.5 CC(C)OC(=O)CC#N HR136578 [0,1,0,0,0,0|2,0,1]=4 162 B8R0.5 CC(C)OC(=O)CCS HR117191 [0,1,0,0,0,0|2,0,0]=3 163 B8R0.5 CC(C)OC(=O)OCCl HR138445 [0,1,0,0,0,0|3,0,0]=4 164 B8R0.5 CCNC(=S)OC(C)C HR109488 [0,1,0,0,0,0|2,1,0]=4 165 B8R0.5 CCOC(=O)C=C(C)C HR123584 [0,1,0,0,0,0|1,0,2]=4 166 B8R0.5 CCOC(=O)CC(=N)N HR111201 [0,1,0,0,0,0|2,0,1]=4 167 B8R0.5 CCOC(=O)CC(=O)Cl HR105395 [0,1,0,0,0,0|2,0,1]=4 168 B8R0.5 CCOC(=O)CC(=O)O HR125762 [0,1,0,0,0,0|2,0,1]=4 169 B8R0.5 CCOC(=O)CC(C)=O BRSA08315 [0,1,0,0,0,0|1,0,1]=3 170 B8R0.5 CCOC(=O)CC(C)=O HR134952 [0,1,0,0,0,0|1,0,1]=3 171 B8R0.5 CCOC(=O)CC(C)O HR103958 [0,1,0,0,0,0|1,0,0]=2 172 B8R0.5 CCOC(=O)CC(C)O HR115663 [0,1,0,0,0,0|1,0,0]=2 173 B8R0.5 CCOC(=O)CC(C)O HR126277 [0,1,0,0,0,0|1,0,0]=2 174 B8R0.5 CCOC(=O)CC(C)S HR114517 [0,1,0,0,0,0|1,0,0]=2 175 B8R0.5 CCOC(=O)CC(N)=O HR32504 [0,1,0,0,0,0|2,0,1]=4 176 B8R0.5 CCOC(=O)CC(N)=S HR111280 [0,1,0,0,0,0|2,0,1]=4 177 B8R0.5 CCOC(=O)CN(C)C HR135000 [0,1,0,0,0,0|2,0,0]=3 178 B8R0.5 CCOC(=O)C[N+](=O)[O-] HR125868 [0,1,0,0,0,0|3,0,0]=4 179 B8R0.5 CCOC(=O)OC(C)Cl HR127687 [0,1,0,0,0,0|2,0,0]=3 180 B8R0.5 CCOC(=O)OC(C)I HR138111 [0,1,0,0,0,0|2,0,0]=3 181 B8R0.5 CCOC(=O)\C=C(/C)N HR137824 [0,1,0,0,0,0|1,0,2]=4 182 B8R0.5 CCOC(=O)\C=C(\C)N HR122434 [0,1,0,0,0,0|1,0,2]=4 183 B8R0.5 COCC(=O)CC(C)=O HR134533 [0,1,0,0,0,0|1,0,1]=3 184 B8R0.22 CCCC(CCO)SC HR134221 [0,1,0,0,0,0|1,1,1]=4 185 B8R0.30 CCCC(C)(O)CCC HR118655 [0,1,0,0,0,0|0,0,2]=3 186 B8R0.30 CCOP(C)(=O)OCC HR143627 [0,1,0,0,0,0|3,0,0]=4 187 B8R0.30 NCCS(=O)(=O)CCCl HR130350 [0,1,0,0,0,0|3,0,0]=4 188 B8R0.30 NCCS(=O)(=O)CCO HR123842 [0,1,0,0,0,0|3,0,0]=4 189 B8R0.30 O=S(=O)(CCO)CCO HR130678 [0,1,0,0,0,0|3,0,0]=4 190 B8R1.4 CC1=CC(=O)CCC1 HR142178 [0,0,0,1,0,0|0,0,2]=3 191 B8R1.4 CC1CC(=O)CCN1 HR120677 [0,0,0,1,0,0|1,0,0]=2 192 B8R1.4 CC1CC(=O)CCN1 HR140081 [0,0,0,1,0,0|1,0,0]=2 193 B8R1.4 CC1CC(O)CCO1 HR120725 [0,0,0,1,0,0|1,0,2]=4 194 B8R1.4 CC1CC(O)CCO1 HR121039 [0,0,0,1,0,0|1,0,2]=4 195 B8R1.4 CC1CCCC(=O)C1 HR143817 [0,0,0,1,0,0|0,0,0]=1 196 B8R1.4 CC1CCCC(C)C1 HR101015 [0,0,0,1,0,0|1,0,1]=3 197 B8R1.4 CC1CCCC(C)N1 HR120277 [0,0,0,1,0,0|2,0,1]=4 198 B8R1.4 CC1CCCC(C)N1 HR140810 [0,0,0,1,0,0|2,0,1]=4 199 B8R1.4 CC1CCCC(N)C1 HR115864 [0,0,0,1,0,0|1,0,1]=3 200 B8R1.4 CC1CCNC(C)C1 HR147221 [0,0,0,1,0,0|2,0,1]=4 201 B8R1.4 CC1CNCC(C)C1 HR135144 [0,0,0,1,0,0|2,0,1]=4 202 B8R1.4 CN1CCC=C(Br)C1 HR149222 [0,0,0,1,0,0|2,0,1]=4 203 B8R1.4 CN1CCCC(=O)C1 HR120165 [0,0,0,1,0,0|1,0,0]=2 204 B8R1.4 CN1CCCC(N)C1 HR114038 [0,0,0,1,0,0|2,0,1]=4 205 B8R1.4 CN1CCCC(N)C1 HR119195 [0,0,0,1,0,0|2,0,1]=4 206 B8R1.4 CN1CCCC(N)C1 HR146131 [0,0,0,1,0,0|2,0,1]=4 207 B8R1.4 CN1CCCC(O)C1 HR119067 [0,0,0,1,0,0|1,0,2]=4 208 B8R1.4 CN1CCNC(=O)C1 HR119613 [0,0,0,1,0,0|2,0,0]=3 209 B8R1.4 NC1=CC(=O)CCC1 HR114131 [0,0,0,1,0,0|1,0,2]=4 210 B8R1.4 NC1CCCC(N)C1 HR146008 [0,0,0,1,0,0|2,0,1]=4 211 B8R1.4 NC1CCCC(O)C1 HR12673 [0,0,0,1,0,0|1,0,2]=4 212 B8R1.4 NC1CCNC(=O)C1 HR107374 [0,0,0,1,0,0|2,0,0]=3 213 B8R1.4 NC1CCNC(=O)C1 HR113606 [0,0,0,1,0,0|2,0,0]=3 214 B8R1.4 NN1CCCC(F)C1 HR149279 [0,0,0,1,0,0|3,0,0]=4 215 B8R1.4 O=C1CC(O)CCN1 HR110819 [0,0,0,1,0,0|2,0,0]=3 216 B8R1.4 O=C1CCCC(=O)C1 HR129932 [0,0,0,1,0,0|1,0,1]=3 217 B8R1.4 O=C1CCCC(=O)N1 HR139848 [0,0,0,1,0,0|2,0,1]=4 218 B8R1.4 O=C1CCCC(=O)O1 ZOCQ02609 [0,0,0,1,0,0|2,0,1]=4 219 B8R1.4 O=C1CCNC(=O)C1 HR127778 [0,0,0,1,0,0|2,0,1]=4 220 B8R1.4 O=C1COCC(=O)C1 HR103955 [0,0,0,1,0,0|2,0,1]=4 221 B8R1.4 OC1CCCC(O)C1 HR133806 [0,0,0,1,0,0|1,0,2]=4 222 B8R1.8 BrCCN1CCCC1 HR120871 [0,0,0,1,0,0|3,0,0]=4 223 B8R1.8 COCC1CCCN1 HR112924 [0,0,0,1,0,0|2,0,1]=4 224 B8R1.8 COCC1CCCN1 HR118289 [0,0,0,1,0,0|2,0,1]=4 225 B8R1.8 ClCCN1CCCC1 HR132966 [0,0,0,1,0,0|3,0,0]=4 226 B8R1.8 ClCCN1CCCC1 HR144838 [0,0,0,1,0,0|3,0,0]=4 227 B8R1.8 NCCC1CCCC1 HR111513 [0,0,0,1,0,0|2,0,1]=4 228 B8R1.8 NCCC1CCCC1 HR146891 [0,0,0,1,0,0|2,0,1]=4 229 B8R1.8 NCCN1CCCC1 CEJL01604 [0,0,0,1,0,0|3,0,0]=4 230 B8R1.8 OCCC1CCCC1 HR111073 [0,0,0,1,0,0|2,0,1]=4 231 B8R1.8 OCCC1CCCN1 