0 B7R0.5 C=C(C)C(=O)NCO HR114687 [0,0,0,0,0,0|3,0,0]=3 1 B7R0.5 CC(C)C(=O)OCCl HR116048 [0,0,0,0,0,0|2,0,1]=3 2 B7R0.5 CCCC(=O)C(=O)O HR138596 [0,0,0,0,0,0|2,0,0]=2 3 B7R0.5 CCCC(=O)C(C)=O HR139186 [0,0,0,0,0,0|1,0,0]=1 4 B7R0.5 CCCC(=O)C(C)C HR130078 [0,0,0,0,0,0|2,0,1]=3 5 B7R0.5 CCCC(Br)C(=O)Cl HR140278 [0,0,0,0,0,0|3,0,1]=4 6 B7R0.5 CCCC(Br)C(=O)O HR114924 [0,0,0,0,0,0|3,0,1]=4 7 B7R0.5 CCCC(C)C(=O)O HR131664 [0,0,0,0,0,0|3,0,1]=4 8 B7R0.5 CCCC(N)C(=O)O HR122649 [0,0,0,0,0,0|3,0,1]=4 9 B7R0.5 CCCC(N)C(=O)O HR136723 [0,0,0,0,0,0|3,0,1]=4 10 B7R0.5 CCCC(N)C(=O)O HR138486 [0,0,0,0,0,0|3,0,1]=4 11 B7R0.5 CCOC(=O)C(=O)Cl HR138954 [0,0,0,0,0,0|1,0,0]=1 12 B7R0.5 CCOC(=O)C(C)=O HR135005 [0,0,0,0,0,0|0,0,0]=0 13 B7R0.5 CCOC(=O)C(C)Br HR123330 [0,0,0,0,0,0|1,0,1]=2 14 B7R0.5 CCOC(=O)C(C)C BEJL02302 [0,0,0,0,0,0|1,0,1]=2 15 B7R0.5 CCOC(=O)C(C)F HR137458 [0,0,0,0,0,0|1,0,1]=2 16 B7R0.5 CCOC(=O)C(C)N HR113453 [0,0,0,0,0,0|1,0,1]=2 17 B7R0.5 CCOC(=O)C(C)N HR123317 [0,0,0,0,0,0|1,0,1]=2 18 B7R0.5 CCOC(=O)C(C)N HR129365 [0,0,0,0,0,0|1,0,1]=2 19 B7R0.5 CCOC(=O)C(C)O HR100136 [0,0,0,0,0,0|0,0,2]=2 20 B7R0.5 CCOC(=O)C(C)O HR15558 [0,0,0,0,0,0|0,0,2]=2 21 B7R0.5 CCOC(=O)C(C)S HR126591 [0,0,0,0,0,0|0,1,1]=2 22 B7R0.5 CCOC(=O)C(F)Br HR137876 [0,0,0,0,0,0|2,0,1]=3 23 B7R0.5 CCOC(=O)C(F)Cl HR115827 [0,0,0,0,0,0|2,0,1]=3 24 B7R0.5 CCOC(=O)C(F)F HR123633 [0,0,0,0,0,0|2,0,1]=3 25 B7R0.5 CCOC(=S)C(N)=O HR125905 [0,0,0,0,0,0|1,1,0]=2 26 B7R0.5 CC\C=C(\C)C(=O)O HR131305 [0,0,0,0,0,0|3,0,0]=3 27 B7R0.5 CC\C=C(\C)C(=O)O HR138938 [0,0,0,0,0,0|3,0,0]=3 28 B6R0.1 C#CC(=O)NCC HR116239 [1,0,0,0,0,0|1,0,2]=4 29 B6R0.1 C#CC(=O)OCC HR132600 [1,0,0,0,0,0|0,0,2]=3 30 B6R0.1 C=CC(=O)CCC HR100488 [1,0,0,0,0,0|1,0,1]=3 31 B6R0.1 C=CC(=O)NCO HR132117 [1,0,0,0,0,0|2,0,1]=4 32 B6R0.1 C=COC(=O)CC HR145643 [1,0,0,0,0,0|0,0,3]=4 33 B6R0.1 CC#CC(=O)OC HR141249 [1,0,0,0,0,0|2,0,1]=4 34 B6R0.1 CCC(=O)CSC HR123442 [1,0,0,0,0,0|2,0,1]=4 35 B6R0.1 CCCC(=O)NN HR113429 [1,0,0,0,0,0|3,0,0]=4 36 B6R0.1 CCCC(=O)SC HR136352 [1,0,0,0,0,0|2,0,0]=3 37 B6R0.1 CCCC(=S)OC HR122832 [1,0,0,0,0,0|2,1,0]=4 38 B6R0.1 CCOC(=N)CCl HR112327 [1,0,0,0,0,0|2,0,1]=4 39 B6R0.1 CCOC(=O)C=O HR130872 [1,0,0,0,0,0|0,0,0]=1 40 B6R0.1 CCOC(=O)CBr AMJB00601 [1,0,0,0,0,0|1,0,1]=3 41 B6R0.1 CCOC(=O)CCl HR147617 [1,0,0,0,0,0|1,0,1]=3 42 B6R0.1 CCOC(=O)CN HR134743 [1,0,0,0,0,0|1,0,1]=3 43 B6R0.1 CCOC(=O)CO HR127384 [1,0,0,0,0,0|0,0,2]=3 44 B6R0.1 CCOC(=O)CS HR136673 [1,0,0,0,0,0|0,1,1]=3 45 B6R0.1 CCOC(=O)NN HR102667 [1,0,0,0,0,0|2,0,0]=3 46 B6R0.1 CCOC(=O)NN HR138962 [1,0,0,0,0,0|2,0,0]=3 47 B6R0.1 CCOC(=O)OC HR138173 [1,0,0,0,0,0|1,0,0]=2 48 B6R0.1 CCOC(=S)S[Na] HR127866 [1,0,0,0,0,0|2,1,0]=4 49 B6R0.1 CCO\C(C)=N/O SIJL01004 [1,0,0,0,0,0|2,0,1]=4 50 B6R0.1 CCSC(=O)CC HR138214 [1,0,0,0,0,0|0,1,1]=3 51 B6R0.1 CNCC(=O)OC HR130436 [1,0,0,0,0,0|3,0,0]=4 52 B6R0.1 COC(=O)CCBr HR133552 [1,0,0,0,0,0|3,0,0]=4 53 B6R0.1 COC(=O)CCN HR135038 [1,0,0,0,0,0|3,0,0]=4 54 B6R0.1 COC(=O)CCS HR133169 [1,0,0,0,0,0|3,0,0]=4 55 B6R0.1 COCC(=O)OC HR147666 [1,0,0,0,0,0|3,0,0]=4 56 B6R0.1 C\C=C\C(=O)CC HR108073 [1,0,0,0,0,0|1,0,2]=4 57 B6R0.3 C=C(CC)C(=O)O HR118672 [1,0,0,0,0,0|2,0,0]=3 58 B6R0.3 C=C(F)C(=O)OC HR30168 [1,0,0,0,0,0|1,0,1]=3 59 B6R0.3 CC(=O)\C(C)=N\O HR130047 [1,0,0,0,0,0|3,0,0]=4 60 B6R0.3 CC(C)C(=O)CBr HR144939 [1,0,0,0,0,0|2,0,1]=4 61 B6R0.3 CCC(=O)C(=O)O HR128819 [1,0,0,0,0,0|1,0,0]=2 62 B6R0.3 CCC(=O)C(C)=O HR131826 [1,0,0,0,0,0|0,0,0]=1 63 B6R0.3 CCC(=O)C(C)Cl HR114937 [1,0,0,0,0,0|1,0,1]=3 64 B6R0.3 CCC(=O)N(C)C HR122269 [1,0,0,0,0,0|2,0,0]=3 65 B6R0.3 CCC(Br)C(=O)Cl HR115509 [1,0,0,0,0,0|2,0,1]=4 66 B6R0.3 CCC(Br)C(=O)O HR123595 [1,0,0,0,0,0|2,0,1]=4 67 B6R0.3 CCC(C)C(=O)Cl HR144038 [1,0,0,0,0,0|2,0,1]=4 68 B6R0.3 CCC(C)C(=O)O HR124401 [1,0,0,0,0,0|2,0,1]=4 69 B6R0.3 CCC(C)C(=O)O HR124666 [1,0,0,0,0,0|2,0,1]=4 70 B6R0.3 CCC(C)C(N)=O HR115534 [1,0,0,0,0,0|2,0,1]=4 71 B6R0.3 CCC(Cl)C(=O)O HR104193 [1,0,0,0,0,0|2,0,1]=4 72 B6R0.3 CCC(Cl)C(=O)O HR104505 [1,0,0,0,0,0|2,0,1]=4 73 B6R0.3 CCC(N)C(=O)O HR100731 [1,0,0,0,0,0|2,0,1]=4 74 B6R0.3 CCC(N)C(=O)O HR128531 [1,0,0,0,0,0|2,0,1]=4 