0 B5R0.1 C#CCC(=O)O HR107056 [0,0,0,0,0,0|1,0,3]=4 1 B5R0.1 C=C(C)CCO HR139358 [0,0,0,0,0,0|2,0,2]=4 2 B5R0.1 C=C(C)C[Mg]Cl HR118348 [0,0,0,0,0,0|3,0,1]=4 3 B5R0.1 C=C(C)OCC HR135003 [0,0,0,0,0,0|2,0,1]=3 4 B5R0.1 C=C(C)\C=C\[AlH3] HR142674 [0,0,0,0,0,0|2,0,0]=2 5 B5R0.1 C=CCC(=O)O HR124911 [0,0,0,0,0,0|1,0,2]=3 6 B5R0.1 C=CCC(C)O HR101482 [0,0,0,0,0,0|0,0,4]=4 7 B5R0.1 C=CCC(C)O HR144395 [0,0,0,0,0,0|0,0,4]=4 8 B5R0.1 C=CCN(C)C HR103500 [0,0,0,0,0,0|2,0,2]=4 9 B5R0.1 C=CC[SiH](C)C HR121456 [0,0,0,0,0,0|1,1,2]=4 10 B5R0.1 C=CNC(C)=O HR112565 [0,0,0,0,0,0|1,0,1]=2 11 B5R0.1 C=COC(C)C HR122658 [0,0,0,0,0,0|2,0,2]=4 12 B5R0.1 CC#CC(=O)O HR16226 [0,0,0,0,0,0|1,0,2]=3 13 B5R0.1 CC(=O)CCCl HR106274 [0,0,0,0,0,0|1,0,2]=3 14 B5R0.1 CC(=O)CCO HR131203 [0,0,0,0,0,0|1,0,2]=3 15 B5R0.1 CC(=O)NCO HR105862 [0,0,0,0,0,0|2,0,1]=3 16 B5R0.1 CC(=O)OC=O HR100841 [0,0,0,0,0,0|2,0,0]=2 17 B5R0.1 CC(=O)OCBr HR127457 [0,0,0,0,0,0|2,0,1]=3 18 B5R0.1 CC(=O)OCCl HR101207 [0,0,0,0,0,0|2,0,1]=3 19 B5R0.1 CC(=O)\C=N\O HR126710 [0,0,0,0,0,0|2,0,0]=2 20 B5R0.1 CC(C)=CC=O HR138342 [0,0,0,0,0,0|2,0,0]=2 21 B5R0.1 CC(C)=CCBr HR133883 [0,0,0,0,0,0|2,0,1]=3 22 B5R0.1 CC(C)=CCCl HR127820 [0,0,0,0,0,0|2,0,1]=3 23 B5R0.1 CC(C)=CCN HR114772 [0,0,0,0,0,0|2,0,1]=3 24 B5R0.1 CC(C)=CCO HR138609 [0,0,0,0,0,0|2,0,1]=3 25 B5R0.1 CC(C)=CCS HR143870 [0,0,0,0,0,0|2,0,1]=3 26 B5R0.1 CC(C)=C[Mg]Br HR109568 [0,0,0,0,0,0|3,0,0]=3 27 B5R0.1 CC(C)=C[SiH2]Cl HR107199 [0,0,0,0,0,0|2,1,0]=3 28 B5R0.1 CCCC(=N)N HR126811 [0,0,0,0,0,0|2,0,2]=4 29 B5R0.1 CCCC(=O)Cl HR147587 [0,0,0,0,0,0|1,0,2]=3 30 B5R0.1 CCCC(=O)[O-] HR129884 [0,0,0,0,0,0|1,0,2]=3 31 B5R0.1 CCCC(=O)[O-] HR137474 [0,0,0,0,0,0|1,0,2]=3 32 B5R0.1 CCCC(C)Cl HR139357 [0,0,0,0,0,0|1,0,3]=4 33 B5R0.1 CCCC(C)N HR107397 [0,0,0,0,0,0|1,0,3]=4 34 B5R0.1 CCCC(C)O HR136841 [0,0,0,0,0,0|0,0,4]=4 35 B5R0.1 CCCC(C)O HR137349 [0,0,0,0,0,0|0,0,4]=4 36 B5R0.1 CCCC(C)S HR128554 [0,0,0,0,0,0|0,1,3]=4 37 B5R0.1 CCCC(N)=O HR137715 [0,0,0,0,0,0|1,0,2]=3 38 B5R0.1 CCNC(C)=O HR100775 [0,0,0,0,0,0|1,0,1]=2 39 B5R0.1 CCNC(N)=O HR126748 [0,0,0,0,0,0|2,0,1]=3 40 B5R0.1 CCNC(N)=[NH2+] HR145586 [0,0,0,0,0,0|3,0,1]=4 41 B5R0.1 CCOC(=N)N HR110036 [0,0,0,0,0,0|3,0,1]=4 42 B5R0.1 CCOC(=O)Cl IVSA07702 [0,0,0,0,0,0|2,0,1]=3 43 B5R0.1 CCOC(=S)[S-] HR127593 [0,0,0,0,0,0|2,1,1]=4 44 B5R0.1 CCOC(C)=N HR126641 [0,0,0,0,0,0|2,0,1]=3 45 B5R0.1 CCOC(N)=O HR123919 [0,0,0,0,0,0|2,0,1]=3 46 B5R0.1 CCSC(C)=O HR138399 [0,0,0,0,0,0|1,0,1]=2 47 B5R0.1 CCSC(C)=S HR129552 [0,0,0,0,0,0|1,1,1]=3 48 B5R0.1 CNCC(=O)O HR132326 [0,0,0,0,0,0|2,0,1]=3 49 B5R0.1 CNCC(=O)[O-] HR133335 [0,0,0,0,0,0|2,0,1]=3 50 B5R0.1 COCC(=N)N HR105552 [0,0,0,0,0,0|3,0,1]=4 51 B5R0.1 COCC(=O)Cl HR138385 [0,0,0,0,0,0|2,0,1]=3 52 B5R0.1 COCC(=O)O HR137614 [0,0,0,0,0,0|2,0,1]=3 53 B5R0.1 COCC(C)=O HR124731 [0,0,0,0,0,0|1,0,1]=2 54 B5R0.1 COCC(C)N HR140312 [0,0,0,0,0,0|2,0,2]=4 55 B5R0.1 COCC(C)O HR106636 [0,0,0,0,0,0|1,0,3]=4 56 B5R0.1 COCC(C)O HR128113 [0,0,0,0,0,0|1,0,3]=4 57 B5R0.1 COCC(C)O HR1904 [0,0,0,0,0,0|1,0,3]=4 58 B5R0.1 CSCC(C)=O HR104929 [0,0,0,0,0,0|1,0,1]=2 59 B5R0.1 CSCC(N)=O HR105921 [0,0,0,0,0,0|2,0,1]=3 60 B5R0.1 C\C(N)=C/C#N HR126883 [0,0,0,0,0,0|2,0,1]=3 61 B5R0.1 C\C=C\B(O)O HR109070 [0,0,0,0,0,0|2,0,1]=3 62 B5R0.1 C\C=C\C(=O)Cl HR100850 [0,0,0,0,0,0|1,0,0]=1 63 B5R0.1 C\C=C\C(=O)Cl HR133043 [0,0,0,0,0,0|1,0,0]=1 64 B5R0.1 N#CCC(=O)O HR146964 [0,0,0,0,0,0|2,0,2]=4 65 B5R0.1 N#CCC(N)=O HR124127 [0,0,0,0,0,0|2,0,2]=4 66 B5R0.1 NC(=O)CCO HR101159 [0,0,0,0,0,0|2,0,2]=4 67 