HR100505 [0,0,0,1,0,0|2,0,1]=4 232 B8R1.8 OCCN1CCCC1 HR132675 [0,0,0,1,0,0|3,0,0]=4 233 B8R1.11 C=CN1CCCC1=O HR130278 [0,0,0,1,0,0|1,0,2]=4 234 B8R1.11 C=CN1CCCC1=O HR131788 [0,0,0,1,0,0|1,0,2]=4 235 B8R1.11 CCN1CCCC1=O HR134739 [0,0,0,1,0,0|1,0,0]=2 236 B8R1.11 CN1CCCC1CO HR103689 [0,0,0,1,0,0|3,0,0]=4 237 B8R1.11 CN1CCCC1CO HR123222 [0,0,0,1,0,0|3,0,0]=4 238 B8R1.11 CN1CCCC1CO HR137677 [0,0,0,1,0,0|3,0,0]=4 239 B8R1.11 N#CC1CCCC1=O HR126764 [0,0,0,1,0,0|1,0,1]=3 240 B8R1.11 N#CC1CSCC1=O HR107418 [0,0,0,1,0,0|2,0,1]=4 241 B8R1.11 NC1CCCC1CO HR120947 [0,0,0,1,0,0|2,0,1]=4 242 B8R1.11 NCC1CCCC1N HR142288 [0,0,0,1,0,0|2,0,1]=4 243 B8R1.22 BrC1CCCCCC1 HR128104 [0,0,0,1,0,0|1,0,1]=3 244 B8R1.22 CN1CCCNCC1 HR123758 [0,0,0,1,0,0|3,0,0]=4 245 B8R1.22 NC1CCCCNC1 HR141733 [0,0,0,1,0,0|2,0,1]=4 246 B8R1.22 NC1CCCCNC1 HR146551 [0,0,0,1,0,0|2,0,1]=4 247 B8R1.22 NC1CCCOCC1 HR105429 [0,0,0,1,0,0|2,0,1]=4 248 B8R1.22 O=C1C=CCCCC1 HR146270 [0,0,0,1,0,0|0,0,2]=3 249 B8R1.22 O=C1CCCCCN1 HR129512 [0,0,0,1,0,0|1,0,0]=2 250 B8R1.22 O=C1CCCCCO1 HR107144 [0,0,0,1,0,0|1,0,0]=2 251 B8R1.22 O=C1CCCCCO1 HR120205 [0,0,0,1,0,0|1,0,0]=2 252 B8R1.22 O=C1CCCNCC1 HR107777 [0,0,0,1,0,0|1,0,0]=2 253 B8R1.22 O=C1CCCNCC1 HR136701 [0,0,0,1,0,0|1,0,0]=2 254 B8R1.22 O=C1CCNCCN1 HR101958 [0,0,0,1,0,0|2,0,0]=3 255 B8R1.22 O=C1CCNCCN1 HR113359 [0,0,0,1,0,0|2,0,0]=3 256 B8R1.22 OC1CCCCCC1 HR122711 [0,0,0,1,0,0|0,0,2]=3 257 B8R1.22 OC1CCCNCC1 HR110756 [0,0,0,1,0,0|1,0,2]=4 258 B8R1.37 CCCC(=O)C1CC1 HR116824 [0,0,0,1,0,0|0,0,0]=1 259 B8R1.37 CCOC(=O)C1CC1 HR132331 [0,0,0,1,0,0|1,0,0]=2 260 B8R1.37 CCOC(=O)C1CO1 HR117347 [0,0,0,1,0,0|2,0,0]=3 261 B8R1.37 CCOC(=O)C1CO1 HR119319 [0,0,0,1,0,0|2,0,0]=3 262 B8R1.37 C\C=C\C(=O)C1CC1 HR116501 [0,0,0,1,0,0|0,0,2]=3 263 B8R1.37 N#CCC(=O)C1CC1 HR108058 [0,0,0,1,0,0|1,0,1]=3 264 B5R0.1 C=C(C)CCO HR139358 [2,0,0,0,0,0|2,0,0]=4 265 B5R0.1 C=C(C)OCC HR135003 [2,0,0,0,0,0|2,0,0]=4 266 B5R0.1 CC(=O)CCCl HR106274 [2,0,0,0,0,0|1,0,0]=3 267 B5R0.1 CC(=O)CCO HR131203 [2,0,0,0,0,0|1,0,0]=3 268 B5R0.1 CC(=O)NCO HR105862 [2,0,0,0,0,0|2,0,0]=4 269 B5R0.1 CC(=O)OCBr HR127457 [2,0,0,0,0,0|2,0,0]=4 270 B5R0.1 CC(=O)OCCl HR101207 [2,0,0,0,0,0|2,0,0]=4 271 B5R0.1 CCCC(=N)N HR126811 [2,0,0,0,0,0|2,0,0]=4 272 B5R0.1 CCCC(=O)Cl HR147587 [2,0,0,0,0,0|1,0,0]=3 273 B5R0.1 CCCC(=O)[O-] HR129884 [2,0,0,0,0,0|1,0,0]=3 274 B5R0.1 CCCC(=O)[O-] HR137474 [2,0,0,0,0,0|1,0,0]=3 275 B5R0.1 CCCC(C)Cl HR139357 [2,0,0,0,0,0|1,0,1]=4 276 B5R0.1 CCCC(C)N HR107397 [2,0,0,0,0,0|1,0,1]=4 277 B5R0.1 CCCC(C)O HR136841 [2,0,0,0,0,0|0,0,2]=4 278 B5R0.1 CCCC(C)O HR137349 [2,0,0,0,0,0|0,0,2]=4 279 B5R0.1 CCCC(C)S HR128554 [2,0,0,0,0,0|0,1,1]=4 280 B5R0.1 CCCC(N)=O HR137715 [2,0,0,0,0,0|1,0,0]=3 281 B5R0.1 CCNC(C)=O HR100775 [2,0,0,0,0,0|1,0,0]=3 282 B5R0.1 CCNC(N)=O HR126748 [2,0,0,0,0,0|2,0,0]=4 283 B5R0.1 CCOC(=O)Cl IVSA07702 [2,0,0,0,0,0|2,0,0]=4 284 B5R0.1 CCOC(C)=N HR126641 [2,0,0,0,0,0|2,0,0]=4 285 B5R0.1 CCOC(N)=O HR123919 [2,0,0,0,0,0|2,0,0]=4 286 B5R0.1 CCSC(C)=O HR138399 [2,0,0,0,0,0|1,0,0]=3 287 B5R0.1 CCSC(C)=S HR129552 [2,0,0,0,0,0|1,1,0]=4 288 B5R0.1 CNCC(=O)O HR132326 [2,0,0,0,0,0|2,0,0]=4 289 B5R0.1 CNCC(=O)[O-] HR133335 [2,0,0,0,0,0|2,0,0]=4 290 B5R0.1 COCC(=O)Cl HR138385 [2,0,0,0,0,0|2,0,0]=4 291 B5R0.1 COCC(=O)O HR137614 [2,0,0,0,0,0|2,0,0]=4 292 B5R0.1 COCC(C)=O HR124731 [2,0,0,0,0,0|1,0,0]=3 293 B5R0.1 CSCC(C)=O HR104929 [2,0,0,0,0,0|1,0,0]=3 294 B5R0.1 CSCC(N)=O HR105921 [2,0,0,0,0,0|2,0,0]=4 295 B5R0.1 NC(=O)CCO HR101159 [2,0,0,0,0,0|2,0,0]=4 296 B5R0.1 NCCC(=O)O HR120135 [2,0,0,0,0,0|2,0,0]=4 297 B5R0.1 NCCC(=O)O HR136538 [2,0,0,0,0,0|2,0,0]=4 298 B5R0.1 NCCC(N)=O HR123050 [2,0,0,0,0,0|2,0,0]=4 299 B5R0.1 O=C(Cl)CCBr HR132550 [2,0,0,0,0,0|2,0,0]=4 300 B5R0.1 O=C(Cl)CCCl HR125686 [2,0,0,0,0,0|2,0,0]=4 301 B5R0.1 O=C(O)CCBr HR146768 [2,0,0,0,0,0|2,0,0]=4 302 B5R0.1 O=C(O)CCI HR118002 [2,0,0,0,0,0|2,0,0]=4 303 B5R0.1 O=C(O)CCO HR12598 [2,0,0,0,0,0|2,0,0]=4 304 B5R0.1 O=C(O)CCS BACQ02107 [2,0,0,0,0,0|2,0,0]=4 305 