75 B6R0.3 CCC(N)C(=O)O HR128797 [1,0,0,0,0,0|2,0,1]=4 76 B6R0.3 CCC(N)C(=O)O HR130831 [1,0,0,0,0,0|2,0,1]=4 77 B6R0.3 CCC(N)C(=O)O VOJL00901 [1,0,0,0,0,0|2,0,1]=4 78 B6R0.3 CCC(N)C(N)=O HR113889 [1,0,0,0,0,0|2,0,1]=4 79 B6R0.3 CCC(N)C(N)=O HR133280 [1,0,0,0,0,0|2,0,1]=4 80 B6R0.3 CCC(O)C(=O)O HR145745 [1,0,0,0,0,0|1,0,2]=4 81 B6R0.3 CCC(O)C(=O)O HR8265 [1,0,0,0,0,0|1,0,2]=4 82 B6R0.3 CCC(S)C(C)=O HR124234 [1,0,0,0,0,0|0,1,1]=3 83 B6R0.3 CCN(C)C(=O)Cl HR16066 [1,0,0,0,0,0|3,0,0]=4 84 B6R0.3 CN(C)C(=O)CCl HR133574 [1,0,0,0,0,0|3,0,0]=4 85 B6R0.3 CN(C)C(=O)CN HR107364 [1,0,0,0,0,0|3,0,0]=4 86 B6R0.3 CN(C)C(=O)CN HR119152 [1,0,0,0,0,0|3,0,0]=4 87 B6R0.3 CNC(=O)N(C)C HR100405 [1,0,0,0,0,0|3,0,0]=4 88 B6R0.3 COC(=O)C(=O)Cl FOXF01206 [1,0,0,0,0,0|1,0,0]=2 89 B6R0.3 COC(=O)C(C)=O HR131015 [1,0,0,0,0,0|0,0,0]=1 90 B6R0.3 COC(=O)C(C)Br HR123627 [1,0,0,0,0,0|1,0,1]=3 91 B6R0.3 COC(=O)C(C)Cl HR133108 [1,0,0,0,0,0|1,0,1]=3 92 B6R0.3 COC(=O)C(C)N HR10884 [1,0,0,0,0,0|1,0,1]=3 93 B6R0.3 COC(=O)C(C)N HR126866 [1,0,0,0,0,0|1,0,1]=3 94 B6R0.3 COC(=O)C(C)N HR127180 [1,0,0,0,0,0|1,0,1]=3 95 B6R0.3 COC(=O)C(C)O HR133668 [1,0,0,0,0,0|0,0,2]=3 96 B6R0.3 COC(=O)C(C)O HR6056 [1,0,0,0,0,0|0,0,2]=3 97 B6R0.3 COC(=O)C(F)F HR120744 [1,0,0,0,0,0|2,0,1]=4 98 B6R0.3 COC(=O)C(N)=O HR115965 [1,0,0,0,0,0|1,0,0]=2 99 B6R0.3 CON(C)C(C)=O HR136259 [1,0,0,0,0,0|2,0,0]=3 100 B6R0.3 CSC(C)C(C)=O HR133684 [1,0,0,0,0,0|1,1,1]=4 101 B6R0.3 C\C=C(/C)C(=O)Cl HR120157 [1,0,0,0,0,0|2,0,1]=4 102 B6R0.3 C\C=C(/C)C(=O)O HR127692 [1,0,0,0,0,0|2,0,1]=4 103 B6R0.3 C\C=C(/C)C(=O)O HR140908 [1,0,0,0,0,0|2,0,1]=4 104 B6R0.3 O=C(O)C(=O)CBr HR129820 [1,0,0,0,0,0|2,0,0]=3 105 B6R0.4 C=C(C)CNCC HR128262 [1,0,0,0,0,0|2,0,1]=4 106 B6R0.4 CC(=O)CCCBr HR147487 [1,0,0,0,0,0|2,0,1]=4 107 B6R0.4 CC(=O)CCCCl HR100024 [1,0,0,0,0,0|2,0,1]=4 108 B6R0.4 CC(=O)CCCO HR136959 [1,0,0,0,0,0|2,0,1]=4 109 B6R0.4 CC(=O)NCCN HR128075 [1,0,0,0,0,0|3,0,0]=4 110 B6R0.4 CC(=O)NCCO HR100613 [1,0,0,0,0,0|3,0,0]=4 111 B6R0.4 CC(=O)OCCBr HR131354 [1,0,0,0,0,0|3,0,0]=4 112 B6R0.4 CCCCC(=O)Cl HR147689 [1,0,0,0,0,0|2,0,1]=4 113 B6R0.4 CCCCC(=O)[O-] HR143929 [1,0,0,0,0,0|2,0,1]=4 114 B6R0.4 CCCCC(N)=O HR110039 [1,0,0,0,0,0|2,0,1]=4 115 B6R0.4 CCCSC(C)=O HR137881 [1,0,0,0,0,0|2,0,0]=3 116 B6R0.4 CCNCC(=O)O HR105131 [1,0,0,0,0,0|2,0,1]=4 117 B6R0.4 CCOCC(=O)O HR123178 [1,0,0,0,0,0|1,0,1]=3 118 B6R0.4 CO\C=C\C(C)=O HR138997 [1,0,0,0,0,0|2,0,0]=3 119 B6R0.4 CSCCC(C)=O HR133952 [1,0,0,0,0,0|2,0,1]=4 120 B8R0.2 CCC(C)C(=O)C(=O)O HR136223 [0,1,0,0,0,0|2,0,0]=3 121 B8R0.2 CCC(C)C(=O)C(=O)[O-] HR105983 [0,1,0,0,0,0|2,0,0]=3 122 B8R0.3 C=C(C#N)C(=O)OCC HR106324 [0,1,0,0,0,0|1,0,1]=3 123 B8R0.3 C=C(CBr)C(=O)OCC HR109438 [0,1,0,0,0,0|1,0,0]=2 124 B8R0.3 C=C(CCl)C(=O)OCC HR112979 [0,1,0,0,0,0|1,0,0]=2 125 B8R0.3 C=C(CO)C(=O)OCC HR110396 [0,1,0,0,0,0|1,0,0]=2 126 B8R0.3 CCCC(Br)C(=O)OC HR135374 [0,1,0,0,0,0|2,0,1]=4 127 B8R0.3 CCCC(N)C(=O)OC HR141930 [0,1,0,0,0,0|2,0,1]=4 128 B8R0.3 CCOC(=O)C(=O)CBr NSJB02101 [0,1,0,0,0,0|0,0,0]=1 129 B8R0.3 CCOC(=O)C(=O)CC HR105760 [0,1,0,0,0,0|0,0,0]=1 130 B8R0.3 CCOC(=O)C(Br)CBr HR129498 [0,1,0,0,0,0|1,0,1]=3 131 B8R0.3 CCOC(=O)C(Br)CC HR135114 [0,1,0,0,0,0|1,0,1]=3 132 B8R0.3 CCOC(=O)C(C)C#N HR121152 [0,1,0,0,0,0|1,0,1]=3 133 B8R0.3 CCOC(=O)C(C)C=O HR112338 [0,1,0,0,0,0|0,0,1]=2 134 B8R0.3 CCOC(=O)C(C)CC HR129683 [0,1,0,0,0,0|1,0,1]=3 135 B8R0.3 CCOC(=O)C(C)CC HR138244 [0,1,0,0,0,0|1,0,1]=3 136 B8R0.3 CCOC(=O)C(C)CN HR117532 [0,1,0,0,0,0|1,0,1]=3 137 B8R0.3 CCOC(=O)C(Cl)CCl HR119653 [0,1,0,0,0,0|1,0,1]=3 138 B8R0.3 CCOC(=O)C(N)CC HR103721 [0,1,0,0,0,0|1,0,1]=3 139 B8R0.3 CCOC(=O)C(N)CO HR127361 [0,1,0,0,0,0|1,0,1]=3 140 B8R0.3 CCOC(=O)C(N)CO HR142606 [0,1,0,0,0,0|1,0,1]=3 141 B8R0.3 CCOC(=O)C(N)CS HR136050 [0,1,0,0,0,0|1,0,1]=3 142 B8R0.3 CCOC(=O)C(S)CC HR118467 [0,1,0,0,0,0|0,1,1]=3 143 B8R0.3 CCOC(=O)\C(Cl)=N/O HR130373 [0,1,0,0,0,0|1,0,1]=3 144 B8R0.3 C\C=C(\C)C(=O)OCC HR128479 [0,1,0,0,0,0|1,0,0]=2 145 B8R0.8 C=C(C)C(=O)OCCC HR115069 [0,1,0,0,0,0|1,0,0]=2 146 B8R0.8 C=C(C)C(=O)OCCN HR143632 [0,1,0,0,0,0|1,0,0]=2 147 B8R0.8 C=C(C)C(=O)OCCO HR133745 [0,1,0,0,0,0|1,0,0]=2 148 B8R0.8 CCCCC(=O)C(C)=O HR133012 [0,1,0,0,0,0|1,0,0]=2 149 B8R0.8 CCCOC(=O)C(C)O HR104314 [0,1,0,0,0,0|0,0,2]=3 150 B8R0.8 CCCOC(=O)C(C)O HR143626 [0,1,0,0,0,0|0,0,2]=3 151 B8R0.12 CCOC(C)(C)C(=O)O HR118727 [0,1,0,0,0,0|2,0,1]=4 152 B8R0.14 C=C(OCC)[Si](C)(C)C HR116026 [0,1,0,0,0,0|2,1,0]=4 153 B8R0.14 CC(C)(C)C(=O)OCCl BEXF01608 [0,1,0,0,0,0|2,0,1]=4 154 B8R0.14 CC(C)(C)C(=O)OCI HR138411 [0,1,0,0,0,0|2,0,1]=4 155 B8R0.14 CCOC(=O)C(C)(C)Br HR146771 [0,1,0,0,0,0|1,0,1]=3 156 B8R0.14 CCOC(=O)C(C)(C)C HR128943 [0,1,0,0,0,0|1,0,1]=3 157 B8R0.14 CCOC(=O)C(C)(C)N HR108303 [0,1,0,0,0,0|1,0,1]=3 158 B8R0.14 CCOC(=O)C(C)(F)F HR142540 [0,1,0,0,0,0|1,0,1]=3 159 B8R0.14 CCOC(=O)C(Cl)(Cl)Cl HR133986 [0,1,0,0,0,0|2,0,1]=4 160 B8R0.14 CCOC(=O)C(F)(Br)Br HR128666 [0,1,0,0,0,0|2,0,1]=4 161 B8R0.14 CCOC(=O)C(F)(F)Br HR16953 [0,1,0,0,0,0|2,0,1]=4 162 B8R0.14 CCOC(=O)C(F)(F)Cl HR123102 [0,1,0,0,0,0|2,0,1]=4 163 B8R0.14 CCOC(=O)C(F)(F)F HR30001 [0,1,0,0,0,0|2,0,1]=4 164 B8R0.14 CCOC(=O)C(F)(F)I HR127216 [0,1,0,0,0,0|2,0,1]=4 165 B8R0.23 C=C(C)C(=O)NC(C)C HR105518 [0,1,0,0,0,0|2,0,0]=3 166 B8R0.23 C=C(CC(C)C)C(C)=O HR119288 [0,1,0,0,0,0|2,0,0]=3 167 B8R0.23 CC(=O)OC(C)C(C)=O HR135424 [0,1,0,0,0,0|1,0,2]=4 168 B8R0.23 CC(C)CC(=O)C(=O)O HR122104 [0,1,0,0,0,0|2,0,0]=3 169 B8R0.23 CC(C)CC(=O)C(=O)[O-] HR105375 [0,1,0,0,0,0|2,0,0]=3 170 B8R0.23 CC(C)CC(=O)C(=O)[O-] HR138461 [0,1,0,0,0,0|2,0,0]=3 171 B8R0.23 CC(C)CC(=O)C(=O)[O-] HR138724 [0,1,0,0,0,0|2,0,0]=3 172 B8R0.23 CC(C)OC(=O)C(C)N HR116348 [0,1,0,0,0,0|1,0,1]=3 173 B8R0.23 CC(C)OC(=O)C(C)N HR142603 [0,1,0,0,0,0|1,0,1]=3 174 B8R0.23 CC(C)OC(=O)C(C)N HR146754 [0,1,0,0,0,0|1,0,1]=3 175 B8R0.23 CC(C)OC(=O)C(C)O HR143818 [0,1,0,0,0,0|0,0,2]=3 176 B8R1.5 C=C1CCCCC1=C HR100430 [0,0,0,1,0,0|3,0,0]=4 177 B8R1.5 CC1CCCCC1=O HR128184 [0,0,0,1,0,0|2,0,1]=4 178 B8R1.5 CC1NCCNC1=O HR149053 [0,0,0,1,0,0|2,0,1]=4 179 B8R1.5 CC1OCCNC1=O HR148881 [0,0,0,1,0,0|1,0,2]=4 180 B8R1.5 NC1CCCNC1=O HR103141 [0,0,0,1,0,0|2,0,1]=4 181 B8R1.5 NC1CCCNC1=O HR109690 [0,0,0,1,0,0|2,0,1]=4 182 B8R1.5 NC1CCCNC1=O HR143772 [0,0,0,1,0,0|2,0,1]=4 183 B8R1.5 NN1CCCCC1=O HR128047 [0,0,0,1,0,0|3,0,0]=4 184 B8R1.5 O=C1CCCCC1=O HR133849 [0,0,0,1,0,0|1,0,0]=2 185 B8R1.5 O=C1CCCCC1Br HR121776 [0,0,0,1,0,0|2,0,1]=4 186 B8R1.5 O=C1CCCCC1Cl HR133138 [0,0,0,1,0,0|2,0,1]=4 187 B8R1.5 O=C1CCCCC1F HR150360 [0,0,0,1,0,0|2,0,1]=4 188 B8R1.5 O=C1NCCCC1F HR149509 [0,0,0,1,0,0|2,0,1]=4 189 B8R1.5 O=C1NCCCC1O HR147038 [0,0,0,1,0,0|1,0,2]=4 190 B8R1.7 CC(=O)C1=CC=CO1 HR129914 [0,0,0,1,0,0|1,0,2]=4 191 B8R1.7 CC(=O)C1=CC=NO1 HR112153 [0,0,0,1,0,0|2,0,1]=4 192 B8R1.7 CC(=O)C1=NC=CO1 HR121608 [0,0,0,1,0,0|1,0,2]=4 193 B8R1.7 CC(=O)C1=NCCS1 HR130371 [0,0,0,1,0,0|1,1,0]=3 194 B8R1.7 CC(=O)C1CCCC1 HR120520 [0,0,0,1,0,0|2,0,1]=4 195 B8R1.7 O=C(O)C1CCCO1 HR129714 [0,0,0,1,0,0|2,0,1]=4 196 B8R1.7 O=C(O)C1CCCO1 HR135878 [0,0,0,1,0,0|2,0,1]=4 197 B8R1.7 O=C(O)C1CCCO1 HR136153 [0,0,0,1,0,0|2,0,1]=4 198 B8R1.18 C=C1CC(=O)OC1=O HR123885 [0,0,0,1,0,0|2,0,1]=4 199 B8R1.18 CC1=CC(=O)OC1=O HR122406 [0,0,0,1,0,0|2,0,1]=4 200 B8R1.18 CC1=NC(C)=C(C)O1 HR8636 [0,0,0,1,0,0|2,0,1]=4 201 B8R1.18 CC1=NC(C)OC1C HR128475 [0,0,0,1,0,0|2,0,1]=4 202 B8R1.18 CC1CC(=O)N(C)C1 HR102594 [0,0,0,1,0,0|3,0,0]=4 203 B8R1.18 O=C1O[V](=O)OC1=O HR101846 [0,0,0,1,0,0|3,0,0]=4 204 B8R1.19 CC1(C)CCCC1=O HR113458 [0,0,0,1,0,0|2,0,1]=4 205 B8R1.37 CCCC(=O)C1CC1 HR116824 [0,0,0,1,0,0|2,0,1]=4 206 B8R1.37 CCOC(=O)C1CC1 HR132331 [0,0,0,1,0,0|1,0,1]=3 207 B8R1.37 CCOC(=O)C1CO1 HR117347 [0,0,0,1,0,0|0,0,2]=3 208 B8R1.37 CCOC(=O)C1CO1 HR119319 [0,0,0,1,0,0|0,0,2]=3 209 B8R0.5 CC(C)OC(=O)OCCl HR138445 [0,0,0,0,0,1|2,0,1]=4 210 B8R0.5 CCOC(=O)C=C(C)C HR123584 [0,0,0,0,0,1|1,0,0]=2 211 B8R0.5 CCOC(=O)CC(=N)N HR111201 [0,0,0,0,0,1|2,0,0]=3 212 B8R0.5 CCOC(=O)CC(=O)Cl HR105395 [0,0,0,0,0,1|1,0,0]=2 213 B8R0.5 CCOC(=O)CC(=O)O HR125762 [0,0,0,0,0,1|1,0,0]=2 214 B8R0.5 CCOC(=O)CC(C)=O BRSA08315 [0,0,0,0,0,1|0,0,0]=1 215 B8R0.5 CCOC(=O)CC(C)=O HR134952 [0,0,0,0,0,1|0,0,0]=1 216 B8R0.5 CCOC(=O)CC(C)O HR103958 [0,0,0,0,0,1|0,0,2]=3 217 B8R0.5 CCOC(=O)CC(C)O