B5R0.1 NC(=O)NCO HR121643 [0,0,0,0,0,0|3,0,1]=4 68 B5R0.1 NCCC(=O)O HR120135 [0,0,0,0,0,0|2,0,2]=4 69 B5R0.1 NCCC(=O)O HR136538 [0,0,0,0,0,0|2,0,2]=4 70 B5R0.1 NCCC(N)=O HR123050 [0,0,0,0,0,0|2,0,2]=4 71 B5R0.1 NOCC(=O)O HR107090 [0,0,0,0,0,0|3,0,1]=4 72 B5R0.1 O=C(Cl)CCBr HR132550 [0,0,0,0,0,0|2,0,2]=4 73 B5R0.1 O=C(Cl)CCCl HR125686 [0,0,0,0,0,0|2,0,2]=4 74 B5R0.1 O=C(O)CCBr HR146768 [0,0,0,0,0,0|2,0,2]=4 75 B5R0.1 O=C(O)CCI HR118002 [0,0,0,0,0,0|2,0,2]=4 76 B5R0.1 O=C(O)CCO HR12598 [0,0,0,0,0,0|2,0,2]=4 77 B5R0.1 O=C(O)CCS BACQ02107 [0,0,0,0,0,0|2,0,2]=4 78 B5R0.1 O=C(O)\C=C\I HR145754 [0,0,0,0,0,0|2,0,0]=2 79 B5R0.1 [SiH3]\C=C\C(Cl)Cl HR132332 [0,0,0,0,0,0|2,1,1]=4 80 B4R0.1 C=C(C)CBr HR118272 [1,0,0,0,0,0|2,0,1]=4 81 B4R0.1 C=C(C)CN HR103061 [1,0,0,0,0,0|2,0,1]=4 82 B4R0.1 C=C(C)OC HR127251 [1,0,0,0,0,0|2,0,0]=3 83 B4R0.1 C=C(C)[Mg]Br HR133880 [1,0,0,0,0,0|3,0,0]=4 84 B4R0.1 C=CC(=O)Cl HR138421 [1,0,0,0,0,0|1,0,0]=2 85 B4R0.1 C=CC(=O)O HR147507 [1,0,0,0,0,0|1,0,0]=2 86 B4R0.1 C=CC(=O)[O-] HR107941 [1,0,0,0,0,0|1,0,0]=2 87 B4R0.1 C=CC(=O)[O-] HR108077 [1,0,0,0,0,0|1,0,0]=2 88 B4R0.1 C=CC(=O)[O-] HR108254 [1,0,0,0,0,0|1,0,0]=2 89 B4R0.1 C=CC(=O)[O-] HR114407 [1,0,0,0,0,0|1,0,0]=2 90 B4R0.1 C=CC(=O)[O-] HR128661 [1,0,0,0,0,0|1,0,0]=2 91 B4R0.1 C=CC(=O)[O-] HR138209 [1,0,0,0,0,0|1,0,0]=2 92 B4R0.1 C=CC(C)=O NASA01402 [1,0,0,0,0,0|0,0,0]=1 93 B4R0.1 C=CC(C)N HR115106 [1,0,0,0,0,0|1,0,1]=3 94 B4R0.1 C=CC(C)N HR115412 [1,0,0,0,0,0|1,0,1]=3 95 B4R0.1 C=CC(C)O HR107775 [1,0,0,0,0,0|0,0,2]=3 96 B4R0.1 C=CC(N)=O HR124129 [1,0,0,0,0,0|1,0,0]=2 97 B4R0.1 C=CC(N)=O HR132105 [1,0,0,0,0,0|1,0,0]=2 98 B4R0.1 C=CC(N)=O HR147511 [1,0,0,0,0,0|1,0,0]=2 99 B4R0.1 C=C[N+](=O)[O-] HR118582 [1,0,0,0,0,0|2,0,0]=3 100 B4R0.1 CC(=O)C=O HR138052 [1,0,0,0,0,0|1,0,0]=2 101 B4R0.1 CC(=O)CBr HR147584 [1,0,0,0,0,0|1,0,1]=3 102 B4R0.1 CC(=O)CCl HR146994 [1,0,0,0,0,0|1,0,1]=3 103 B4R0.1 CC(=O)CN HR103911 [1,0,0,0,0,0|1,0,1]=3 104 B4R0.1 CC(=O)CN HR120199 [1,0,0,0,0,0|1,0,1]=3 105 B4R0.1 CC(=O)CO HR130889 [1,0,0,0,0,0|1,0,1]=3 106 B4R0.1 CC(=O)NN HR137209 [1,0,0,0,0,0|2,0,0]=3 107 B4R0.1 CC(=O)NO HR132350 [1,0,0,0,0,0|2,0,0]=3 108 B4R0.1 CC(=O)OO HR147573 [1,0,0,0,0,0|2,0,0]=3 109 B4R0.1 CC(C)=C=O HR100570 [1,0,0,0,0,0|2,0,1]=4 110 B4R0.1 CC(C)=NO HR135300 [1,0,0,0,0,0|3,0,0]=4 111 B4R0.1 CC=C(Cl)Cl HR101176 [1,0,0,0,0,0|2,0,0]=3 112 B4R0.1 CCC(=N)N HR124081 [1,0,0,0,0,0|2,0,1]=4 113 B4R0.1 CCC(=O)[O-] HR100550 [1,0,0,0,0,0|1,0,1]=3 114 B4R0.1 CCC(=O)[O-] HR104439 [1,0,0,0,0,0|1,0,1]=3 115 B4R0.1 CCC(=O)[O-] HR133146 [1,0,0,0,0,0|1,0,1]=3 116 B4R0.1 CCC(=O)[O-] HR133686 [1,0,0,0,0,0|1,0,1]=3 117 B4R0.1 CCC(=O)[O-] HR140520 [1,0,0,0,0,0|1,0,1]=3 118 B4R0.1 CCC(=O)[O-] HR145618 [1,0,0,0,0,0|1,0,1]=3 119 B4R0.1 CCC(C)N HR146170 [1,0,0,0,0,0|1,0,2]=4 120 B4R0.1 CCC(C)O HR134477 [1,0,0,0,0,0|0,0,3]=4 121 B4R0.1 CCC(C)O HR138640 [1,0,0,0,0,0|0,0,3]=4 122 B4R0.1 CCC(C)[O-] HR123042 [1,0,0,0,0,0|0,0,3]=4 123 B4R0.1 CCC(N)=O HR135085 [1,0,0,0,0,0|1,0,1]=3 124 B4R0.1 CCC(N)=S HR103772 [1,0,0,0,0,0|1,1,1]=4 125 B4R0.1 CCN(C)C HR137292 [1,0,0,0,0,0|2,0,1]=4 126 B4R0.1 CCS(=O)[O-] HR107475 [1,0,0,0,0,0|2,0,1]=4 127 B4R0.1 CC[N+](=O)[O-] ANSA06411 [1,0,0,0,0,0|2,0,1]=4 128 B4R0.1 CN(C)C=O HR147510 [1,0,0,0,0,0|3,0,0]=4 129 B4R0.1 CN(C)C=S HR147835 [1,0,0,0,0,0|3,0,0]=4 130 B4R0.1 CNC(=N)N HR100834 [1,0,0,0,0,0|3,0,0]=4 131 B4R0.1 CNC(=N)N HR127277 [1,0,0,0,0,0|3,0,0]=4 132 B4R0.1 CNC(=O)Cl HR124675 [1,0,0,0,0,0|2,0,0]=3 133 B4R0.1 CNC(C)=O HR133410 [1,0,0,0,0,0|1,0,0]=2 134 B4R0.1 CNC(C)C HR108788 [1,0,0,0,0,0|2,0,1]=4 135 B4R0.1 CNC(N)=O HR130491 [1,0,0,0,0,0|2,0,0]=3 136 B4R0.1 CNC(N)=S HR130920 [1,0,0,0,0,0|2,1,0]=4 137 B4R0.1 COC(=N)N HR109396 [1,0,0,0,0,0|3,0,0]=4 138 B4R0.1 COC(=N)N HR124434 [1,0,0,0,0,0|3,0,0]=4 139 B4R0.1 COC(=N)N HR127122 [1,0,0,0,0,0|3,0,0]=4 140 B4R0.1 COC(=N)N HR128592 [1,0,0,0,0,0|3,0,0]=4 141 B4R0.1 COC(=O)Cl ANSA06440 [1,0,0,0,0,0|2,0,0]=3 142 B4R0.1 COC(N)=O HR124182 [1,0,0,0,0,0|2,0,0]=3 143 B4R0.1 CO[SiH](C)C HR100966 [1,0,0,0,0,0|2,1,0]=4 144 B4R0.1 CSC(=N)N HR104771 [1,0,0,0,0,0|3,0,0]=4 145 B4R0.1 CSC(=N)N HR136603 [1,0,0,0,0,0|3,0,0]=4 146 B4R0.1 CSC(=N)N HR136931 [1,0,0,0,0,0|3,0,0]=4 147 B4R0.1 CSC(C)=O HR129778 [1,0,0,0,0,0|1,0,0]=2 148 B4R0.1 CSC(C)C HR129517 [1,0,0,0,0,0|2,0,1]=4 149 B4R0.1 C[N+](C)=CCl HR128587 [1,0,0,0,0,0|3,0,0]=4 150 B4R0.1 NC(=O)CBr HR101040 [1,0,0,0,0,0|2,0,1]=4 151 B4R0.1 NC(=O)CBr HR132005 [1,0,0,0,0,0|2,0,1]=4 152 B4R0.1 NC(=O)CCl HR138619 [1,0,0,0,0,0|2,0,1]=4 153 B4R0.1 NC(=O)CI HR127038 [1,0,0,0,0,0|2,0,1]=4 154 B4R0.1 NC(=O)NO HR136334 [1,0,0,0,0,0|3,0,0]=4 155 B4R0.1 NCC(=O)O HR123103 [1,0,0,0,0,0|2,0,1]=4 156 B4R0.1 NCC(=O)O HR134482 [1,0,0,0,0,0|2,0,1]=4 157 B4R0.1 NCC(=O)[O-] HR100672 [1,0,0,0,0,0|2,0,1]=4 158 B4R0.1 NCC(=O)[O-] HR132852 [1,0,0,0,0,0|2,0,1]=4 159 B4R0.1 NCC(=O)[O-] HR132860 [1,0,0,0,0,0|2,0,1]=4 160 B4R0.1 NCC(=O)[O-] HR134278 [1,0,0,0,0,0|2,0,1]=4 161 B4R0.1 NCC(=O)[O-] HR136299 [1,0,0,0,0,0|2,0,1]=4 162 B4R0.1 NCC(=O)[O-] HR9921 [1,0,0,0,0,0|2,0,1]=4 163 B4R0.1 NCC(N)=O HR123368 [1,0,0,0,0,0|2,0,1]=4 164 B4R0.1 NCC(N)=O SESA01801 [1,0,0,0,0,0|2,0,1]=4 165 B4R0.1 NNC(N)=O AZXF00310 [1,0,0,0,0,0|3,0,0]=4 166 B4R0.1 NNC(N)=O HR100595 [1,0,0,0,0,0|3,0,0]=4 167 B4R0.1 O=C(Br)CBr POCQ01902 [1,0,0,0,0,0|2,0,1]=4 168 B4R0.1 O=C(Cl)CBr POCQ01905 [1,0,0,0,0,0|2,0,1]=4 169 B4R0.1 O=C(Cl)CCl SQJB01602 [1,0,0,0,0,0|2,0,1]=4 170 B4R0.1 O=C(Cl)CF HR102086 [1,0,0,0,0,0|2,0,1]=4 171 B4R0.1 O=C(O)CBr HR147062 [1,0,0,0,0,0|2,0,1]=4 172 B4R0.1 O=C(O)CCl HR147508 [1,0,0,0,0,0|2,0,1]=4 173 B4R0.1 O=C(O)CO HR128939 [1,0,0,0,0,0|2,0,1]=4 174 B4R0.1 O=C(O)CS HR128237 [1,0,0,0,0,0|2,0,1]=4 175 B4R0.1 O=C([O-])CBr HR116499 [1,0,0,0,0,0|2,0,1]=4 176 B4R0.1 O=C([O-])CI HR131471 [1,0,0,0,0,0|2,0,1]=4 177 B4R0.1 O=C([O-])CO HR134522 [1,0,0,0,0,0|2,0,1]=4 178 B4R0.1 O=C([O-])CS HR135616 [1,0,0,0,0,0|2,0,1]=4 179 B4R0.1 O=C([O-])CS HR135882 [1,0,0,0,0,0|2,0,1]=4 180 B4R0.1 O=C([O-])CS HR136156 [1,0,0,0,0,0|2,0,1]=4 181 B4R0.1 O=C([O-])CS HR137167 [1,0,0,0,0,0|2,0,1]=4 182 B4R0.1 O=CC(=O)O APSA07202 [1,0,0,0,0,0|2,0,0]=3 183 B4R0.1 O=CC(=O)O HR136448 [1,0,0,0,0,0|2,0,0]=3 184 B4R0.1 O=CC(=O)O HR136846 [1,0,0,0,0,0|2,0,0]=3 185 B4R0.1 [Li]C(C)CC HR128023 [1,0,0,0,0,0|1,0,2]=4 186 B4R0.2 C=CCOC HR111200 [1,0,0,0,0,0|1,0,2]=4 187 B4R0.2 C=CCSC HR122911 [1,0,0,0,0,0|1,0,2]=4 188 B4R0.2 C=COCC CESA03009 [1,0,0,0,0,0|1,0,2]=4 189 B4R0.2 CCCNC HR109098 [1,0,0,0,0,0|1,0,2]=4 190 B4R0.2 CCCSC HR128481 [1,0,0,0,0,0|1,0,2]=4 191 B4R0.2 CCNC=O HR104364 [1,0,0,0,0,0|1,0,1]=3 192 B4R0.2 CCNCC HR101857 [1,0,0,0,0,0|1,0,2]=4 193 B4R0.2 CCNCC HR127000 [1,0,0,0,0,0|1,0,2]=4 194 B4R0.2 CCNCC HR132573 [1,0,0,0,0,0|1,0,2]=4 195 B4R0.2 CCOC=N HR105865 [1,0,0,0,0,0|2,0,1]=4 196 B4R0.2 CCPCC HR117135 [1,0,0,0,0,0|1,0,2]=4 197 B4R0.2 CCSCC HR120777 [1,0,0,0,0,0|1,0,2]=4 198 B4R0.2 CCSCC HR127285 [1,0,0,0,0,0|1,0,2]=4 199 B4R0.2 CCSSC HR129263 [1,0,0,0,0,0|2,0,1]=4 200 B4R0.2 CC\C=C\Br HR114361 [1,0,0,0,0,0|1,0,1]=3 201 B4R0.2 