B5R0.2 BrCCCCBr HR135783 [2,0,0,0,0,0|2,0,0]=4 306 B5R0.2 CCCCSC HR128739 [2,0,0,0,0,0|1,0,0]=3 307 B5R0.2 CCCC[Mg]Cl HR114410 [2,0,0,0,0,0|2,0,0]=4 308 B5R0.2 CCCNCC HR129859 [2,0,0,0,0,0|1,0,0]=3 309 B5R0.2 CCCSCC HR131098 [2,0,0,0,0,0|1,0,0]=3 310 B5R0.2 CCCSSC HR127587 [2,0,0,0,0,0|2,0,0]=4 311 B5R0.2 CCNCCN HR124923 [2,0,0,0,0,0|2,0,0]=4 312 B5R0.2 CCNCCO HR131326 [2,0,0,0,0,0|2,0,0]=4 313 B5R0.2 CCOCCBr HR147270 [2,0,0,0,0,0|2,0,0]=4 314 B5R0.2 CCOCCCl HR125621 [2,0,0,0,0,0|2,0,0]=4 315 B5R0.2 CCOCCN HR133098 [2,0,0,0,0,0|2,0,0]=4 316 B5R0.2 CCOCCN HR141597 [2,0,0,0,0,0|2,0,0]=4 317 B5R0.2 CCSCCCl HR138028 [2,0,0,0,0,0|2,0,0]=4 318 B5R0.2 CCSSCC HR137639 [2,0,0,0,0,0|2,0,0]=4 319 B5R0.2 CC[Se][Se]CC HR102291 [2,0,0,0,0,0|2,0,0]=4 320 B5R0.2 CC\C=C\CBr HR102032 [2,0,0,0,0,0|1,0,1]=4 321 B5R0.2 CNCCCN HR127543 [2,0,0,0,0,0|2,0,0]=4 322 B5R0.2 CNCCNC HR134870 [2,0,0,0,0,0|2,0,0]=4 323 B5R0.2 COCCCBr HR11240 [2,0,0,0,0,0|2,0,0]=4 324 B5R0.2 COCCCCl HR128474 [2,0,0,0,0,0|2,0,0]=4 325 B5R0.2 COCCCN HR131273 [2,0,0,0,0,0|2,0,0]=4 326 B5R0.2 COCCCO HR1936 [2,0,0,0,0,0|2,0,0]=4 327 B5R0.2 COCCOC HR147135 [2,0,0,0,0,0|2,0,0]=4 328 B5R0.2 CSCCCCl HR118093 [2,0,0,0,0,0|2,0,0]=4 329 B5R0.2 C\C=C\CCC HR121014 [2,0,0,0,0,0|0,0,1]=3 330 B5R0.2 C\C=C\OCC HR128979 [2,0,0,0,0,0|1,0,1]=4 331 B5R0.2 ClCCCCBr AZXF00302 [2,0,0,0,0,0|2,0,0]=4 332 B5R0.2 ClCCCCI HR102777 [2,0,0,0,0,0|2,0,0]=4 333 B5R0.2 ICCCCI HR127157 [2,0,0,0,0,0|2,0,0]=4 334 B5R0.2 NCCCCBr HR148711 [2,0,0,0,0,0|2,0,0]=4 335 B5R0.2 NCCCCN HR123185 [2,0,0,0,0,0|2,0,0]=4 336 B5R0.2 NCCCCO HR105259 [2,0,0,0,0,0|2,0,0]=4 337 B5R0.2 OCCCCCl HR129662 [2,0,0,0,0,0|2,0,0]=4 338 B5R0.2 SCCCCS HR128290 [2,0,0,0,0,0|2,0,0]=4 339 B5R0.3 CCC(=O)CBr HR101618 [2,0,0,0,0,0|1,0,0]=3 340 B5R0.3 CCC(=O)NC HR138361 [2,0,0,0,0,0|1,0,0]=3 341 B5R0.3 CCC(=S)OC HR134757 [2,0,0,0,0,0|1,1,0]=4 342 B5R0.3 CCC(Br)CC HR126412 [2,0,0,0,0,0|1,0,1]=4 343 B5R0.3 CCC(N)CC HR124629 [2,0,0,0,0,0|1,0,1]=4 344 B5R0.3 CCC(O)CC HR127807 [2,0,0,0,0,0|0,0,2]=4 345 B5R0.3 CCC(S)CC HR120847 [2,0,0,0,0,0|0,1,1]=4 346 B5R0.3 CCN(C)CC HR114271 [2,0,0,0,0,0|2,0,0]=4 347 B5R0.3 CCN(O)CC HR136115 [2,0,0,0,0,0|1,0,1]=4 348 B5R0.3 CCS(=O)CC HR101279 [2,0,0,0,0,0|1,0,0]=3 349 B5R0.3 CC[AlH3](I)CC HR145180 [2,0,0,0,0,0|2,0,0]=4 350 B5R0.3 CNC(=O)CBr HR108109 [2,0,0,0,0,0|2,0,0]=4 351 B5R0.3 CNC(=O)NC HR124408 [2,0,0,0,0,0|2,0,0]=4 352 B5R0.3 COC(=O)CBr HR147010 [2,0,0,0,0,0|2,0,0]=4 353 B5R0.3 COC(=O)CCl HR147665 [2,0,0,0,0,0|2,0,0]=4 354 B5R0.3 COC(=O)CF HR147087 [2,0,0,0,0,0|2,0,0]=4 355 B5R0.3 COC(=O)CN VAJB00904 [2,0,0,0,0,0|2,0,0]=4 356 B5R0.3 COC(=O)CO HR136159 [2,0,0,0,0,0|2,0,0]=4 357 B5R0.3 COC(=O)CS HR136418 [2,0,0,0,0,0|2,0,0]=4 358 B5R0.3 O=C(CBr)CBr HR100914 [2,0,0,0,0,0|2,0,0]=4 359 B5R0.3 O=C(CCl)CCl HR147139 [2,0,0,0,0,0|2,0,0]=4 360 B5R0.3 O=C(CO)CO HR136414 [2,0,0,0,0,0|2,0,0]=4 361 B7R0.2 CC(C)NC(=O)CBr HR117083 [1,1,0,0,0,0|2,0,0]=4 362 B7R0.2 CC(C)OC(=O)CN HR105079 [1,1,0,0,0,0|2,0,0]=4 363 B7R0.2 CC(C)OC(=O)CN HR117760 [1,1,0,0,0,0|2,0,0]=4 364 B7R0.2 CC(C)OC(=O)CO HR105901 [1,1,0,0,0,0|2,0,0]=4 365 B7R0.2 CCC(=O)CC(C)=O HR133940 [1,1,0,0,0,0|0,0,1]=3 366 B7R0.2 CCC(C)CC(C)N HR121358 [1,1,0,0,0,0|1,0,1]=4 367 B7R0.2 CCC(C)CC(C)N HR123488 [1,1,0,0,0,0|1,0,1]=4 368 B7R0.2 CNC(=O)CC(C)=O HR100837 [1,1,0,0,0,0|1,0,1]=4 369 B7R0.2 COC(=O)CC(C)=O TECQ03701 [1,1,0,0,0,0|1,0,1]=4 370 B7R0.2 COC(=O)CC(C)N HR119861 [1,1,0,0,0,0|1,0,0]=3 371 B7R0.2 COC(=O)CC(C)N HR143484 [1,1,0,0,0,0|1,0,0]=3 372 B7R0.2 COC(=O)CC(C)O HR138815 [1,1,0,0,0,0|1,0,0]=3 373 B7R0.2 CSC(=O)CC(C)C HR122226 [1,1,0,0,0,0|1,0,0]=3 374 B7R0.3 C=CC(=O)OCCC HR144889 [1,1,0,0,0,0|0,0,2]=4 375 B7R0.3 CCC(C)CCCO HR119648 [1,1,0,0,0,0|1,0,1]=4 376 B7R0.3 CCCCC(=O)NN HR113250 [1,1,0,0,0,0|2,0,0]=4 377 B7R0.3 CCCCC(O)CC HR100535 [1,1,0,0,0,0|0,0,2]=4 378 B7R0.3 CCCOC(=O)CC HR127273 [1,1,0,0,0,0|0,0,0]=2 379 B7R0.3 COC(=O)CCC#N HR113384 [1,1,0,0,0,0|1,0,1]=4 380 B7R0.3 COC(=O)CCC=O HR116651 [1,1,0,0,0,0|1,0,1]=4 381 