HR115663 [0,0,0,0,0,1|0,0,2]=3 218 B8R0.5 CCOC(=O)CC(C)O HR126277 [0,0,0,0,0,1|0,0,2]=3 219 B8R0.5 CCOC(=O)CC(C)S HR114517 [0,0,0,0,0,1|0,1,1]=3 220 B8R0.5 CCOC(=O)CC(N)=O HR32504 [0,0,0,0,0,1|1,0,0]=2 221 B8R0.5 CCOC(=O)CC(N)=S HR111280 [0,0,0,0,0,1|1,1,0]=3 222 B8R0.5 CCOC(=O)CN(C)C HR135000 [0,0,0,0,0,1|2,0,0]=3 223 B8R0.5 CCOC(=O)C[N+](=O)[O-] HR125868 [0,0,0,0,0,1|2,0,0]=3 224 B8R0.5 CCOC(=O)OC(C)Cl HR127687 [0,0,0,0,0,1|1,0,1]=3 225 B8R0.5 CCOC(=O)OC(C)I HR138111 [0,0,0,0,0,1|1,0,1]=3 226 B8R0.5 CCOC(=O)\C=C(/C)N HR137824 [0,0,0,0,0,1|1,0,0]=2 227 B8R0.5 CCOC(=O)\C=C(\C)N HR122434 [0,0,0,0,0,1|1,0,0]=2 228 B8R0.5 CCOC(C)OC(C)=O HR121743 [0,0,0,0,0,1|1,0,1]=3 229 B8R0.5 COCC(=O)CC(C)=O HR134533 [0,0,0,0,0,1|2,0,0]=3 230 B5R0.1 C=C(C)OCC HR135003 [2,0,0,0,0,0|1,0,0]=3 231 B5R0.1 CC(=O)CCCl HR106274 [2,0,0,0,0,0|1,0,1]=4 232 B5R0.1 CC(=O)CCO HR131203 [2,0,0,0,0,0|1,0,1]=4 233 B5R0.1 CC(=O)NCO HR105862 [2,0,0,0,0,0|2,0,0]=4 234 B5R0.1 CC(=O)OC=O HR100841 [2,0,0,0,0,0|1,0,1]=4 235 B5R0.1 CC(=O)OCBr HR127457 [2,0,0,0,0,0|1,0,0]=3 236 B5R0.1 CC(=O)OCCl HR101207 [2,0,0,0,0,0|1,0,0]=3 237 B5R0.1 CC(=O)\C=N\O HR126710 [2,0,0,0,0,0|2,0,0]=4 238 B5R0.1 CC(C)=CCBr HR133883 [2,0,0,0,0,0|2,0,0]=4 239 B5R0.1 CC(C)=CCCl HR127820 [2,0,0,0,0,0|2,0,0]=4 240 B5R0.1 CC(C)=CCN HR114772 [2,0,0,0,0,0|2,0,0]=4 241 B5R0.1 CC(C)=CCO HR138609 [2,0,0,0,0,0|2,0,0]=4 242 B5R0.1 CC(C)=CCS HR143870 [2,0,0,0,0,0|2,0,0]=4 243 B5R0.1 CCCC(=O)Cl HR147587 [2,0,0,0,0,0|1,0,1]=4 244 B5R0.1 CCCC(=O)[O-] HR129884 [2,0,0,0,0,0|1,0,1]=4 245 B5R0.1 CCCC(=O)[O-] HR137474 [2,0,0,0,0,0|1,0,1]=4 246 B5R0.1 CCCC(N)=O HR137715 [2,0,0,0,0,0|1,0,1]=4 247 B5R0.1 CCNC(C)=O HR100775 [2,0,0,0,0,0|1,0,0]=3 248 B5R0.1 CCNC(N)=O HR126748 [2,0,0,0,0,0|2,0,0]=4 249 B5R0.1 CCOC(=N)N HR110036 [2,0,0,0,0,0|2,0,0]=4 250 B5R0.1 CCOC(=O)Cl IVSA07702 [2,0,0,0,0,0|1,0,0]=3 251 B5R0.1 CCOC(=S)[S-] HR127593 [2,0,0,0,0,0|0,2,0]=4 252 B5R0.1 CCOC(C)=N HR126641 [2,0,0,0,0,0|1,0,0]=3 253 B5R0.1 CCOC(N)=O HR123919 [2,0,0,0,0,0|1,0,0]=3 254 B5R0.1 CCSC(C)=O HR138399 [2,0,0,0,0,0|0,1,0]=3 255 B5R0.1 CCSC(C)=S HR129552 [2,0,0,0,0,0|0,2,0]=4 256 B5R0.1 COCC(=O)Cl HR138385 [2,0,0,0,0,0|1,0,1]=4 257 B5R0.1 COCC(=O)O HR137614 [2,0,0,0,0,0|1,0,1]=4 258 B5R0.1 COCC(C)=O HR124731 [2,0,0,0,0,0|0,0,1]=3 259 B5R0.1 CSCC(C)=O HR104929 [2,0,0,0,0,0|0,1,1]=4 260 B5R0.1 C\C=C\C(=O)Cl HR100850 [2,0,0,0,0,0|1,0,1]=4 261 B5R0.1 C\C=C\C(=O)Cl HR133043 [2,0,0,0,0,0|1,0,1]=4 262 B5R0.2 CCO\C=C\Br ATXF02514 [2,0,0,0,0,0|1,0,0]=3 263 B5R0.2 CC\C=C\C=O HR111713 [2,0,0,0,0,0|1,0,0]=3 264 B5R0.2 CC\C=C\C=O HR139459 [2,0,0,0,0,0|1,0,0]=3 265 B5R0.2 C\C=C\CCC HR121014 [2,0,0,0,0,0|1,0,0]=3 266 B5R0.2 C\C=C\OCC HR128979 [2,0,0,0,0,0|0,0,0]=2 267 B5R0.3 C#CC(=O)OC HR133415 [2,0,0,0,0,0|0,0,2]=4 268 B5R0.3 C=C(C=O)CC HR137788 [2,0,0,0,0,0|1,0,0]=3 269 B5R0.3 C=CC(=O)CBr HR146340 [2,0,0,0,0,0|1,0,1]=4 270 B5R0.3 C=CC(=O)CBr HR146362 [2,0,0,0,0,0|1,0,1]=4 271 B5R0.3 C=CC(=O)OC LECQ00902 [2,0,0,0,0,0|0,0,1]=3 272 B5R0.3 CCC(=O)CBr HR101618 [2,0,0,0,0,0|1,0,1]=4 273 B5R0.3 CCC(=O)NC HR138361 [2,0,0,0,0,0|1,0,0]=3 274 B5R0.3 CCC(=S)OC HR134757 [2,0,0,0,0,0|0,1,1]=4 275 B5R0.3 CCC(C)C=O HR108130 [2,0,0,0,0,0|1,0,1]=4 276 B5R0.3 CCS(=O)CC HR101279 [2,0,0,0,0,0|1,0,1]=4 277 B5R0.3 CNC(=O)CBr HR108109 [2,0,0,0,0,0|2,0,0]=4 278 B5R0.3 CNC(=O)NC HR124408 [2,0,0,0,0,0|2,0,0]=4 279 B5R0.3 COC(=N)OC HR100139 [2,0,0,0,0,0|2,0,0]=4 280 B5R0.3 COC(=O)C=O HR131069 [2,0,0,0,0,0|0,0,0]=2 281 B5R0.3 COC(=O)CBr HR147010 [2,0,0,0,0,0|1,0,1]=4 282 B5R0.3 COC(=O)CCl HR147665 [2,0,0,0,0,0|1,0,1]=4 283 B5R0.3 COC(=O)CF HR147087 [2,0,0,0,0,0|1,0,1]=4 284 B5R0.3 COC(=O)CN VAJB00904 [2,0,0,0,0,0|1,0,1]=4 285 B5R0.3 COC(=O)CO HR136159 [2,0,0,0,0,0|0,0,2]=4 286 B5R0.3 COC(=O)CS HR136418 [2,0,0,0,0,0|0,1,1]=4 287 B5R0.3 COC(=O)NN HR17404 [2,0,0,0,0,0|2,0,0]=4 288 B5R0.3 COS(=O)OC HR128367 [2,0,0,0,0,0|2,0,0]=4 289 B5R0.3 CO[PH](=O)OC HR135600 [2,0,0,0,0,0|2,0,0]=4 290 B5R0.3 C\C=C(\C)C=O HR112466 [2,0,0,0,0,0|1,0,1]=4 291 B5R0.3 C\C=C(\C)C=O HR139746 [2,0,0,0,0,0|1,0,1]=4 292 B5R0.5 C=C(C)C(=O)Cl HR138689 [2,0,0,0,0,0|2,0,0]=4 