CO[Ca]OC HR130023 [1,0,0,0,0,0|3,0,0]=4 202 B4R0.2 CSCC=O HR129243 [1,0,0,0,0,0|1,0,1]=3 203 B4R0.2 CSCSC HR125290 [1,0,0,0,0,0|2,0,1]=4 204 B4R0.2 CSSSC HR136400 [1,0,0,0,0,0|3,0,0]=4 205 B4R0.2 C\C=C\C#N HR148236 [1,0,0,0,0,0|1,0,1]=3 206 B4R0.2 C\C=C\CC HR121335 [1,0,0,0,0,0|0,0,1]=2 207 B4R0.2 C\C=C\CC HR121956 [1,0,0,0,0,0|0,0,1]=2 208 B4R0.2 C\C=C\CCl HR130392 [1,0,0,0,0,0|1,0,1]=3 209 B4R0.2 C\C=C\CN HR109640 [1,0,0,0,0,0|1,0,1]=3 210 B4R0.2 C\C=C\OC HR102446 [1,0,0,0,0,0|1,0,0]=2 211 B4R0.2 Cl\C=C\CCl HR127094 [1,0,0,0,0,0|2,0,1]=4 212 B4R0.2 Cl\C=C\CCl HR137813 [1,0,0,0,0,0|2,0,1]=4 213 B4R0.2 N#CCC=O HR116464 [1,0,0,0,0,0|1,0,2]=4 214 B6R0.1 C#CC(=O)NCC HR116239 [0,1,0,0,0,0|1,0,2]=4 215 B6R0.1 C#CC(=O)OCC HR132600 [0,1,0,0,0,0|1,0,2]=4 216 B6R0.1 C#C\C(C)=C/CO HR102743 [0,1,0,0,0,0|2,0,1]=4 217 B6R0.1 C#C\C(C)=C/CO HR110020 [0,1,0,0,0,0|2,0,1]=4 218 B6R0.1 C=CC(=O)CCC HR100488 [0,1,0,0,0,0|0,0,3]=4 219 B6R0.1 C=COC(=O)CC HR145643 [0,1,0,0,0,0|1,0,1]=3 220 B6R0.1 CC#CC(=O)OC HR141249 [0,1,0,0,0,0|0,0,2]=3 221 B6R0.1 CCC(=O)CC#N HR104780 [0,1,0,0,0,0|1,0,2]=4 222 B6R0.1 CCC(=O)CSC HR123442 [0,1,0,0,0,0|1,0,1]=3 223 B6R0.1 CCCC(=O)NN HR113429 [0,1,0,0,0,0|1,0,2]=4 224 B6R0.1 CCCC(=O)SC HR136352 [0,1,0,0,0,0|0,0,2]=3 225 B6R0.1 CCCC(=S)OC HR122832 [0,1,0,0,0,0|0,1,2]=4 226 B6R0.1 CCOC(=N)CCl HR112327 [0,1,0,0,0,0|2,0,1]=4 227 B6R0.1 CCOC(=O)C=O HR130872 [0,1,0,0,0,0|1,0,2]=4 228 B6R0.1 CCOC(=O)CBr AMJB00601 [0,1,0,0,0,0|1,0,1]=3 229 B6R0.1 CCOC(=O)CCl HR147617 [0,1,0,0,0,0|1,0,1]=3 230 B6R0.1 CCOC(=O)CN HR134743 [0,1,0,0,0,0|1,0,1]=3 231 B6R0.1 CCOC(=O)CO HR127384 [0,1,0,0,0,0|1,0,1]=3 232 B6R0.1 CCOC(=O)CS HR136673 [0,1,0,0,0,0|1,0,1]=3 233 B6R0.1 CCOC(=O)NN HR102667 [0,1,0,0,0,0|2,0,1]=4 234 B6R0.1 CCOC(=O)NN HR138962 [0,1,0,0,0,0|2,0,1]=4 235 B6R0.1 CCOC(=O)OC HR138173 [0,1,0,0,0,0|1,0,1]=3 236 B6R0.1 CCO\C(C)=N/O SIJL01004 [0,1,0,0,0,0|1,0,2]=4 237 B6R0.1 CCSC(=O)CC HR138214 [0,1,0,0,0,0|1,0,1]=3 238 B6R0.1 CNC(=O)CC#N HR121877 [0,1,0,0,0,0|1,0,2]=4 239 B6R0.1 CNCC(=O)OC HR130436 [0,1,0,0,0,0|1,0,1]=3 240 B6R0.1 COC(=O)CC#N OLSA05202 [0,1,0,0,0,0|1,0,2]=4 241 B6R0.1 COC(=O)CCBr HR133552 [0,1,0,0,0,0|1,0,2]=4 242 B6R0.1 COC(=O)CCN HR135038 [0,1,0,0,0,0|1,0,2]=4 243 B6R0.1 COC(=O)CCS HR133169 [0,1,0,0,0,0|1,0,2]=4 244 B6R0.1 COC(=O)N=C=O HR121998 [0,1,0,0,0,0|2,0,1]=4 245 B6R0.1 COC(=O)NC#N HR128405 [0,1,0,0,0,0|2,0,1]=4 246 B6R0.1 COC(=O)\C=C\N HR109927 [0,1,0,0,0,0|1,0,0]=2 247 B6R0.1 COCC(=O)OC HR147666 [0,1,0,0,0,0|1,0,1]=3 248 B6R0.1 C\C=C\C(=O)CC HR108073 [0,1,0,0,0,0|0,0,0]=1 249 B6R0.1 O=C(CCl)NCO HR124394 [0,1,0,0,0,0|2,0,1]=4 250 B6R0.1 [C-]#[N+]CC(=O)OC HR110956 [0,1,0,0,0,0|1,0,2]=4 251 B6R0.2 CC(=O)CC(=O)[O-] HR126081 [0,1,0,0,0,0|1,0,1]=3 252 B6R0.2 CC(=O)CC(C)=O AVJB01201 [0,1,0,0,0,0|0,0,1]=2 253 B6R0.2 CC(=O)CC(C)=O CUSA07105 [0,1,0,0,0,0|0,0,1]=2 254 B6R0.2 CC(=O)CC(C)=O HR108604 [0,1,0,0,0,0|0,0,1]=2 255 B6R0.2 CC(=O)CC(N)=O HR125580 [0,1,0,0,0,0|1,0,1]=3 256 B6R0.2 CC(=O)NC(=N)N HR3986 [0,1,0,0,0,0|2,0,0]=3 257 B6R0.2 CC(=O)NC(C)C ABSA04901 [0,1,0,0,0,0|1,0,1]=3 258 B6R0.2 CC(=O)OC(C)=O NASA01407 [0,1,0,0,0,0|1,0,0]=2 259 B6R0.2 CC(=O)OC(C)Br HR115050 [0,1,0,0,0,0|1,0,1]=3 260 B6R0.2 CC(=O)\C=C(/C)N HR105871 [0,1,0,0,0,0|0,0,0]=1 261 B6R0.2 CC(=O)\C=C(\C)[O-] HR100501 [0,1,0,0,0,0|0,0,0]=1 262 B6R0.2 CC(=O)\C=C(\C)[O-] HR107173 [0,1,0,0,0,0|0,0,0]=1 263 B6R0.2 CC(=O)\C=C(\C)[O-] HR113781 [0,1,0,0,0,0|0,0,0]=1 264 B6R0.2 CC(=O)\C=C(\C)[O-] HR117143 [0,1,0,0,0,0|0,0,0]=1 265 B6R0.2 CC(C)=CC(=O)Cl