B7R0.3 COC(=O)CCCBr HR134912 [1,1,0,0,0,0|1,0,0]=3 382 B7R0.3 COC(=O)CCCCl HR131361 [1,1,0,0,0,0|1,0,0]=3 383 B7R0.3 COC(=O)CCCN HR105959 [1,1,0,0,0,0|1,0,0]=3 384 B7R0.3 COCCC(=O)OC HR130750 [1,1,0,0,0,0|1,0,0]=3 385 B7R0.3 C\C=C\CC(=O)OC HR127455 [1,1,0,0,0,0|1,0,1]=4 386 B7R0.5 CC(C)C(=O)OCCl HR116048 [1,1,0,0,0,0|2,0,0]=4 387 B7R0.5 CCCC(=O)C(=O)O HR138596 [1,1,0,0,0,0|1,0,1]=4 388 B7R0.5 CCCC(=O)C(C)=O HR139186 [1,1,0,0,0,0|0,0,1]=3 389 B7R0.5 CCCC(=O)C(C)C HR130078 [1,1,0,0,0,0|0,0,0]=2 390 B7R0.5 CCCC(O)C(C)C HR101888 [1,1,0,0,0,0|0,0,2]=4 391 B7R0.5 CCOC(=O)C(C)=O HR135005 [1,1,0,0,0,0|1,0,1]=4 392 B7R0.5 CCOC(=O)C(C)Br HR123330 [1,1,0,0,0,0|1,0,0]=3 393 B7R0.5 CCOC(=O)C(C)C BEJL02302 [1,1,0,0,0,0|1,0,0]=3 394 B7R0.5 CCOC(=O)C(C)F HR137458 [1,1,0,0,0,0|1,0,0]=3 395 B7R0.5 CCOC(=O)C(C)N HR113453 [1,1,0,0,0,0|1,0,0]=3 396 B7R0.5 CCOC(=O)C(C)N HR123317 [1,1,0,0,0,0|1,0,0]=3 397 B7R0.5 CCOC(=O)C(C)N HR129365 [1,1,0,0,0,0|1,0,0]=3 398 B7R0.5 CCOC(=O)C(C)O HR100136 [1,1,0,0,0,0|1,0,0]=3 399 B7R0.5 CCOC(=O)C(C)O HR15558 [1,1,0,0,0,0|1,0,0]=3 400 B7R0.5 CCOC(=O)C(C)S HR126591 [1,1,0,0,0,0|1,0,0]=3 401 B7R0.5 CCOC(=O)C(F)Br HR137876 [1,1,0,0,0,0|2,0,0]=4 402 B7R0.5 CCOC(=O)C(F)Cl HR115827 [1,1,0,0,0,0|2,0,0]=4 403 B7R0.5 CCOC(=O)C(F)F HR123633 [1,1,0,0,0,0|2,0,0]=4 404 B7R0.10 CCC(=O)C(=O)CC HR122518 [1,1,0,0,0,0|0,0,1]=3 405 B7R0.10 CCC(Br)C(=O)OC HR123363 [1,1,0,0,0,0|1,0,0]=3 406 B7R0.10 CCC(C)C(=O)OC HR133876 [1,1,0,0,0,0|1,0,0]=3 407 B7R0.10 CCC(C)C(=O)OC HR143721 [1,1,0,0,0,0|1,0,0]=3 408 B7R0.10 CCC(C)C(=O)SC HR105243 [1,1,0,0,0,0|1,0,0]=3 409 B7R0.10 CCC(O)C(=O)OC HR144357 [1,1,0,0,0,0|1,0,0]=3 410 B7R0.10 COC(=O)C(Br)CBr HR132839 [1,1,0,0,0,0|2,0,0]=4 411 B7R0.10 COC(=O)C(C)CO HR144262 [1,1,0,0,0,0|2,0,0]=4 412 B7R0.10 COC(=O)C(Cl)CCl HR130110 [1,1,0,0,0,0|2,0,0]=4 413 B7R0.10 COC(=O)C(N)CCl HR117490 [1,1,0,0,0,0|2,0,0]=4 414 B7R0.10 COC(=O)C(N)CO HR126639 [1,1,0,0,0,0|2,0,0]=4 415 B7R0.10 COC(=O)C(N)CO HR134950 [1,1,0,0,0,0|2,0,0]=4 416 B7R0.10 COC(=O)C(N)CO HR136274 [1,1,0,0,0,0|2,0,0]=4 417 B7R0.10 COC(=O)C(N)CO HR146542 [1,1,0,0,0,0|2,0,0]=4 418 B7R0.10 COC(=O)C(N)CS HR136576 [1,1,0,0,0,0|2,0,0]=4 419 B7R0.10 COC(=O)C(O)CO HR119304 [1,1,0,0,0,0|2,0,0]=4 420 B7R0.10 COC(=O)C(O)OC HR135004 [1,1,0,0,0,0|2,0,0]=4 421 B7R0.10 O=C(CO)C(O)CO HR100190 [1,1,0,0,0,0|2,0,0]=4 422 B7R0.11 CCCC(C)(O)CC HR122193 [1,1,0,0,0,0|0,0,2]=4 423 B7R0.1 BrCCCCCCBr HR134505 [1,1,0,0,0,0|1,0,1]=4 424 B7R0.1 CCCCCCCBr HR134594 [1,1,0,0,0,0|0,0,1]=3 425 B7R0.1 CCCCCCCCl HR120915 [1,1,0,0,0,0|0,0,1]=3 426 B7R0.1 CCCCCCCI HR126873 [1,1,0,0,0,0|0,0,1]=3 427 B7R0.1 CCCCCCCO HR135329 [1,1,0,0,0,0|0,0,1]=3 428 B7R0.1 CCCCCCCS HR126629 [1,1,0,0,0,0|0,0,1]=3 429 B7R0.1 CCCCCC[Mg]Br HR108941 [1,1,0,0,0,0|1,0,1]=4 430 B7R0.1 CCCCCC[Mg]Cl HR110838 [1,1,0,0,0,0|1,0,1]=4 431 B7R0.1 CCCCNCCO HR101726 [1,1,0,0,0,0|1,0,1]=4 432 B7R0.1 CCCCOCCCl HR133392 [1,1,0,0,0,0|1,0,1]=4 433 B7R0.1 CCCNCCCN HR100474 [1,1,0,0,0,0|1,0,0]=3 434 B7R0.1 CCCNCCOC HR103597 [1,1,0,0,0,0|1,0,0]=3 435 B7R0.1 CCCSSCCC HR122302 [1,1,0,0,0,0|1,0,0]=3 436 B7R0.1 CCOCCCCCl HR130559 [1,1,0,0,0,0|1,0,1]=4 437 B7R0.1 CC\C=C\CCCC HR100327 [1,1,0,0,0,0|0,0,1]=3 438 B7R0.1 CC\C=C\CCCO HR144605 [1,1,0,0,0,0|0,0,1]=3 439 B7R0.1 COCCOCCBr HR125362 [1,1,0,0,0,0|2,0,0]=4 440 B7R0.1 COCCOCCO HR127002 [1,1,0,0,0,0|2,0,0]=4 441 B7R0.1 ClCCCCCCBr HR126311 [1,1,0,0,0,0|1,0,1]=4 442 B7R0.1 ClCCCCCCCl HR135348 [1,1,0,0,0,0|1,0,1]=4 443 B7R0.1 FCCCCCCBr HR144938 [1,1,0,0,0,0|1,0,1]=4 444 B7R0.1 NCCCCCCN HR128708 [1,1,0,0,0,0|1,0,1]=4 445 B7R0.1 NCCCCCCO HR113176 [1,1,0,0,0,0|1,0,1]=4 446 B7R0.1 NCCCNCCBr HR146740 [1,1,0,0,0,0|2,0,0]=4 447 B7R0.1 NCCCNCCN HR144708 [1,1,0,0,0,0|2,0,0]=4 448 B7R0.1 NCCCNCCO HR135493 [1,1,0,0,0,0|2,0,0]=4 449 B7R0.1 OCCCCCCBr HR132457 [1,1,0,0,0,0|1,0,1]=4 450 B7R0.1 OCCCCCCCl HR127389 [1,1,0,0,0,0|1,0,1]=4 451 B7R0.1 OCCCCCCO HR126915 [1,1,0,0,0,0|1,0,1]=4 452 B7R0.1 OCCCCCCS HR108497 [1,1,0,0,0,0|1,0,1]=4 453 B7R0.1 SCCCCCCS HR125411 [1,1,0,0,0,0|1,0,1]=4 454 B7R0.4 CC(C)CCCCBr HR119057 [1,1,0,0,0,0|1,0,1]=4 455 B7R0.4 CC(C)CCCCO HR145339 [1,1,0,0,0,0|1,0,1]=4 456 B7R0.4 CC(O)CCCCO HR100920 [1,1,0,0,0,0|1,0,1]=4 457 B7R0.4 CCCCCC(C)Br HR136114 [1,1,0,0,0,0|0,0,1]=3 458 B7R0.4 CCCCCC(C)O HR113580 [1,1,0,0,0,0|0,0,1]=3 459 B7R0.4 CCCCCC(C)O HR113894 [1,1,0,0,0,0|0,0,1]=3 460 B7R0.4 CCCCCC(C)O HR133526 [1,1,0,0,0,0|0,0,1]=3 461 B7R0.4 CCCOCC(C)O HR142954 [1,1,0,0,0,0|1,0,0]=3 462 B7R0.4 CCC\C=C\C(C)=O HR30170 [1,1,0,0,0,0|0,0,2]=4 463 B9R0.4 CCCOC(=O)CC(C)C HR123585 [0,2,0,0,0,0|0,0,0]=2 464 B9R0.5 CCCCCC(O)CCC HR100209 [0,2,0,0,0,0|0,0,2]=4 465 B9R0.5 CCCCOC(=O)CC#N HR124420 [0,2,0,0,0,0|1,0,1]=4 466 B9R0.5 CCCCOC(=O)CCS HR144609 [0,2,0,0,0,0|1,0,0]=3 467 B9R0.5 CCC\C=C\C(=O)OCC HR127011 [0,2,0,0,0,0|1,0,0]=3 468 B9R0.5 CCOC(=O)CCCCBr HR125890 [0,2,0,0,0,0|1,0,0]=3 469 B9R0.5 CCOC(=O)CCCCN HR148504 [0,2,0,0,0,0|1,0,0]=3 470 B9R0.5 CCOC(=O)COCCCl HR134831 [0,2,0,0,0,0|1,0,0]=3 471 B9R0.5 CCOCCC(=O)OCC HR122912 [0,2,0,0,0,0|1,0,0]=3 472 B9R0.5 CCO\C=C\C(=O)OCC HR108713 [0,2,0,0,0,0|1,0,1]=4 473 B9R0.5 CCO\C=C\C(=O)OCC HR12909 [0,2,0,0,0,0|1,0,1]=4 474 B9R0.5 CC\C=C\CC(=O)OCC HR143249 [0,2,0,0,0,0|1,0,0]=3 475 B9R0.5 COCCOC(=O)CC#N HR140049 [0,2,0,0,0,0|1,0,1]=4 476 B9R0.8 CCCOC(=O)C(C)CC HR142970 [0,2,0,0,0,0|0,0,0]=2 477 B9R0.8 C\C=C(\C)C(=O)OCCC HR129262 [0,2,0,0,0,0|0,0,2]=4 478 B9R0.18 CCCCC(=O)CCCC HR140614 [0,2,0,0,0,0|0,0,0]=2 479 B9R0.18 CCCC[P+](=O)CCCC HR118819 [0,2,0,0,0,0|1,0,0]=3 480 B9R0.18 CCCNC(=O)NCCC HR105462 [0,2,0,0,0,0|0,0,0]=2 481 B9R0.18 CCOCC(O)COCC HR123783 [0,2,0,0,0,0|0,0,2]=4 482 B9R0.18 CN(CCCN)CCCN HR136343 [0,2,0,0,0,0|2,0,0]=4 483 B9R0.18 O=C(CCCCl)CCCCl HR135367 [0,2,0,0,0,0|0,0,0]=2 484 B9R0.18 O=C(NCCCl)NCCCl HR138383 [0,2,0,0,0,0|2,0,0]=4 485 B9R0.34 CCCC(=O)CC(=O)OC HR142969 [0,2,0,0,0,0|0,0,1]=3 486 B9R0.34 CCCC(C)CC(C)CC HR100997 [0,2,0,0,0,0|1,0,1]=4 487 B9R0.34 CCOC(=O)CC(=O)CBr HR133762 [0,2,0,0,0,0|1,0,1]=4 488 B9R0.34 CCOC(=O)CC(=O)CC HR131188 [0,2,0,0,0,0|1,0,0]=3 489 B9R0.34 CCOC(=O)CC(=O)CCl HR124896 [0,2,0,0,0,0|1,0,1]=4 490 B9R0.34 CCOC(=O)CC(=O)NC HR125174 [0,2,0,0,0,0|1,0,1]=4 491 B9R0.34 CCOC(=O)CC(C)CC HR102263 [0,2,0,0,0,0|1,0,0]=3 492 B9R0.34 CCOC(=O)CC(O)CBr HR123965 [0,2,0,0,0,0|1,0,0]=3 493 B9R0.34 CCOC(=O)CC(O)CBr HR124224 [0,2,0,0,0,0|1,0,0]=3 494 B9R0.34 CCOC(=O)CC(O)CCl HR107822 [0,2,0,0,0,0|1,0,0]=3 495 B9R0.34 CCOC(=O)CC(O)CCl HR123432 [0,2,0,0,0,0|1,0,0]=3 496 B9R0.34 CCOC(=O)CC(O)CCl HR123697 [0,2,0,0,0,0|1,0,0]=3 497 B9R0.34 COCC(=O)CC(=O)OC CAJB01105 [0,2,0,0,0,0|1,0,1]=4 498 B9R0.35 C=CCC(C)C(=O)OCC HR139572 [0,2,0,0,0,0|1,0,1]=4 499 B9R0.35 CCCC(=O)C(=O)OCC HR137737 [0,2,0,0,0,0|0,0,1]=3 500 B9R0.35 CCCC(=O)C(O)CCC HR106180 [0,2,0,0,0,0|0,0,0]=2 501 B9R0.35 CCCC(Br)C(=O)OCC HR135641 [0,2,0,0,0,0|1,0,0]=3 502 B9R0.35 CCCC(C)C(=O)OCC HR130749 [0,2,0,0,0,0|1,0,0]=3 503 B9R0.35 CCCC(N)C(=O)OCC HR128528 [0,2,0,0,0,0|1,0,0]=3 504 B9R0.35 CCOC(=N)C(=O)OCC HR139134 [0,2,0,0,0,0|1,0,1]=4 505 B9R0.35 CCOC(=O)C(=O)OCC ELXM01907 [0,2,0,0,0,0|1,0,1]=4 506 B9R0.35 CCOC(=O)C(Br)CCBr HR138648 [0,2,0,0,0,0|1,0,0]=3 507 B9R0.35 CCOC(=O)C(Cl)OCC HR113792 [0,2,0,0,0,0|1,0,0]=3 508 B9R0.35 C\C=C\C(C)C(=O)OCC HR100631 [0,2,0,0,0,0|1,0,1]=4 509 B9R0.48 CC(C)COC(=O)CC#N HR125981 [0,2,0,0,0,0|1,0,1]=4 510 B9R0.48 CCCC(=O)OCC(C)C HR119768 [0,2,0,0,0,0|0,0,0]=2 511 B9R0.48 CCOC(=O)CCC(=O)Cl HR129703 [0,2,0,0,0,0|1,0,1]=4 512 B9R0.48 CCOC(=O)CCC(=O)[O-] HR131805 [0,2,0,0,0,0|1,0,1]=4 513 B9R0.48 CCOC(=O)CCC(C)=O HR131025 [0,2,0,0,0,0|1,0,0]=3 514 B9R0.48 CCOC(=O)CCC(C)Cl HR102899 [0,2,0,0,0,0|1,0,0]=3 515 B9R0.48 CCOC(=O)CC[N+](=O)[O-] HR32204 [0,2,0,0,0,0|2,0,0]=4 516 B9R0.48 CCOC(=O)CNC(C)=O HR137968 [0,2,0,0,0,0|1,0,1]=4 517 B9R0.48 C\C=C\C(=O)OCC(C)C HR133085 [0,2,0,0,0,0|0,0,2]=4 518 B9R0.6 CCOC(=O)C(=O)C(C)C HR140341 [0,2,0,0,0,0|1,0,1]=4 519 B9R0.6 CCOC(=O)C(Br)C(C)=O HR141243 [0,2,0,0,0,0|1,0,1]=4 520 B9R0.6 CCOC(=O)C(Br)C(C)C HR124370 [0,2,0,0,0,0|1,0,0]=3 521 B9R0.6 