293 B5R0.5 C=C(C)C(=O)[O-] HR113778 [2,0,0,0,0,0|1,0,1]=4 294 B5R0.5 C=C(C)C(=O)[O-] HR114122 [2,0,0,0,0,0|1,0,1]=4 295 B5R0.5 C=C(C)C(=O)[O-] HR121033 [2,0,0,0,0,0|1,0,1]=4 296 B5R0.5 C=C(C)C(=O)[O-] HR122305 [2,0,0,0,0,0|1,0,1]=4 297 B5R0.5 C=C(C)C(=O)[O-] HR125115 [2,0,0,0,0,0|1,0,1]=4 298 B5R0.5 C=C(C)C(=O)[O-] HR135365 [2,0,0,0,0,0|1,0,1]=4 299 B5R0.5 C=C(C)C(N)=O HR124465 [2,0,0,0,0,0|2,0,0]=4 300 B5R0.5 C=C(Cl)C(=O)O HR132918 [2,0,0,0,0,0|1,0,1]=4 301 B5R0.5 C=C(N)C(=O)O HR106545 [2,0,0,0,0,0|1,0,1]=4 302 B5R0.5 CC(=O)C(=O)O HR137803 [2,0,0,0,0,0|0,0,0]=2 303 B5R0.5 CC(=O)C(=O)[O-] HR112958 [2,0,0,0,0,0|0,0,1]=3 304 B5R0.5 CC(=O)C(=O)[O-] HR125137 [2,0,0,0,0,0|0,0,1]=3 305 B5R0.5 CC(=O)C(=O)[O-] HR130480 [2,0,0,0,0,0|0,0,1]=3 306 B5R0.5 CC(=O)C(=O)[O-] HR132795 [2,0,0,0,0,0|0,0,1]=3 307 B5R0.5 CC(=O)C(C)=O HR147207 [2,0,0,0,0,0|0,0,0]=2 308 B5R0.5 CC(=O)C(C)Br HR130439 [2,0,0,0,0,0|1,0,1]=4 309 B5R0.5 CC(=O)C(C)C HR147367 [2,0,0,0,0,0|1,0,1]=4 310 B5R0.5 CC(=O)C(C)Cl HR132014 [2,0,0,0,0,0|1,0,1]=4 311 B5R0.5 CC(=O)C(C)S HR123296 [2,0,0,0,0,0|0,1,1]=4 312 B5R0.5 CC(=O)N(C)C HR128416 [2,0,0,0,0,0|2,0,0]=4 313 B5R0.5 CC(Br)C(=O)O HR118834 [2,0,0,0,0,0|1,0,1]=4 314 B5R0.5 CC(Br)C(=O)O HR119145 [2,0,0,0,0,0|1,0,1]=4 315 B5R0.5 CC(Cl)C(=O)O HR133703 [2,0,0,0,0,0|1,0,1]=4 316 B5R0.5 CC(Cl)C(=O)O HR5746 [2,0,0,0,0,0|1,0,1]=4 317 B5R0.5 CC(F)C(=O)O HR125319 [2,0,0,0,0,0|1,0,1]=4 318 B5R0.5 CC(N)C(=O)O HR127064 [2,0,0,0,0,0|1,0,1]=4 319 B5R0.5 CC(N)C(=O)O HR128842 [2,0,0,0,0,0|1,0,1]=4 320 B5R0.5 CC(N)C(=O)O HR135609 [2,0,0,0,0,0|1,0,1]=4 321 B5R0.5 CC(N)C(=O)O HR143449 [2,0,0,0,0,0|1,0,1]=4 322 B5R0.5 CC(N)[13C](=O)O HR144974 [2,0,0,0,0,0|1,0,1]=4 323 B5R0.5 CC(O)C(=O)O HR122637 [2,0,0,0,0,0|0,0,2]=4 324 B5R0.5 CC(O)C(=O)O HR124397 [2,0,0,0,0,0|0,0,2]=4 325 B5R0.5 CC(O)C(=O)O HR137557 [2,0,0,0,0,0|0,0,2]=4 326 B5R0.5 C[13CH](N)C(=O)O HR143521 [2,0,0,0,0,0|1,0,1]=4 327 B5R0.5 NC(=O)C(N)=O HR106809 [2,0,0,0,0,0|2,0,0]=4 328 B5R0.5 O=C(Cl)C(=O)Cl TIJL03003 [2,0,0,0,0,0|2,0,0]=4 329 B5R0.5 O=C(O)C(=O)O HR123261 [2,0,0,0,0,0|1,0,0]=3 330 B5R0.5 O=C([O-])C(=O)O HR136858 [2,0,0,0,0,0|1,0,0]=3 331 B5R0.5 O=C([O-])C(=O)[O-] HR100686 [2,0,0,0,0,0|1,0,1]=4 332 B5R0.5 O=C([O-])C(=O)[O-] HR100962 [2,0,0,0,0,0|1,0,1]=4 333 B5R0.5 O=C([O-])C(=O)[O-] HR101005 [2,0,0,0,0,0|1,0,1]=4 334 B5R0.5 O=C([O-])C(=O)[O-] HR102573 [2,0,0,0,0,0|1,0,1]=4 335 B5R0.5 O=C([O-])C(=O)[O-] HR110849 [2,0,0,0,0,0|1,0,1]=4 336 B5R0.5 O=C([O-])C(=O)[O-] HR128357 [2,0,0,0,0,0|1,0,1]=4 337 B5R0.5 O=C([O-])C(=O)[O-] HR129686 [2,0,0,0,0,0|1,0,1]=4 338 B5R0.5 O=C([O-])C(=O)[O-] HR129949 [2,0,0,0,0,0|1,0,1]=4 339 B5R0.5 O=C([O-])C(=O)[O-] HR132963 [2,0,0,0,0,0|1,0,1]=4 340 B5R0.5 O=C([O-])C(=O)[O-] HR134379 [2,0,0,0,0,0|1,0,1]=4 341 B5R0.5 O=C([O-])C(=O)[O-] HR136084 [2,0,0,0,0,0|1,0,1]=4 342 B5R0.5 O=C([O-])C(=O)[O-] HR136170 [2,0,0,0,0,0|1,0,1]=4 343 B5R0.5 O=C([O-])C(=O)[O-] HR136344 [2,0,0,0,0,0|1,0,1]=4 344 B5R0.5 O=C([O-])C(=O)[O-] HR136431 [2,0,0,0,0,0|1,0,1]=4 345 B5R0.5 O=C([O-])C(=O)[O-] HR136606 [2,0,0,0,0,0|1,0,1]=4 346 B5R0.5 O=C([O-])C(=O)[O-] HR136689 [2,0,0,0,0,0|1,0,1]=4 347 B5R0.5 O=C([O-])C(=O)[O-] HR136946 [2,0,0,0,0,0|1,0,1]=4 348 B5R0.5 O=C([O-])C(=O)[O-] HR138096 [2,0,0,0,0,0|1,0,1]=4 349 B5R0.5 O=C([O-])C(=O)[O-] HR138340 [2,0,0,0,0,0|1,0,1]=4 350 B5R0.5 [13CH3]C(N)C(=O)O HR141384 [2,0,0,0,0,0|1,0,1]=4 351 B5R0.5 [13CH3]C(N)C(=O)O HR144202 [2,0,0,0,0,0|1,0,1]=4 352 B7R0.2 C=CC(=O)NC(C)C HR138308 [1,1,0,0,0,0|1,0,1]=4 353 B7R0.2 CC(C)OC(=O)CN HR105079 [1,1,0,0,0,0|1,0,1]=4 354 B7R0.2 CC(C)OC(=O)CN HR117760 [1,1,0,0,0,0|1,0,1]=4 355 B7R0.2 CC(C)OC(=O)CO HR105901 [1,1,0,0,0,0|0,0,2]=4 356 B7R0.2 COC(=O)CC(C)N HR119861 [1,1,0,0,0,0|2,0,0]=4 357 B7R0.2 COC(=O)CC(C)N HR143484 [1,1,0,0,0,0|2,0,0]=4 358 B7R0.2 COC(=O)CC(C)O HR138815 [1,1,0,0,0,0|2,0,0]=4 359 B7R0.2 CSC(=O)CC(C)C HR122226 [1,1,0,0,0,0|2,0,0]=4 360 B7R0.3 C=CC(=O)OCCC HR144889 [1,1,0,0,0,0|0,0,1]=3 361 B7R0.3 C=CC(=O)OCCO HR125757 [1,1,0,0,0,0|0,0,1]=3 362 B7R0.3 C=CCOC(=O)C=C HR107303 [1,1,0,0,0,0|0,0,2]=4 363 B7R0.3 CCCOC(=O)CC HR127273 [1,1,0,0,0,0|0,0,1]=3 364 B7R0.3 COC(=O)CCCBr HR134912 [1,1,0,0,0,0|2,0,0]=4 365 B7R0.3 COC(=O)CCCCl HR131361 [1,1,0,0,0,0|2,0,0]=4 366 B7R0.3 COC(=O)CCCN HR105959 [1,1,0,0,0,0|2,0,0]=4 367 B7R0.3 COCCC(=O)OC HR130750 [1,1,0,0,0,0|2,0,0]=4 368 B7R0.7 C=C(OCC)OCC IVSA07713 [1,1,0,0,0,0|1,0,1]=4 369 B7R0.7 C=C=CC(=O)OCC HR108306 [1,1,0,0,0,0|0,0,1]=3 370 B7R0.7 C=COC(=O)\C=C\C HR129020 [1,1,0,0,0,0|0,0,2]=4 371 B7R0.7 CC#CC(=O)OCC HR127977 [1,1,0,0,0,0|0,0,1]=3 372 B7R0.7 CCCC(=O)OCCl HR123267 [1,1,0,0,0,0|1,0,1]=4 373 B7R0.7 CCCC(=S)OCC HR130469 [1,1,0,0,0,0|0,1,1]=4 374 B7R0.7 CCCC(=S)OCC HR143387 [1,1,0,0,0,0|0,1,1]=4 375 B7R0.7 CCNC(=O)NCC HR128759 [1,1,0,0,0,0|1,0,1]=4 376 B7R0.7 CCOC(=O)CCBr HR132284 [1,1,0,0,0,0|0,0,1]=3 377 B7R0.7 CCOC(=O)CCCl HR147079 [1,1,0,0,0,0|0,0,1]=3 378 B7R0.7 CCOC(=O)CCI HR101944 [1,1,0,0,0,0|0,0,1]=3 379 B7R0.7 CCOC(=O)CCN HR129110 [1,1,0,0,0,0|0,0,1]=3 380 B7R0.7 CCOC(=O)CCS HR135162 [1,1,0,0,0,0|0,0,1]=3 381 B7R0.7 CCOC(=O)CNC HR138266 [1,1,0,0,0,0|0,0,1]=3 382 B7R0.7 CCOC(=O)CNN HR128003 [1,1,0,0,0,0|1,0,1]=4 383 B7R0.7 CCOC(=O)COC HR123443 [1,1,0,0,0,0|0,0,1]=3 384 B7R0.7 CCOC(=O)N=C=S FISA07802 [1,1,0,0,0,0|0,1,1]=4 385 B7R0.7 CCOC(=O)OCCl HR138904 [1,1,0,0,0,0|1,0,0]=3 386 B7R0.7 CCOC(=O)\C=C\I HR11670 [1,1,0,0,0,0|0,0,1]=3 387 B7R0.7 CCOS(=O)OCC HR101466 [1,1,0,0,0,0|1,0,1]=4 388 B7R0.7 CCO[PH](=O)OCC HR109664 [1,1,0,0,0,0|1,0,1]=4 389 B7R0.7 [C-]#[N+]CC(=O)OCC HR146955 [1,1,0,0,0,0|0,0,2]=4 390 B7R0.10 CCC(=O)C(=O)CC HR122518 [1,1,0,0,0,0|1,0,1]=4 391 B7R0.10 CCC(Br)C(=O)OC HR123363 [1,1,0,0,0,0|2,0,0]=4 392 B7R0.10 CCC(C)C(=O)OC HR133876 [1,1,0,0,0,0|2,0,0]=4 393 B7R0.10 CCC(C)C(=O)OC HR143721 [1,1,0,0,0,0|2,0,0]=4 394 B7R0.10 CCC(C)C(=O)SC HR105243 [1,1,0,0,0,0|2,0,0]=4 395 B7R0.10 CCC(O)C(=O)OC HR144357 [1,1,0,0,0,0|2,0,0]=4 396 B7R0.14 COC(=O)C(C)(C)Br HR124478 [1,1,0,0,0,0|1,0,1]=4 397 B7R0.14 COC(=O)C(C)(C)F HR126418 [1,1,0,0,0,0|1,0,1]=4 398 B7R0.14 COC(=O)C(C)(C)N HR16472 [1,1,0,0,0,0|1,0,1]=4 399 B7R0.14 COC(=O)C(C)(C)O HR132026 [1,1,0,0,0,0|0,0,2]=4 400 B7R0.14 COC(=O)C(C)(C)S HR144548 [1,1,0,0,0,0|0,1,1]=4 401 B7R0.15 COC(OC)C(C)=O HR9977 [1,1,0,0,0,0|0,0,2]=4 402 B7R0.16 C=C(C)C(=O)N(C)C HR143638 [1,1,0,0,0,0|2,0,0]=4 403 B7R0.16 CC(=O)C(=O)C(C)C HR141113 [1,1,0,0,0,0|0,0,0]=2 404 B7R0.16 CC(C)C(=O)C(=O)O HR136485 [1,1,0,0,0,0|1,0,0]=3 405 B7R0.16 CC(C)C(=O)C(=O)[O-] HR127707 [1,1,0,0,0,0|1,0,0]=3 406 B7R0.16 CC(C)C(=O)C(=O)[O-] HR137721 [1,1,0,0,0,0|1,0,0]=3 407 B7R0.16 CC(O)C(=O)N(C)C HR100956 [1,1,0,0,0,0|2,0,0]=4 408 B7R0.16 CN(C)C(=O)C(=O)O HR118982 [1,1,0,0,0,0|2,0,0]=4 409 B7R0.16 CN(C)C(=O)C(N)=O HR128536 [1,1,0,0,0,0|2,0,0]=4 410 B7R0.4 CC(=O)CCCCBr HR125447 [1,1,0,0,0,0|1,0,1]=4 411 B7R0.4 CC(=O)CCCCCl HR124124 [1,1,0,0,0,0|1,0,1]=4 412 B7R0.4 CC(=O)OCCCCl HR130837 [1,1,0,0,0,0|2,0,0]=4 413 B7R0.4 CCC\C=C\C(C)=O HR30170 [1,1,0,0,0,0|1,0,0]=3 414 B7R0.4 CCOCC=C(C)C HR111947 [1,1,0,0,0,0|1,0,0]=3 415 B7R0.4 CCO[SiH2]C=C(C)C HR136449 [1,1,0,0,0,0|1,0,0]=3 416 B7R0.4 CCO\C=C\C(=O)Cl HR144705 [1,1,0,0,0,0|1,0,0]=3 417 B7R0.4 CCO\C=C\C(=O)O HR20958 [1,1,0,0,0,0|1,0,0]=3 418 B7R0.4 CC\C=C\CC(=O)O HR109903 [1,1,0,0,0,0|2,0,0]=4 419 B7R0.4 NC(=O)COCCCl HR115417 [1,1,0,0,0,0|1,0,1]=4 420 B7R0.4 O=C(O)COCCCl HR100767 [1,1,0,0,0,0|1,0,1]=4 421 B7R0.6 CC(=O)COC(C)=O HR123551 [1,1,0,0,0,0|0,0,2]=4 422 B7R0.6 CC(=O)\C=C\C(C)C HR142759 [1,1,0,0,0,0|1,0,0]=3 423 B7R0.6 CC(C)\C=C\C(=O)[O-] HR107648 [1,1,0,0,0,0|2,0,0]=4 424 B9R0.4 C=CCOC(=O)CC(C)=O HR126314 [0,1,0,0,0,1|0,0,1]=3 425 B9R0.4 CCCOC(=O)CC(C)C HR123585 [0,1,0,0,0,1|1,0,1]=4 426 B9R0.4 CCOCC(C)OC(C)=O HR111309 [0,1,0,0,0,1|1,0,1]=4 427 B9R0.6 CCOC(=O)C(=O)C(C)C HR140341 [0,1,0,0,0,1|1,0,1]=4 428 B9R0.6 CCOC(=O)C(Br)C(C)=O HR141243 [0,1,0,0,0,1|0,0,0]=2 429 B9R0.6 CCOC(=O)C(Br)C(C)C HR124370 [0,1,0,0,0,1|1,0,1]=4 430 B9R0.6 CCOC(=O)C(C)C(C)=O HR122775 [0,1,0,0,0,1|0,0,0]=2 431 B9R0.6 CCOC(=O)C(Cl)C(C)=O HR134430 [0,1,0,0,0,1|0,0,0]=2 432 B9R0.6 CCOC(=O)C(F)C(C)=O HR131178 [0,1,0,0,0,1|0,0,0]=2 433 B9R0.6 CCOC(=O)C(N)C(C)=O HR148536 [0,1,0,0,0,1|0,0,0]=2 434 B9R0.6 CCOC(=O)C(N)C(C)C HR129467 [0,1,0,0,0,1|1,0,1]=4 435 B9R0.6 CCOC(=O)C(N)C(C)C HR139476 [0,1,0,0,0,1|1,0,1]=4 436 B9R0.6 CCOC(=O)C(N)C(C)O HR117025 [0,1,0,0,0,1|0,0,2]=4 437 B9R0.6 CCOC(=O)C(O)C(C)C HR145867 [0,1,0,0,0,1|1,0,1]=4 438 B9R0.34 CCCC(=O)CC(=O)OC HR142969 [0,1,0,0,0,1|1,0,0]=3 439 B9R0.34 CCOC(=O)CC(=O)CBr HR133762 [0,1,0,0,0,1|0,0,0]=2 440 B9R0.34 CCOC(=O)CC(=O)CC HR131188 [0,1,0,0,0,1|0,0,0]=2 441 B9R0.34 CCOC(=O)CC(=O)CCl HR124896 [0,1,0,0,0,1|0,0,0]=2 442 B9R0.34 CCOC(=O)CC(=O)NC HR125174 [0,1,0,0,0,1|0,0,0]=2 443 B9R0.34 CCOC(=O)CC(C)CC HR102263 [0,1,0,0,0,1|1,0,1]=4 444 B9R0.34 CCOC(=O)CC(O)CBr HR123965 [0,1,0,0,0,1|0,0,2]=4 445 B9R0.34 CCOC(=O)CC(O)CBr HR124224 [0,1,0,0,0,1|0,0,2]=4 446 B9R0.34 CCOC(=O)CC(O)CCl HR107822 [0,1,0,0,0,1|0,0,2]=4 447 B9R0.34 CCOC(=O)CC(O)CCl HR123432 [0,1,0,0,0,1|0,0,2]=4 448 B9R0.34 CCOC(=O)CC(O)CCl HR123697 [0,1,0,0,0,1|0,0,2]=4 449 B9R0.34 CCOC(=O)\C=C(/C)CBr PEJL03409 [0,1,0,0,0,1|1,0,0]=3 450 B9R0.34 CCOC(=O)\C=C(\C)C=O HR121055 [0,1,0,0,0,1|0,0,0]=2 451 B9R0.34 COCC(=O)CC(=O)OC CAJB01105 [0,1,0,0,0,1|2,0,0]=4 452 B9R0.44 CCOC(=O)CC(C)(C)N HR148568 [0,1,0,0,0,1|1,0,1]=4 453 B9R0.44 CCOC(=O)CS(C)(=O)=O HR143635 [0,1,0,0,0,1|1,0,0]=3 454 B9R0.44 CCOC(=O)C[Si](C)(C)C HR110962 [0,1,0,0,0,1|1,1,0]=4 455 B9R0.53 C=C(OC(C)=O)OC(C)=O HR101781 [0,1,0,0,0,1|1,0,1]=4 456 B9R0.53 CC(=O)CC(=O)CC(C)C HR120010 [0,1,0,0,0,1|1,0,0]=3 457 B9R0.53 CC(=O)CC(=O)OC(C)C HR133707 [0,1,0,0,0,1|0,0,0]=2 458 B9R0.53 CC(C)OC(=O)OC(C)Cl HR127414 [0,1,0,0,0,1|1,0,1]=4 459 B9R0.53 CC(C)OC(=O)OC(C)I HR138639 [0,1,0,0,0,1|1,0,1]=4 460 B9R0.53 C\C(N)=C/C(=O)OC(C)C HR138074 [0,1,0,0,0,1|1,0,0]=3 461 B9R0.8 CCCOC(=O)C(C)CC HR142970 [0,2,0,0,0,0|1,0,1]=4 462 B9R0.8 C\C=C(\C)C(=O)OCCC HR129262 [0,2,0,0,0,0|1,0,0]=3 463 B9R0.19 CCOC(=O)C(F)(F)CN HR108205 [0,2,0,0,0,0|1,0,1]=4 464 B9R0.35 C=CCC(C)C(=O)OCC HR139572 [0,2,0,0,0,0|1,0,1]=4 465 B9R0.35 CCCC(=O)C(=O)OCC HR137737 [0,2,0,0,0,0|0,0,0]=2 466 B9R0.35 CCCC(Br)C(=O)OCC HR135641 [0,2,0,0,0,0|1,0,1]=4 467 B9R0.35 CCCC(C)C(=O)OCC HR130749 [0,2,0,0,0,0|1,0,1]=4 468 B9R0.35 CCCC(N)C(=O)OCC HR128528 [0,2,0,0,0,0|1,0,1]=4 469 B9R0.35 CCOC(=N)C(=O)OCC HR139134 [0,2,0,0,0,0|1,0,0]=3 470 B9R0.35 CCOC(=O)C(=O)OCC ELXM01907 [0,2,0,0,0,0|0,0,0]=2 471 B9R0.35 CCOC(=O)C(Br)CCBr HR138648 [0,2,0,0,0,0|1,0,1]=4 472 B9R0.35 CCOC(=O)C(Cl)OCC HR113792 [0,2,0,0,0,0|1,0,1]=4 473 B9R0.35 C\C=C\C(C)C(=O)OCC HR100631 [0,2,0,0,0,0|1,0,1]=4 474 B9R0.37 CCOC(=O)C(C#N)CC HR104781 [0,2,0,0,0,0|1,0,1]=4 475 B9R0.37 CCOC(=O)C(C=O)C=O HR103719 [0,2,0,0,0,0|0,0,2]=4 476 B9R0.37 CCOC(=O)C(CO)CO HR117038 [0,2,0,0,0,0|0,0,2]=4 477 B9R0.37 CCOC(=O)\C(C#N)=N/O HR21633 [0,2,0,0,0,0|0,0,2]=4 478 B9R0.7 C=C(C)C(=O)NCC(C)O HR135174 [0,2,0,0,0,0|2,0,0]=4 479 B9R0.7 C=C(C)C(=O)OCC(C)O HR136407 [0,2,0,0,0,0|1,0,0]=3 480 B9R0.7 CC(C)COC(=O)C(C)O HR129672 [0,2,0,0,0,0|0,0,2]=4 481 B9R0.47 C=C(C)C(=O)NCCCN HR120835 [0,2,0,0,0,0|2,0,0]=4 482 B9R0.47 C=C(C)C(=O)OCCOC HR129605 [0,2,0,0,0,0|1,0,0]=3 483 B9R0.47 CCCCOC(=O)C(C)=O HR124899 [0,2,0,0,0,0|0,0,0]=2 484 B9R0.47 CCCCOC(=O)C(C)C HR144880 [0,2,0,0,0,0|1,0,1]=4 485 B9R0.47 CCCCOC(=O)C(C)O HR123058 [0,2,0,0,0,0|0,0,2]=4 486 B9R0.10 CC(C)OC(=O)C(C)(C)Br ELSA04704 [0,2,0,0,0,0|1,0,1]=4 487 B9R0.57 C=C(C)C(=O)OC(C)(C)C HR128537 [0,2,0,0,0,0|1,0,0]=3 488 B9R0.57 CC(Br)C(=O)OC(C)(C)C HR114562 [0,2,0,0,0,0|1,0,1]=4 489 B9R0.57 CC(C)(C)CC(=O)C(=O)O HR106255 [0,2,0,0,0,0|2,0,0]=4 490 B9R0.57 CC(N)C(=O)OC(C)(C)C HR127921 [0,2,0,0,0,0|1,0,1]=4 491 B9R0.57 CC(N)C(=O)OC(C)(C)C HR135956 [0,2,0,0,0,0|1,0,1]=4 492 B9R0.57 CN(C)C(=O)OC(C)(C)C HR141508 [0,2,0,0,0,0|2,0,0]=4 493 B9R0.57 CN(N)C(=O)OC(C)(C)C HR16950 [0,2,0,0,0,0|2,0,0]=4 494 B7R1.1 CCC1=NCCO1 HR131444 [1,0,0,1,0,0|1,0,1]=4 495 B7R1.1 O=CC1CCCO1 HR106351 [1,0,0,1,0,0|1,0,1]=4 496 B7R1.2 CC1CCC(=O)O1 HR126256 [1,0,0,1,0,0|0,0,1]=3 497 B7R1.2 CC1CNC(=O)C1 HR146359 [1,0,0,1,0,0|2,0,0]=4 498 B7R1.2 CC1CNC(=O)C1 HR146360 [1,0,0,1,0,0|2,0,0]=4 499 B7R1.2 CC1CNC(=O)C1 HR146369 [1,0,0,1,0,0|2,0,0]=4 500 B7R1.2 CC1COC(=O)O1 HR125363 [1,0,0,1,0,0|1,0,0]=3 501 B7R1.2 CC1COC(=O)O1 HR128407 [1,0,0,1,0,0|1,0,0]=3 502 