HR129281 [0,1,0,0,0,0|1,0,0]=2 266 B6R0.2 CC(C)=CC(=O)O HR21295 [0,1,0,0,0,0|1,0,0]=2 267 B6R0.2 CC(C)CC(=O)O HR123359 [0,1,0,0,0,0|1,0,2]=4 268 B6R0.2 CC(C)CC(N)=O HR109732 [0,1,0,0,0,0|1,0,2]=4 269 B6R0.2 CC(N)CC(=O)O HR103780 [0,1,0,0,0,0|1,0,2]=4 270 B6R0.2 CC(N)CC(=O)O HR116211 [0,1,0,0,0,0|1,0,2]=4 271 B6R0.2 CC(N)CC(=O)O HR120488 [0,1,0,0,0,0|1,0,2]=4 272 B6R0.2 CC(N)CC(=O)O HR124863 [0,1,0,0,0,0|1,0,2]=4 273 B6R0.2 CC(O)CC(=O)[O-] HR147106 [0,1,0,0,0,0|1,0,2]=4 274 B6R0.2 CN(C)CC(=O)O HR127289 [0,1,0,0,0,0|2,0,1]=4 275 B6R0.2 CN(C)CC(=O)[O-] HR134057 [0,1,0,0,0,0|2,0,1]=4 276 B6R0.2 C[S+](C)CC(=O)[O-] HR107996 [0,1,0,0,0,0|2,0,1]=4 277 B6R0.2 N=C(N)CC(N)=O HR137702 [0,1,0,0,0,0|2,0,1]=4 278 B6R0.2 N=C(N)NC(N)=O HR122408 [0,1,0,0,0,0|3,0,0]=4 279 B6R0.2 N=C(N)NC(N)=O HR122672 [0,1,0,0,0,0|3,0,0]=4 280 B6R0.2 NC(=O)CC(N)=O HR138203 [0,1,0,0,0,0|2,0,1]=4 281 B6R0.2 NC(=O)NC(N)=O HR130501 [0,1,0,0,0,0|3,0,0]=4 282 B6R0.2 O=C(O)CC(=O)O DACQ01002 [0,1,0,0,0,0|2,0,1]=4 283 B6R0.2 O=C(O)CC(=O)O HR144418 [0,1,0,0,0,0|2,0,1]=4 284 B6R0.2 O=C([O-])CC(=O)[O-] HR125830 [0,1,0,0,0,0|2,0,1]=4 285 B6R0.2 O=C([O-])CC(=O)[O-] HR131351 [0,1,0,0,0,0|2,0,1]=4 286 B6R0.2 O=C([O-])OC(=O)[O-] HR101507 [0,1,0,0,0,0|3,0,0]=4 287 B6R0.3 C=C(CC)C(=O)O HR118672 [0,1,0,0,0,0|1,0,1]=3 288 B6R0.3 C=C(F)C(=O)OC HR30168 [0,1,0,0,0,0|2,0,1]=4 289 B6R0.3 C=CC(=O)N(C)C HR129014 [0,1,0,0,0,0|2,0,1]=4 290 B6R0.3 C=CC(N)C(=O)O HR139947 [0,1,0,0,0,0|1,0,2]=4 291 B6R0.3 C=CC(N)C(=O)O HR146204 [0,1,0,0,0,0|1,0,2]=4 292 B6R0.3 C=CN(C)C(C)=O HR127450 [0,1,0,0,0,0|1,0,1]=3 293 B6R0.3 CC(=O)\C(C)=N\O HR130047 [0,1,0,0,0,0|2,0,0]=3 294 B6R0.3 CCC(=O)C(=O)O HR128819 [0,1,0,0,0,0|1,0,1]=3 295 B6R0.3 CCC(=O)C(C)=O HR131826 [0,1,0,0,0,0|0,0,1]=2 296 B6R0.3 CCC(=O)C(C)Cl HR114937 [0,1,0,0,0,0|1,0,2]=4 297 B6R0.3 CCC(=O)N(C)C HR122269 [0,1,0,0,0,0|2,0,1]=4 298 B6R0.3 CCC(Br)C(=O)Cl HR115509 [0,1,0,0,0,0|1,0,2]=4 299 B6R0.3 CCC(Br)C(=O)O HR123595 [0,1,0,0,0,0|1,0,2]=4 300 B6R0.3 CCC(C)C(=O)Cl HR144038 [0,1,0,0,0,0|1,0,2]=4 301 B6R0.3 CCC(C)C(=O)O HR124401 [0,1,0,0,0,0|1,0,2]=4 302 B6R0.3 CCC(C)C(=O)O HR124666 [0,1,0,0,0,0|1,0,2]=4 303 B6R0.3 CCC(C)C(N)=O HR115534 [0,1,0,0,0,0|1,0,2]=4 304 B6R0.3 CCC(Cl)C(=O)O HR104193 [0,1,0,0,0,0|1,0,2]=4 305 B6R0.3 CCC(Cl)C(=O)O HR104505 [0,1,0,0,0,0|1,0,2]=4 306 B6R0.3 CCC(N)C(=O)O HR100731 [0,1,0,0,0,0|1,0,2]=4 307 B6R0.3 CCC(N)C(=O)O HR128531 [0,1,0,0,0,0|1,0,2]=4 308 B6R0.3 CCC(N)C(=O)O HR128797 [0,1,0,0,0,0|1,0,2]=4 309 B6R0.3 CCC(N)C(=O)O HR130831 [0,1,0,0,0,0|1,0,2]=4 310 B6R0.3 CCC(N)C(=O)O VOJL00901 [0,1,0,0,0,0|1,0,2]=4 311 B6R0.3 CCC(N)C(N)=O HR113889 [0,1,0,0,0,0|1,0,2]=4 312 B6R0.3 CCC(N)C(N)=O HR133280 [0,1,0,0,0,0|1,0,2]=4 313 B6R0.3 CCC(O)C(=O)O HR145745 [0,1,0,0,0,0|1,0,2]=4 314 B6R0.3 CCC(O)C(=O)O HR8265 [0,1,0,0,0,0|1,0,2]=4 315 B6R0.3 CCC(S)C(C)=O HR124234 [0,1,0,0,0,0|0,0,2]=3 316 B6R0.3 CCN(C)C(=O)Cl HR16066 [0,1,0,0,0,0|2,0,1]=4 317 B6R0.3 CNC(=O)N(C)C HR100405 [0,1,0,0,0,0|3,0,0]=4 318 B6R0.3 CNC(C)C(=O)O HR126490 [0,1,0,0,0,0|2,0,1]=4 319 B6R0.3 CNC(C)C(=O)O HR131233 [0,1,0,0,0,0|2,0,1]=4 320 B6R0.3 CNC(C)C(=O)O HR138734 [0,1,0,0,0,0|2,0,1]=4 321 B6R0.3 CNC(C)C(=O)[O-] HR145674 [0,1,0,0,0,0|2,0,1]=4 322 B6R0.3 COC(=O)C(=O)Cl FOXF01206 [0,1,0,0,0,0|2,0,0]=3 323 B6R0.3 COC(=O)C(C)=O HR131015 [0,1,0,0,0,0|1,0,0]=2 324 B6R0.3 COC(=O)C(C)Br HR123627 [0,1,0,0,0,0|2,0,1]=4 325 B6R0.3 COC(=O)C(C)Cl HR133108 [0,1,0,0,0,0|2,0,1]=4 326 B6R0.3 COC(=O)C(C)N HR10884 [0,1,0,0,0,0|2,0,1]=4 327 B6R0.3 COC(=O)C(C)N