CCOC(=O)C(C)C(C)=O HR122775 [0,2,0,0,0,0|1,0,1]=4 522 B9R0.6 CCOC(=O)C(Cl)C(C)=O HR134430 [0,2,0,0,0,0|1,0,1]=4 523 B9R0.6 CCOC(=O)C(F)C(C)=O HR131178 [0,2,0,0,0,0|1,0,1]=4 524 B9R0.6 CCOC(=O)C(N)C(C)=O HR148536 [0,2,0,0,0,0|1,0,1]=4 525 B9R0.6 CCOC(=O)C(N)C(C)C HR129467 [0,2,0,0,0,0|1,0,0]=3 526 B9R0.6 CCOC(=O)C(N)C(C)C HR139476 [0,2,0,0,0,0|1,0,0]=3 527 B9R0.6 CCOC(=O)C(N)C(C)O HR117025 [0,2,0,0,0,0|1,0,0]=3 528 B9R0.6 CCOC(=O)C(O)C(C)C HR145867 [0,2,0,0,0,0|1,0,0]=3 529 B9R0.19 CCOC(=O)C(F)(F)CN HR108205 [0,2,0,0,0,0|2,0,0]=4 530 B9R0.23 CCC(C)C(=O)OC(C)C HR139110 [0,2,0,0,0,0|1,0,0]=3 531 B9R0.37 CCCC(O)C(CC)CO HR137485 [0,2,0,0,0,0|0,0,2]=4 532 B9R0.37 CCOC(=O)C(C#N)CC HR104781 [0,2,0,0,0,0|1,0,0]=3 533 B9R0.37 CCOC(=O)C(CO)CO HR117038 [0,2,0,0,0,0|2,0,0]=4 534 B9R0.44 CC(C)(C)OC(=O)CCN HR104255 [0,2,0,0,0,0|2,0,0]=4 535 B9R0.44 CCOC(=O)CC(C)(C)N HR148568 [0,2,0,0,0,0|1,0,0]=3 536 B9R0.44 CCOC(=O)CC(F)(F)F HR140570 [0,2,0,0,0,0|2,0,0]=4 537 B9R0.44 CCOC(=O)CS(C)(=O)=O HR143635 [0,2,0,0,0,0|2,0,0]=4 538 B9R0.44 CCOC(=O)C[Si](C)(C)C HR110962 [0,2,0,0,0,0|1,1,0]=4 539 B9R0.44 CNCC(=O)OC(C)(C)C HR130705 [0,2,0,0,0,0|2,0,0]=4 540 B9R0.44 CNCC(=O)OC(C)(C)C HR144736 [0,2,0,0,0,0|2,0,0]=4 541 B9R0.53 CC(=O)CC(=O)CC(C)C HR120010 [0,2,0,0,0,0|0,0,1]=3 542 B9R0.53 CC(=O)CC(=O)OC(C)C HR133707 [0,2,0,0,0,0|1,0,1]=4 543 B9R0.53 CC(C)CC(O)CC(C)C HR131807 [0,2,0,0,0,0|0,0,2]=4 544 B9R0.53 CC(C)OC(=O)OC(C)Cl HR127414 [0,2,0,0,0,0|2,0,0]=4 545 B9R0.53 CC(C)OC(=O)OC(C)I HR138639 [0,2,0,0,0,0|2,0,0]=4 546 B9R0.15 CCCC(CCC)C(=O)O HR126708 [0,2,0,0,0,0|0,0,1]=3 547 B9R0.15 CCCC(CCC)C(=O)O HR129255 [0,2,0,0,0,0|0,0,1]=3 548 B9R0.15 CCCC(CCC)C(=O)[O-] HR135608 [0,2,0,0,0,0|0,0,1]=3 549 B9R0.15 CCCC(CCC)C(=O)[O-] HR139668 [0,2,0,0,0,0|0,0,1]=3 550 B9R0.15 CCCC(CCC)C(N)=O HR136410 [0,2,0,0,0,0|0,0,1]=3 551 B9R0.17 CCCP(CCC)CCC HR129140 [0,2,0,0,0,0|2,0,0]=4 552 B7R1.1 CCC1=NCCO1 HR131444 [1,0,0,1,0,0|1,0,1]=4 553 B7R1.1 CCN1CCCC1 HR139662 [1,0,0,1,0,0|2,0,0]=4 554 B7R1.2 CC1=CC(=O)CC1 HR137516 [1,0,0,1,0,0|0,0,2]=4 555 B7R1.2 CC1CCC(=O)O1 HR126256 [1,0,0,1,0,0|1,0,0]=3 556 B7R1.2 CC1CCC(N)C1 HR109161 [1,0,0,1,0,0|1,0,1]=4 557 B7R1.2 CC1CNC(=O)C1 HR146359 [1,0,0,1,0,0|1,0,0]=3 558 B7R1.2 CC1CNC(=O)C1 HR146360 [1,0,0,1,0,0|1,0,0]=3 559 B7R1.2 CC1CNC(=O)C1 HR146369 [1,0,0,1,0,0|1,0,0]=3 560 B7R1.2 CC1COC(=O)O1 HR125363 [1,0,0,1,0,0|2,0,0]=4 561 B7R1.2 CC1COC(=O)O1 HR128407 [1,0,0,1,0,0|2,0,0]=4 562 B7R1.2 CC1COC(=O)O1 HR129273 [1,0,0,1,0,0|2,0,0]=4 563 B7R1.2 CN1CCC(=O)C1 HR102484 [1,0,0,1,0,0|1,0,0]=3 564 B7R1.2 NC1CCC(=O)C1 HR145995 [1,0,0,1,0,0|1,0,0]=3 565 B7R1.2 NC1COC(=O)C1 HR14757 [1,0,0,1,0,0|2,0,0]=4 566 B7R1.2 NC1COC(=O)C1 HR14758 [1,0,0,1,0,0|2,0,0]=4 567 B7R1.2 O=C1CC(O)CN1 HR138458 [1,0,0,1,0,0|2,0,0]=4 568 B7R1.2 O=C1CC(O)CN1 HR138722 [1,0,0,1,0,0|2,0,0]=4 569 B7R1.2 O=C1CC(O)CN1 HR145864 [1,0,0,1,0,0|2,0,0]=4 570 B7R1.2 O=C1CC(O)CO1 HR126625 [1,0,0,1,0,0|2,0,0]=4 571 B7R1.2 O=C1CC(O)CO1 HR127054 [1,0,0,1,0,0|2,0,0]=4 572 B7R1.2 O=C1CC(S)CN1 HR112550 [1,0,0,1,0,0|2,0,0]=4 573 B7R1.2 O=C1CCC(=O)C1 HR130125 [1,0,0,1,0,0|1,0,1]=4 574 B7R1.3 BrC1=CCCCC1 HR156605 [1,0,0,1,0,0|1,0,1]=4 575 B7R1.3 BrC1CCCCC1 HR130726 [1,0,0,1,0,0|1,0,1]=4 576 B7R1.3 C=C1CCNCC1 HR142260 [1,0,0,1,0,0|2,0,0]=4 577 B7R1.3 CC1=CCCCC1 HR143913 [1,0,0,1,0,0|1,0,1]=4 578 B7R1.3 ClC1=CCCCC1 HR129641 [1,0,0,1,0,0|1,0,1]=4 579 B7R1.3 ClC1CCCCC1 HR135558 [1,0,0,1,0,0|1,0,1]=4 580 B7R1.3 NC1CCCCC1 HR124720 [1,0,0,1,0,0|1,0,1]=4 581 B7R1.3 NC1CCCCC1 HR128823 [1,0,0,1,0,0|1,0,1]=4 582 B7R1.3 NC1CCCCC1 HR144083 [1,0,0,1,0,0|1,0,1]=4 583 B7R1.3 NC1CCCCC1 HR145293 [1,0,0,1,0,0|1,0,1]=4 584 B7R1.3 NN1CCCCC1 HR126890 [1,0,0,1,0,0|2,0,0]=4 585 B7R1.3 NN1CCCCC1 HR127151 [1,0,0,1,0,0|2,0,0]=4 586 B7R1.3 O=C1C=CCCC1 HR146309 [1,0,0,1,0,0|0,0,2]=4 587 B7R1.3 O=C1CCCCC1 SIJL01002 [1,0,0,1,0,0|0,0,0]=2 588 B7R1.3 O=C1CCCCN1 HR126393 [1,0,0,1,0,0|1,0,0]=3 589 B7R1.3 O=C1CCCCO1 HR128412 [1,0,0,1,0,0|1,0,0]=3 590 B7R1.3 O=C1CCCNC1 HR108093 [1,0,0,1,0,0|1,0,0]=3 591 B7R1.3 O=C1CCCNC1 HR116769 [1,0,0,1,0,0|1,0,0]=3 592 B7R1.3 O=C1CCCOC1 HR104744 [1,0,0,1,0,0|1,0,0]=3 593 B7R1.3 O=C1CCNCC1 CESA03001 [1,0,0,1,0,0|1,0,0]=3 594 B7R1.3 O=C1CCNCC1 HR105315 [1,0,0,1,0,0|1,0,0]=3 595 B7R1.3 O=C1CCNCC1 HR7756 [1,0,0,1,0,0|1,0,0]=3 596 B7R1.3 O=C1CCOCC1 HR9557 [1,0,0,1,0,0|1,0,0]=3 597 B7R1.3 O=C1CCSCC1 HR123861 [1,0,0,1,0,0|1,0,0]=3 598 B7R1.3 O=C1CC[NH2+]CC1 HR127185 [1,0,0,1,0,0|1,0,0]=3 599 B7R1.3 O=C1CNCCN1 HR132423 [1,0,0,1,0,0|2,0,0]=4 600 B7R1.3 O=C1CNCCO1 HR30209 [1,0,0,1,0,0|2,0,0]=4 601 B7R1.3 O=C1COCCN1 HR115059 [1,0,0,1,0,0|2,0,0]=4 602 B7R1.3 O=C1COCCO1 HR127683 [1,0,0,1,0,0|2,0,0]=4 603 B7R1.3 O=C1CSCCN1 HR147732 [1,0,0,1,0,0|2,0,0]=4 604 B7R1.3 O=C1NCCCN1 HR123216 [1,0,0,1,0,0|2,0,0]=4 605 B7R1.3 OC1CCCCC1 HR122340 [1,0,0,1,0,0|0,0,2]=4 606 B7R1.3 ON1CCCCC1 HR106287 [1,0,0,1,0,0|1,0,1]=4 607 B7R1.3 PC1CCCCC1 HR119652 [1,0,0,1,0,0|1,0,1]=4 608 B7R1.3 SC1CCCCC1 HR119141 [1,0,0,1,0,0|0,1,1]=4 609 B7R1.4 CC1=CCCC1=O HR114448 [1,0,0,1,0,0|0,0,2]=4 610 B7R1.4 CC1CCCC1=O HR112329 [1,0,0,1,0,0|0,0,0]=2 611 B7R1.4 CC1CCNC1=O HR103871 [1,0,0,1,0,0|1,0,0]=3 612 B7R1.4 CC1OCCC1=O HR131028 [1,0,0,1,0,0|1,0,0]=3 613 B7R1.4 CC1SCCC1=O HR124610 [1,0,0,1,0,0|1,0,0]=3 614 B7R1.4 CN1CCCC1=O HR130754 [1,0,0,1,0,0|1,0,0]=3 615 B7R1.4 CN1CCOC1=O HR132150 [1,0,0,1,0,0|2,0,0]=4 616 B7R1.4 NC1CCNC1=O HR148583 [1,0,0,1,0,0|2,0,0]=4 617 B7R1.4 NC1CCOC1=O HR103069 [1,0,0,1,0,0|2,0,0]=4 618 B7R1.4 NC1CCOC1=O HR134625 [1,0,0,1,0,0|2,0,0]=4 619 B7R1.4 NC1CCOC1=O HR137954 [1,0,0,1,0,0|2,0,0]=4 620 B7R1.4 NC1CCOC1=O HR146738 [1,0,0,1,0,0|2,0,0]=4 621 B7R1.4 NC1CCSC1=O HR137672 [1,0,0,1,0,0|2,0,0]=4 622 B7R1.4 NN1CCCC1=O GASA04306 [1,0,0,1,0,0|2,0,0]=4 623 B7R1.4 O=C1CCCC1Br HR121144 [1,0,0,1,0,0|1,0,0]=3 624 B7R1.4 O=C1CCCC1Cl HR112783 [1,0,0,1,0,0|1,0,0]=3 625 B7R1.4 O=C1NCCC1O HR102172 [1,0,0,1,0,0|2,0,0]=4 626 B7R1.4 O=C1NCCC1O HR113273 [1,0,0,1,0,0|2,0,0]=4 627 B7R1.4 O=C1NCCC1O HR113406 [1,0,0,1,0,0|2,0,0]=4 628 B7R1.4 O=C1NCCC1O HR147016 [1,0,0,1,0,0|2,0,0]=4 629 B7R1.4 O=C1OCCC1Br HR10714 [1,0,0,1,0,0|2,0,0]=4 630 B7R1.22 CCC(=O)C1CC1 HR104134 [1,0,0,1,0,0|0,0,0]=2 631 B7R1.22 COC(=O)C1CC1 HR128125 [1,0,0,1,0,0|1,0,0]=3 632 B7R1.22 COC(=O)C1CN1 HR112447 [1,0,0,1,0,0|2,0,0]=4 633 B7R1.22 COC(=O)C1CO1 HR129937 [1,0,0,1,0,0|2,0,0]=4 634 B7R1.22 O=C(CBr)C1CC1 HR125713 [1,0,0,1,0,0|1,0,0]=3 635 B7R1.24 C1CCCNCC1 HR146715 [1,0,0,1,0,0|1,0,0]=3 636 B7R1.24 C1CCOCOC1 HR105864 [1,0,0,1,0,0|2,0,0]=4 637 B7R1.24 C1CNCCNC1 HR122712 [1,0,0,1,0,0|2,0,0]=4 638 B7R1.24 C1CNCCOC1 HR100780 [1,0,0,1,0,0|2,0,0]=4 639 B7R1.24 C1CNCCOC1 HR146137 [1,0,0,1,0,0|2,0,0]=4 640 B9R1.2 CCC1CC(=O)CCO1 HR120478 [0,1,0,1,0,0|1,0,0]=3 641 B9R1.2 CCC1CCCC(=O)N1 HR146355 [0,1,0,1,0,0|0,0,0]=2 642 B9R1.2 CCC1CCCC(=O)O1 HR115799 [0,1,0,1,0,0|0,0,0]=2 643 B9R1.2 CCN1CCCC(O)C1 HR124748 [0,1,0,1,0,0|0,0,2]=4 644 B9R1.2 CN1CCCC(CN)C1 HR119510 [0,1,0,1,0,0|2,0,0]=4 645 B9R1.2 CN1CCCC(CO)C1 HR137012 [0,1,0,1,0,0|2,0,0]=4 646 B9R1.2 O=C1CCCC(CO)C1 HR121488 [0,1,0,1,0,0|0,0,0]=2 647 B9R1.2 O=C1CCCC(CO)N1 HR145838 [0,1,0,1,0,0|1,0,0]=3 648 B9R1.2 O=C1CCCC(CO)N1 HR145841 [0,1,0,1,0,0|1,0,0]=3 649 B9R1.2 O=C1CCCC(CO)N1 HR145844 [0,1,0,1,0,0|1,0,0]=3 650 B9R1.2 O=C1COCC(CO)N1 HR145834 [0,1,0,1,0,0|2,0,0]=4 651 B9R1.8 CCCC1CCCCN1 HR117183 [0,1,0,1,0,0|1,0,1]=4 652 B9R1.8 CCCC1CCNCC1 HR111340 [0,1,0,1,0,0|1,0,1]=4 653 B9R1.8 CCCN1CCNCC1 HR149066 [0,1,0,1,0,0|2,0,0]=4 654 B9R1.8 CCOC1=CCCCC1 HR107315 [0,1,0,1,0,0|2,0,0]=4 655 B9R1.8 NCCC1=CCCCC1 HR113892 [0,1,0,1,0,0|2,0,0]=4 656 B9R1.12 CCCCN1CCCC1 HR134206 [0,1,0,1,0,0|2,0,0]=4 657 B9R1.12 CCOCC1CCCO1 HR104807 [0,1,0,1,0,0|0,0,2]=4 658 B9R1.12 NCCCN1CCCC1 HR104838 [0,1,0,1,0,0|2,0,0]=4 659 B9R1.12 OCCCN1CCCC1 HR104866 [0,1,0,1,0,0|2,0,0]=4 660 B9R1.15 COC1CCCNC1=O HR120913 [0,1,0,1,0,0|1,0,0]=3 661 B9R1.15 COC1COCCC1=O HR108975 [0,1,0,1,0,0|1,0,0]=3 662 B9R1.15 N#CC1CNCCC1=O HR114535 [0,1,0,1,0,0|1,0,1]=4 663 B9R1.15 N#CC1CNCCC1=O HR148662 [0,1,0,1,0,0|1,0,1]=4 