B7R1.2 CC1COC(=O)O1 HR129273 [1,0,0,1,0,0|1,0,0]=3 503 B7R1.2 O=C1OCC(Cl)O1 HR123970 [1,0,0,1,0,0|2,0,0]=4 504 B7R1.2 O=C1OCC(F)O1 HR135652 [1,0,0,1,0,0|2,0,0]=4 505 B7R1.3 BrC1=CCCCC1 HR156605 [1,0,0,1,0,0|2,0,0]=4 506 B7R1.3 CC1=CCCCC1 HR143913 [1,0,0,1,0,0|2,0,0]=4 507 B7R1.3 ClC1=CCCCC1 HR129641 [1,0,0,1,0,0|2,0,0]=4 508 B7R1.3 O=C1C=CCCC1 HR146309 [1,0,0,1,0,0|1,0,1]=4 509 B7R1.3 O=C1CCCCC1 SIJL01002 [1,0,0,1,0,0|1,0,1]=4 510 B7R1.3 O=C1CCCCN1 HR126393 [1,0,0,1,0,0|1,0,1]=4 511 B7R1.3 O=C1CCCCO1 HR128412 [1,0,0,1,0,0|0,0,1]=3 512 B7R1.3 O=C1CNCCO1 HR30209 [1,0,0,1,0,0|1,0,1]=4 513 B7R1.3 O=C1COCCO1 HR127683 [1,0,0,1,0,0|0,0,2]=4 514 B7R1.3 O=C1NCCCN1 HR123216 [1,0,0,1,0,0|2,0,0]=4 515 B7R1.3 O=S1OCCCO1 HR134327 [1,0,0,1,0,0|2,0,0]=4 516 B7R1.4 C=C1CCOC1=O HR130328 [1,0,0,1,0,0|0,0,1]=3 517 B7R1.4 CC1=C(S)CCO1 HR124755 [1,0,0,1,0,0|1,1,0]=4 518 B7R1.4 CC1=CCCC1=O HR114448 [1,0,0,1,0,0|1,0,1]=4 519 B7R1.4 CC1CCCC1=O HR112329 [1,0,0,1,0,0|1,0,1]=4 520 B7R1.4 CC1CCNC1=O HR103871 [1,0,0,1,0,0|1,0,1]=4 521 B7R1.4 CC1OCCC1=O HR131028 [1,0,0,1,0,0|1,0,1]=4 522 B7R1.4 CN1CCCC1=O HR130754 [1,0,0,1,0,0|2,0,0]=4 523 B7R1.4 CN1CCOC1=O HR132150 [1,0,0,1,0,0|1,0,0]=3 524 B7R1.4 NC1CCOC1=O HR103069 [1,0,0,1,0,0|1,0,1]=4 525 B7R1.4 NC1CCOC1=O HR134625 [1,0,0,1,0,0|1,0,1]=4 526 B7R1.4 NC1CCOC1=O HR137954 [1,0,0,1,0,0|1,0,1]=4 527 B7R1.4 NC1CCOC1=O HR146738 [1,0,0,1,0,0|1,0,1]=4 528 B7R1.4 NN1CCOC1=O HR146108 [1,0,0,1,0,0|2,0,0]=4 529 B7R1.4 O=C1CCC=C1O HR148600 [1,0,0,1,0,0|1,0,1]=4 530 B7R1.4 O=C1OCC=C1Br HR102966 [1,0,0,1,0,0|1,0,1]=4 531 B7R1.4 O=C1OCCC1Br HR10714 [1,0,0,1,0,0|1,0,1]=4 532 B7R1.4 O=C1O[Cu]OC1=O HR101666 [1,0,0,1,0,0|2,0,0]=4 533 B7R1.4 O=C1O[SnH2]OC1=O HR138079 [1,0,0,1,0,0|2,0,0]=4 534 B7R1.22 CCC(=O)C1CC1 HR104134 [1,0,0,1,0,0|1,0,1]=4 535 B7R1.22 COC(=O)C1CC1 HR128125 [1,0,0,1,0,0|2,0,0]=4 536 B7R1.18 CC(=O)C1CCC1 HR143826 [1,0,0,1,0,0|1,0,1]=4 537 B9R1.34 CC1CC(=O)CC(=O)C1 HR14279 [0,0,0,1,0,1|1,0,0]=3 538 B9R1.34 CC1CC(=O)CC(C)O1 HR111074 [0,0,0,1,0,1|1,0,1]=4 539 B9R1.41 CC(=O)C1CCCC1=O HR144598 [0,0,0,1,0,1|1,0,0]=3 540 B9R1.41 CC(=O)C1CCOC1=O HTXM01002 [0,0,0,1,0,1|0,0,0]=2 541 B9R1.41 CC(=O)N1C=COC1=O HR111374 [0,0,0,1,0,1|0,0,2]=4 542 B9R1.41 CC(=O)N1CCNC1=O HR132352 [0,0,0,1,0,1|1,0,0]=3 543 B9R1.41 O=C(Cl)N1CCNC1=O HR132102 [0,0,0,1,0,1|2,0,0]=4 544 B9R1.41 O=C(O)C1CCCC1=O HR109477 [0,0,0,1,0,1|2,0,0]=4 545 B9R1.48 O=C1CCCCC(=O)C1 HR20261 [0,0,0,1,0,1|1,0,0]=3 546 B9R1.66 CC1(O)CCOC(=O)C1 HR123601 [0,0,0,1,0,1|0,0,2]=4 547 B9R1.75 CCOC(=O)CC1CC1 HR119908 [0,0,0,1,0,1|1,0,1]=4 548 B9R1.137 CC(=O)CC(=O)C1CC1 HR144451 [0,0,0,1,0,1|1,0,0]=3 549 B9R1.3 CC1C(=O)CCCC1=O HR133563 [0,1,0,1,0,0|1,0,1]=4 550 B9R1.37 CC1=C(O)C(=O)C(C)O1 HR128379 [0,1,0,1,0,0|2,0,0]=4 551 B9R1.37 CC1=C(O)C(=O)OC1C HR132334 [0,1,0,1,0,0|0,0,1]=3 552 B9R1.37 CC1CC(=O)C(=O)C1C HR124020 [0,1,0,1,0,0|1,0,0]=3 553 B9R1.132 CCC1=C(O)C(=O)CC1 HR124889 [0,1,0,1,0,0|1,0,1]=4 554 B9R1.11 COC(=O)C1CCCO1 HR126735 [0,1,0,1,0,0|1,0,1]=4 555 B9R1.33 CCOC1=C(C)N=CO1 HR8651 [0,1,0,1,0,0|1,0,1]=4 556 B9R1.73 CCOC(=O)C1CCC1 HR127166 [0,1,0,1,0,0|1,0,1]=4 557 B9R1.73 CCOC(=O)C1CNC1 HR139224 [0,1,0,1,0,0|1,0,1]=4 558 B9R1.74 CCOC(=O)C1(C)CC1 HR109932 [0,1,0,1,0,0|1,0,1]=4 559 B9R1.74 CCOC(=O)C1(N)CC1 HR14733 [0,1,0,1,0,0|1,0,1]=4 560 B9R1.6 CC(=O)C1=CCCCC1 HR138989 [0,1,0,1,0,0|2,0,0]=4 561 B9R1.36 CC1SC(C)(C)OC1=O HR110633 [0,1,0,1,0,0|0,1,1]=4 562 B9R0.48 CCNC(=O)\C=C\C(=O)O HR104340 [0,0,0,0,0,2|2,0,0]=4 563 B9R0.48 CCOC(=O)CCC(=O)Cl HR129703 [0,0,0,0,0,2|1,0,0]=3 564 B9R0.48 CCOC(=O)CCC(=O)[O-] HR131805 [0,0,0,0,0,2|1,0,0]=3 565 B9R0.48 CCOC(=O)CCC(C)=O HR131025 [0,0,0,0,0,2|0,0,0]=2 566 B9R0.48 CCOC(=O)CCC(C)Cl HR102899 [0,0,0,0,0,2|1,0,1]=4 567 B9R0.48 CCOC(=O)CC[N+](=O)[O-] HR32204 [0,0,0,0,0,2|2,0,0]=4 568 B9R0.48 CCOC(=O)CNC(C)=O HR137968 [0,0,0,0,0,2|0,0,0]=2 569 B9R0.48 CCOC(=O)\C=C\C(=O)Cl HR144452 [0,0,0,0,0,2|1,0,0]=3 570 B9R0.48 CCOC(=O)\C=C\C(=O)[O-] HR129266 [0,0,0,0,0,2|1,0,0]=3 571 B9R0.48 CCOC(=O)\C=C\C(C)=O HR117323 [0,0,0,0,0,2|0,0,0]=2 572 B9R0.48 CCOC(=O)\C=C\N(C)C HR137200 [0,0,0,0,0,2|2,0,0]=4