664 B9R1.27 CCC1=C(C)CNC1=O HR133364 [0,1,0,1,0,0|0,0,2]=4 665 B9R1.27 CCC1C(=O)CCC1=O HR124455 [0,1,0,1,0,0|0,0,1]=3 666 B9R1.33 CCCN1CCCC1=O HR125417 [0,1,0,1,0,0|0,0,0]=2 667 B9R1.33 CN1CCCC1CCCl HR118734 [0,1,0,1,0,0|2,0,0]=4 668 B9R1.33 CN1CCCC1CCCl HR122673 [0,1,0,1,0,0|2,0,0]=4 669 B9R1.33 CN1CCCC1CCN HR127358 [0,1,0,1,0,0|2,0,0]=4 670 B9R1.33 CN1CCCC1CCN HR136120 [0,1,0,1,0,0|2,0,0]=4 671 B9R1.33 CN1CCCC1CCN HR146012 [0,1,0,1,0,0|2,0,0]=4 672 B9R1.33 CN1CCCC1CCN HR146095 [0,1,0,1,0,0|2,0,0]=4 673 B9R1.33 CN1CCCC1CCO HR133704 [0,1,0,1,0,0|2,0,0]=4 674 B9R1.33 COCC1CCCN1N HR120313 [0,1,0,1,0,0|2,0,0]=4 675 B9R1.33 COCC1CCCN1N HR120636 [0,1,0,1,0,0|2,0,0]=4 676 B9R1.33 NCCN1CCCC1=O HR106125 [0,1,0,1,0,0|1,0,0]=3 677 B9R1.33 NCCN1CCNC1=O HR108791 [0,1,0,1,0,0|2,0,0]=4 678 B9R1.33 NCCN1CCNC1=O HR120336 [0,1,0,1,0,0|2,0,0]=4 679 B9R1.33 O=C1CCCN1CCO HR133780 [0,1,0,1,0,0|1,0,0]=3 680 B9R1.33 O=C1NCCN1CCCl HR134172 [0,1,0,1,0,0|2,0,0]=4 681 B9R1.33 O=C1NCCN1CCO HR135370 [0,1,0,1,0,0|2,0,0]=4 682 B9R1.33 O=C1OCCN1CCCl HR110242 [0,1,0,1,0,0|2,0,0]=4 683 B9R1.33 O=C1OCCN1CCO HR109919 [0,1,0,1,0,0|2,0,0]=4 684 B9R1.48 O=C1CCCCC(=O)C1 HR20261 [0,1,0,1,0,0|0,0,1]=3 685 B9R1.49 CN1CCCC(=O)CC1 HR115762 [0,1,0,1,0,0|0,0,0]=2 686 B9R1.49 CN1CCCC(=O)CC1 HR2443 [0,1,0,1,0,0|0,0,0]=2 687 B9R1.49 CN1CCCC(O)CC1 HR132019 [0,1,0,1,0,0|0,0,2]=4 688 B9R1.49 CN1CCNC(=O)CC1 HR112731 [0,1,0,1,0,0|1,0,0]=3 689 B9R1.49 CN1CCNC(=O)CC1 HR146772 [0,1,0,1,0,0|1,0,0]=3 690 B9R1.50 NC1CCCCCCC1 HR140139 [0,1,0,1,0,0|1,0,1]=4 691 B9R1.50 O=C1CCCCCCC1 HR129393 [0,1,0,1,0,0|0,0,0]=2 692 B9R1.50 O=C1CCCCCCN1 HR128374 [0,1,0,1,0,0|0,0,0]=2 693 B9R1.50 O=C1CCNCCCN1 HR116529 [0,1,0,1,0,0|1,0,0]=3 694 B9R1.50 OC1CCCCCCC1 HR105676 [0,1,0,1,0,0|0,0,2]=4 695 B9R1.69 CC1CNC(=O)CC1=O HR148296 [0,1,0,1,0,0|1,0,1]=4 696 B9R1.73 CCOC(=O)C1CCC1 HR127166 [0,1,0,1,0,0|1,0,0]=3 697 B9R1.73 CCOC(=O)C1CNC1 HR139224 [0,1,0,1,0,0|1,0,0]=3 698 B9R1.75 CCCC(=O)OC1CO1 PRCQ00205 [0,1,0,1,0,0|1,0,0]=3 699 B9R1.75 CCOC(=O)CC1CC1 HR119908 [0,1,0,1,0,0|1,0,0]=3 700 B9R1.100 CCCNC(=O)C1CC1 HR141530 [0,1,0,1,0,0|0,0,0]=2 701 B9R1.3 CC1C(=O)CCCC1=O HR133563 [0,1,0,1,0,0|1,0,1]=4 702 B9R1.3 O=C1CCCC(=O)C1Br HR108385 [0,1,0,1,0,0|1,0,1]=4 703 B9R1.5 CN1CCCCCC1=O HR132765 [0,1,0,1,0,0|1,0,0]=3 704 B9R1.5 NC1CCCCNC1=O HR143152 [0,1,0,1,0,0|1,0,0]=3 705 B9R1.5 NC1CCCCNC1=O HR144162 [0,1,0,1,0,0|1,0,0]=3 706 B9R1.5 NC1CSCCNC1=O HR111257 [0,1,0,1,0,0|2,0,0]=4 707 B9R1.5 O=C1CCCCCN1Br HR100192 [0,1,0,1,0,0|1,0,0]=3 708 B9R1.37 CC1CC(=O)C(=O)C1C HR124020 [0,1,0,1,0,0|0,0,1]=3 709 B9R1.74 CCOC(=O)C1(C)CC1 HR109932 [0,1,0,1,0,0|1,0,0]=3 710 B9R1.74 CCOC(=O)C1(N)CC1 HR14733 [0,1,0,1,0,0|1,0,0]=3 711 B9R1.34 CC1CC(=O)CC(=O)C1 HR14279 [0,1,0,1,0,0|0,0,1]=3 712 B9R1.34 CC1CC(=O)CC(C)O1 HR111074 [0,1,0,1,0,0|0,0,0]=2 713 B9R1.34 CC1CC(O)CC(C)N1 HR149817 [0,1,0,1,0,0|0,0,2]=4 714 B9R1.41 CC(=O)C1CCCC1=O HR144598 [0,1,0,1,0,0|0,0,1]=3 715 B9R1.41 CC(=O)C1CCOC1=O HTXM01002 [0,1,0,1,0,0|1,0,1]=4 716 B9R1.41 CC(C)N1CCCC1=O HR104571 [0,1,0,1,0,0|1,0,0]=3 717 B9R1.41 O=C(O)C1CCCC1=O HR109477 [0,1,0,1,0,0|1,0,1]=4 718 B9R1.66 CC1(C)CC(=O)CCO1 HR102210 [0,1,0,1,0,0|1,0,0]=3 719 B9R1.66 CC1(C)CCCC(=O)C1 HR30153 [0,1,0,1,0,0|0,0,0]=2 720 B9R1.66 CC1(O)CCOC(=O)C1 HR123601 [0,1,0,1,0,0|1,0,0]=3 721 B9R1.137 CC(=O)CC(=O)C1CC1 HR144451 [0,1,0,1,0,0|0,0,1]=3 722 B9R1.89 NCC1CCCCCC1 HR109302 [0,1,0,1,0,0|1,0,1]=4 723 B9R1.89 O=CC1CCCCCC1 HR146293 [0,1,0,1,0,0|0,0,1]=3 724 B9R1.89 O=CN1CCCNCC1 HR112855 [0,1,0,1,0,0|2,0,0]=4 725 B9R2.39 O=C1CC2CCC1C2 HR102426 [0,0,0,2,0,0|0,0,0]=2 726 B9R2.68 C1CC2CNC(C1)C2 HR116444 [0,0,0,2,0,0|1,0,1]=4 727 B9R2.7 O=C1CC2C=CCC12 HR129364 [0,0,0,2,0,0|0,0,2]=4 728 B9R2.7 O=C1CC2C=CCC12 HR142933 [0,0,0,2,0,0|0,0,2]=4 729 B9R2.7 O=C1CC2C=CCC12 HR143858 [0,0,0,2,0,0|0,0,2]=4 730 B9R2.7 O=C1NC2CCCC12 HR101686 [0,0,0,2,0,0|1,0,0]=3 731 B9R2.87 NC(C1CC1)C2CC2 HR124296 [0,0,0,2,0,0|1,0,1]=4 732 B9R2.87 O=C(C1CC1)C2CC2 HR129673 [0,0,0,2,0,0|0,0,0]=2