HR126866 [0,1,0,0,0,0|2,0,1]=4 328 B6R0.3 COC(=O)C(C)N HR127180 [0,1,0,0,0,0|2,0,1]=4 329 B6R0.3 COC(=O)C(C)O HR133668 [0,1,0,0,0,0|1,0,2]=4 330 B6R0.3 COC(=O)C(C)O HR6056 [0,1,0,0,0,0|1,0,2]=4 331 B6R0.3 COC(=O)C(N)=O HR115965 [0,1,0,0,0,0|2,0,0]=3 332 B6R0.3 CON(C)C(C)=O HR136259 [0,1,0,0,0,0|2,0,0]=3 333 B6R0.3 CSC(C)C(C)=O HR133684 [0,1,0,0,0,0|1,0,1]=3 334 B6R0.3 C\C=C(/C)C(=O)Cl HR120157 [0,1,0,0,0,0|1,0,0]=2 335 B6R0.3 C\C=C(/C)C(=O)O HR127692 [0,1,0,0,0,0|1,0,0]=2 336 B6R0.3 C\C=C(/C)C(=O)O HR140908 [0,1,0,0,0,0|1,0,0]=2 337 B6R0.3 C\C=C(\C)B(O)O HR33800 [0,1,0,0,0,0|2,0,1]=4 338 B6R0.3 O=C(O)C(=O)CBr HR129820 [0,1,0,0,0,0|2,0,1]=4 339 B6R0.4 C=C(C)CNCC HR128262 [0,1,0,0,0,0|1,0,2]=4 340 B6R0.4 C=CCCC(=O)Cl HR106043 [0,1,0,0,0,0|1,0,2]=4 341 B6R0.4 C=CCCC(=O)O HR128583 [0,1,0,0,0,0|1,0,2]=4 342 B6R0.4 C=CCOC(C)=S HR100810 [0,1,0,0,0,0|0,1,2]=4 343 B6R0.4 CC(=O)CCCBr HR147487 [0,1,0,0,0,0|0,0,2]=3 344 B6R0.4 CC(=O)CCCCl HR100024 [0,1,0,0,0,0|0,0,2]=3 345 B6R0.4 CC(=O)CCCO HR136959 [0,1,0,0,0,0|0,0,2]=3 346 B6R0.4 CC(=O)NCCN HR128075 [0,1,0,0,0,0|1,0,1]=3 347 B6R0.4 CC(=O)NCCO HR100613 [0,1,0,0,0,0|1,0,1]=3 348 B6R0.4 CC(=O)OCCBr HR131354 [0,1,0,0,0,0|1,0,1]=3 349 B6R0.4 CC(C)=NNC=O HR117540 [0,1,0,0,0,0|3,0,0]=4 350 B6R0.4 CCCCC(=O)Cl HR147689 [0,1,0,0,0,0|1,0,2]=4 351 B6R0.4 CCCCC(=O)[O-] HR143929 [0,1,0,0,0,0|1,0,2]=4 352 B6R0.4 CCCCC(N)=O HR110039 [0,1,0,0,0,0|1,0,2]=4 353 B6R0.4 CCCSC(C)=O HR137881 [0,1,0,0,0,0|0,0,2]=3 354 B6R0.4 CCNCC(=O)O HR105131 [0,1,0,0,0,0|1,0,2]=4 355 B6R0.4 CCOCC(=O)O HR123178 [0,1,0,0,0,0|1,0,2]=4 356 B6R0.4 CC\C=C\B(O)O HR116587 [0,1,0,0,0,0|2,0,1]=4 357 B6R0.4 CN(C)\C=C\C=O HR126291 [0,1,0,0,0,0|2,0,1]=4 358 B6R0.4 CNCCC(=O)O HR100194 [0,1,0,0,0,0|1,0,2]=4 359 B6R0.4 CO\C=C\C(C)=O HR138997 [0,1,0,0,0,0|0,0,0]=1 360 B6R0.4 CSCCC(C)=O HR133952 [0,1,0,0,0,0|0,0,2]=3 361 B6R0.4 NCCCC(=O)O HR130958 [0,1,0,0,0,0|1,0,2]=4 362 B6R0.4 O=C(Cl)CCCBr HR102428 [0,1,0,0,0,0|1,0,2]=4 363 B6R0.4 O=C(Cl)CCCCl HR129406 [0,1,0,0,0,0|1,0,2]=4 364 B6R0.4 O=C(Cl)OCCCl HR132842 [0,1,0,0,0,0|2,0,1]=4 365 B6R0.4 O=C(Cl)OCCCl HR17418 [0,1,0,0,0,0|2,0,1]=4 366 B6R0.4 O=C(O)C#CCO HR112666 [0,1,0,0,0,0|1,0,2]=4 367 B6R0.4 O=C(O)CCCBr HR131673 [0,1,0,0,0,0|1,0,2]=4 368 B6R0.4 O=C(O)CCCCl HR120152 [0,1,0,0,0,0|1,0,2]=4 369 B6R0.4 O=CCCC(=O)O HR134907 [0,1,0,0,0,0|2,0,1]=4 370 B6R0.5 CCOS(C)(=O)=O HR131022 [0,1,0,0,0,0|2,0,1]=4 371 B6R1.2 BrC1=CC=CO1 HR132225 [0,0,0,1,0,0|1,0,2]=4 372 B6R1.2 BrC1=CC=CS1 HR34180 [0,0,0,1,0,0|1,1,1]=4 373 B6R1.2 BrC1=CNC=C1 HR106799 [0,0,0,1,0,0|2,0,1]=4 374 B6R1.2 BrC1=COC=C1 HR8830 [0,0,0,1,0,0|2,0,1]=4 375 B6R1.2 BrC1=CSC=C1 HR126013 [0,0,0,1,0,0|2,0,1]=4 376 B6R1.2 BrC1=NNC=C1 HR117565 [0,0,0,1,0,0|3,0,0]=4 377 B6R1.2 BrC1=NSC=C1 HR109115 [0,0,0,1,0,0|3,0,0]=4 378 B6R1.2 CC1=CC=CN1 HR147294 [0,0,0,1,0,0|1,0,1]=3 379 B6R1.2 CC1=CC=CS1 HR131866 [0,0,0,1,0,0|0,1,1]=3 380 B6R1.2 CC1=CC=NN1 HR10442 [0,0,0,1,0,0|2,0,0]=3 381 B6R1.2 CC1=CC=NO1 HR131159 [0,0,0,1,0,0|1,0,1]=3 382 B6R1.2 CC1=CN=CS1 HR128769 [0,0,0,1,0,0|1,1,1]=4 383 B6R1.2 CC1=CNC=C1 HR13921 [0,0,0,1,0,0|2,0,0]=3 384 B6R1.2 CC1=CNC=N1 HR7153 [0,0,0,1,0,0|2,0,1]=4 385 B6R1.2 CC1=CNN=C1 HR13055 [0,0,0,1,0,0|3,0,0]=4 386 B6R1.2 CC1=CNN=N1 HR148271 [0,0,0,1,0,0|3,0,0]=4 387 B6R1.2 CC1=COC=C1 HR125178 [0,0,0,1,0,0|2,0,0]=3 388 B6R1.2 CC1=COC=N1 HR121299 [0,0,0,1,0,0|2,0,1]=4 389 B6R1.2 CC1=CSC=N1 HR132874 [0,0,0,1,0,0|2,0,1]=4 390 B6R1.2 CC1=NC=CN1 HR135019 [0,0,0,1,0,0|2,0,1]=4 391 B6R1.2 CC1=NC=CS1 HR128073 [0,0,0,1,0,0|1,1,1]=4 392 B6R1.2 CC1=NCCC1 HR128050 [0,0,0,1,0,0|1,0,2]=4 393 B6R1.2 CC1=NCCS1 HR124488 [0,0,0,1,0,0|1,1,1]=4 394 B6R1.2 CC1=NNC=C1 HR13253 [0,0,0,1,0,0|2,0,0]=3 395 B6R1.2 CC1=NNC=N1 FOXF01203 [0,0,0,1,0,0|3,0,0]=4 396 B6R1.2 CC1=NOC=C1 HR104498 [0,0,0,1,0,0|2,0,0]=3 397 B6R1.2 CC1=NSC=C1 HR105128 [0,0,0,1,0,0|2,0,0]=3 398 B6R1.2 CN1C=CC=C1 HR131584 [0,0,0,1,0,0|2,0,1]=4 399 B6R1.2 CN1C=CC=N1 HR128244 [0,0,0,1,0,0|2,0,1]=4 400 B6R1.2 CN1C=CN=C1 HR134754 [0,0,0,1,0,0|3,0,0]=4 401 B6R1.2 CN1C=CN=N1 HR32395 [0,0,0,1,0,0|3,0,0]=4 402 B6R1.2 ClC1=CC=CS1 HR130520 [0,0,0,1,0,0|1,1,1]=4 403 B6R1.2 ClC1=CCCC1 HR140861 [0,0,0,1,0,0|1,0,1]=3 404 B6R1.2 ClC1=CSC=C1 HR130789 [0,0,0,1,0,0|2,0,1]=4 405 B6R1.2 FC1=CC=CS1 HR116433 [0,0,0,1,0,0|1,1,1]=4 406 B6R1.2 IC1=CC=CS1 HR133352 [0,0,0,1,0,0|1,1,1]=4 407 B6R1.2 IC1=CSC=C1 HR131727 [0,0,0,1,0,0|2,0,1]=4 408 B6R1.2 IC1=NNC=C1 HR148460 [0,0,0,1,0,0|3,0,0]=4 409 B6R1.2 NC1=CC=CN1 HR107433 [0,0,0,1,0,0|2,0,1]=4 410 B6R1.2 NC1=CC=CS1 HR102647 [0,0,0,1,0,0|1,1,1]=4 411 B6R1.2 NC1=CC=NN1 HR147285 [0,0,0,1,0,0|3,0,0]=4 412 B6R1.2 NC1=CC=NO1 HR120254 [0,0,0,1,0,0|2,0,1]=4 413 B6R1.2 NC1=CSC=C1 HR102995 [0,0,0,1,0,0|2,0,1]=4 414 B6R1.2 NC1=NCCC1 HR112379 [0,0,0,1,0,0|2,0,1]=4 415 B6R1.2 NC1=NCCC1 HR112697 [0,0,0,1,0,0|2,0,1]=4 416 B6R1.2 NC1=NNC=C1 HR11252 [0,0,0,1,0,0|3,0,0]=4 417 B6R1.2 NC1=NOC=C1 HR8627 [0,0,0,1,0,0|3,0,0]=4 418 B6R1.2 Nc1ccsc1 HR114587 [0,0,0,1,0,0|2,0,1]=4 419 B6R1.2 O=C1C=CCC1 HR136753 [0,0,0,1,0,0|0,0,0]=1 420 B6R1.2 O=C1C=CCO1 HR119486 [0,0,0,1,0,0|1,0,0]=2 421 B6R1.2 O=C1C=CON1 HR31911 [0,0,0,1,0,0|2,0,0]=3 422 B6R1.2 O=C1C=CSN1 HR146483 [0,0,0,1,0,0|2,0,0]=3 423 B6R1.2 O=C1CC=CC1 HR111189 [0,0,0,1,0,0|0,0,2]=3 424 B6R1.2 O=C1CCCC1 HR147576 [0,0,0,1,0,0|0,0,2]=3 425 B6R1.2 O=C1CCCN1 HR144424 [0,0,0,1,0,0|1,0,1]=3 426 B6R1.2 O=C1CCCN1 HR147307 [0,0,0,1,0,0|1,0,1]=3 427 B6R1.2 O=C1CCNC1 HR126926 [0,0,0,1,0,0|1,0,1]=3 428 B6R1.2 O=C1CCNC1 HR127189 [0,0,0,1,0,0|1,0,1]=3 429 B6R1.2 O=C1CCNN1 HR146471 [0,0,0,1,0,0|2,0,0]=3 430 B6R1.2 O=C1CCOC1 HR109194 [0,0,0,1,0,0|1,0,1]=3 431 B6R1.2 O=C1CCSC1 HR5575 [0,0,0,1,0,0|1,0,1]=3 432 B6R1.2 O=C1CNCN1 HR114619 [0,0,0,1,0,0|2,0,1]=4 433 B6R1.2 O=C1CO[Pt]O1 HR131319 [0,0,0,1,0,0|3,0,0]=4 434 B6R1.2 O=C1N=CN=N1 HR101779 [0,0,0,1,0,0|3,0,0]=4 435 B6R1.2 O=C1N=CNN1 HR123246 [0,0,0,1,0,0|3,0,0]=4 436 B6R1.2 O=C1NCCN1 HR124833 [0,0,0,1,0,0|2,0,1]=4 437 B6R1.2 O=C1NCCN1 HR138382 [0,0,0,1,0,0|2,0,1]=4 438 B6R1.2 O=C1NCCO1 HR134554 [0,0,0,1,0,0|2,0,1]=4 439 B6R1.2 O=C1NCCS1 HR14582 [0,0,0,1,0,0|2,0,1]=4 440 B6R1.2 O=C1OC=CO1 HR128933 [0,0,0,1,0,0|2,0,1]=4 441 B6R1.2 O=C1OCCO1 APSA06102 [0,0,0,1,0,0|2,0,1]=4 442 B6R1.2 OC1=CNC=C1 HR106486 [0,0,0,1,0,0|1,0,2]=4 443 B6R1.2 SC1=CC=CS1 HR128217 [0,0,0,1,0,0|1,1,1]=4 444 B6R1.2 SC1=CSC=C1 HR103982 [0,0,0,1,0,0|1,1,1]=4 445 B6R1.5 CC1CC(=O)C1 HR121137 [0,0,0,1,0,0|0,0,2]=3 446 B6R1.5 NC1CC(=O)C1 HR145979 [0,0,0,1,0,0|1,0,2]=4 447 B6R1.5 O=C1CC(Br)C1 HR120509 [0,0,0,1,0,0|1,0,2]=4 448 B6R1.5 O=C1CC(O)C1 HR119245 [0,0,0,1,0,0|1,0,2]=4 449 B6R1.11 C=C(C)C1CO1 HR139225 [0,0,0,1,0,0|2,0,1]=4 450 B6R1.11 CC(=O)C1CC1 HR134464 [0,0,0,1,0,0|0,0,2]=3 451 B6R1.11 NC(=O)C1CC1 HR21401 [0,0,0,1,0,0|1,0,2]=4 452 B6R1.11 O=C(Cl)C1CC1 FISA07805 [0,0,0,1,0,0|1,0,2]=4 453 B6R1.11 O=C(O)C1CC1 HR133116 [0,0,0,1,0,0|1,0,2]=4 454 B3R0.1 C#CC=O HR107808 [2,0,0,0,0,0|0,0,2]=4 455 B3R0.1 C=C=CC HR102099 [2,0,0,0,0,0|0,0,1]=3 456 B3R0.1 C=CC#N HR147575 [2,0,0,0,0,0|1,0,1]=4 457 B3R0.1 C=CCBr MIJL02702 [2,0,0,0,0,0|1,0,1]=4 458 B3R0.1 C=C[Mg]Br HR125056 [2,0,0,0,0,0|2,0,0]=4 459 B3R0.1 C=C[Mg]Cl HR136967 [2,0,0,0,0,0|2,0,0]=4 460 B3R0.1 CCC=O HR147700 [2,0,0,0,0,0|0,0,1]=3 461 B3R0.1 CCNC HR124522 [2,0,0,0,0,0|1,0,1]=4 462 B3R0.1 CCNC HR137767 [2,0,0,0,0,0|1,0,1]=4 463 B3R0.1 CCSC HR132879 [2,0,0,0,0,0|1,0,1]=4 464 B3R0.1 CNC=O HR129999 [2,0,0,0,0,0|1,0,0]=3 465 B3R0.1 CNOC ANSA06428 [2,0,0,0,0,0|2,0,0]=4 466 B3R0.1 CNOC SACQ02002 [2,0,0,0,0,0|2,0,0]=4 467 B3R0.1 C[Se][Se]C HR124157 [2,0,0,0,0,0|2,0,0]=4 468 B3R0.1 C\C=C\C HR122646 [2,0,0,0,0,0|0,0,0]=2 469 B3R0.1 C\C=C\C HR122910 [2,0,0,0,0,0|0,0,0]=2 470 B3R0.1 Cl\C=C\Cl HR134929 [2,0,0,0,0,0|2,0,0]=4 471 B3R0.1 NNC=O FOXF01201 [2,0,0,0,0,0|2,0,0]=4 472 B3R0.1 O=CC=O HR136593 [2,0,0,0,0,0|1,0,0]=3 473 B3R0.1 O=CCCl HR147594 [2,0,0,0,0,0|1,0,1]=4 474 B3R0.1 O=CCS HR100447 [2,0,0,0,0,0|1,0,1]=4 475 B3R0.2 BN(C)C HR122788 [2,0,0,0,0,0|2,0,0]=4 476 B3R0.2 C=C(F)Br HR110418 [2,0,0,0,0,0|2,0,0]=4 477 B3R0.2 C=C(F)Cl HR110734 [2,0,0,0,0,0|2,0,0]=4 478 B3R0.2 C=[N+](C)C HR101548 [2,0,0,0,0,0|2,0,0]=4 479 B3R0.2 CC(=N)N HR126542 [2,0,0,0,0,0|2,0,0]=4 480 B3R0.2 CC(=O)Br HR147574 [2,0,0,0,0,0|1,0,0]=3 481 B3R0.2 CC(=O)Cl ANSA06435 [2,0,0,0,0,0|1,0,0]=3 482 B3R0.2 CC(=O)O HR101021 [2,0,0,0,0,0|1,0,0]=3 483 B3R0.2 CC(=O)O HR106009 [2,0,0,0,0,0|1,0,0]=3 484 B3R0.2 CC(=O)O HR144874 [2,0,0,0,0,0|1,0,0]=3 485 B3R0.2 CC(=O)[O-] HR100397 [2,0,0,0,0,0|1,0,0]=3 486 B3R0.2 CC(=O)[O-] HR100452 [2,0,0,0,0,0|1,0,0]=3 487 B3R0.2 CC(=O)[O-] HR100574 [2,0,0,0,0,0|1,0,0]=3 488 B3R0.2 CC(=O)[O-] HR101017 [2,0,0,0,0,0|1,0,0]=3 489 B3R0.2 CC(=O)[O-] HR101061 [2,0,0,0,0,0|1,0,0]=3 490 B3R0.2 CC(=O)[O-] HR101458 [2,0,0,0,0,0|1,0,0]=3 491 B3R0.2 CC(=O)[O-] HR101465 [2,0,0,0,0,0|1,0,0]=3 492 B3R0.2 CC(=O)[O-] HR101582 [2,0,0,0,0,0|1,0,0]=3 493 B3R0.2 CC(=O)[O-] HR101606 [2,0,0,0,0,0|1,0,0]=3 494 B3R0.2 CC(=O)[O-] HR101993 [2,0,0,0,0,0|1,0,0]=3 495 B3R0.2 CC(=O)[O-] HR104129 [2,0,0,0,0,0|1,0,0]=3 496 B3R0.2 CC(=O)[O-] HR104441 [2,0,0,0,0,0|1,0,0]=3 497 B3R0.2 CC(=O)[O-] HR105065 [2,0,0,0,0,0|1,0,0]=3 498 B3R0.2 CC(=O)[O-] HR107933 [2,0,0,0,0,0|1,0,0]=3 499 B3R0.2 CC(=O)[O-] HR10966 [2,0,0,0,0,0|1,0,0]=3 500 B3R0.2 CC(=O)[O-] HR118324 [2,0,0,0,0,0|1,0,0]=3 501 B3R0.2 CC(=O)[O-] HR120919 [2,0,0,0,0,0|1,0,0]=3 502 B3R0.2 CC(=O)[O-] HR122569 [2,0,0,0,0,0|1,0,0]=3 503 B3R0.2 CC(=O)[O-] HR123632 [2,0,0,0,0,0|1,0,0]=3 504 B3R0.2 CC(=O)[O-] HR123894 [2,0,0,0,0,0|1,0,0]=3 505 B3R0.2 CC(=O)[O-] HR123911 [2,0,0,0,0,0|1,0,0]=3 506 B3R0.2 CC(=O)[O-] HR124155 [2,0,0,0,0,0|1,0,0]=3 507 B3R0.2 CC(=O)[O-] HR126247 [2,0,0,0,0,0|1,0,0]=3 508 B3R0.2 CC(=O)[O-] HR127039 [2,0,0,0,0,0|1,0,0]=3 509 B3R0.2 CC(=O)[O-] HR127642 [2,0,0,0,0,0|1,0,0]=3 510 B3R0.2 CC(=O)[O-] HR128953 [2,0,0,0,0,0|1,0,0]=3 511 B3R0.2 CC(=O)[O-] HR130171 [2,0,0,0,0,0|1,0,0]=3 512 B3R0.2 CC(=O)[O-] HR131284 [2,0,0,0,0,0|1,0,0]=3 513 B3R0.2 CC(=O)[O-] HR131740 [2,0,0,0,0,0|1,0,0]=3 514 B3R0.2 CC(=O)[O-] HR132897 [2,0,0,0,0,0|1,0,0]=3 515 B3R0.2 CC(=O)[O-] HR136717 [2,0,0,0,0,0|1,0,0]=3 516 B3R0.2 CC(=O)[O-] HR137902 [2,0,0,0,0,0|1,0,0]=3 517 B3R0.2 CC(=O)[O-] HR138420 [2,0,0,0,0,0|1,0,0]=3 518 B3R0.2 CC(=O)[O-] HR138688 [2,0,0,0,0,0|1,0,0]=3 519 B3R0.2 CC(=O)[O-] HR138953 [2,0,0,0,0,0|1,0,0]=3 520 B3R0.2 CC(=O)[O-] HR141575 [2,0,0,0,0,0|1,0,0]=3 521 B3R0.2 CC(=O)[O-] HR142478 [2,0,0,0,0,0|1,0,0]=3 522 B3R0.2 CC(=O)[O-] HR144610 [2,0,0,0,0,0|1,0,0]=3 523 B3R0.2 CC(=O)[O-] HR3997 [2,0,0,0,0,0|1,0,0]=3 524 B3R0.2 CC(C)=O AUSA03806 [2,0,0,0,0,0|0,0,0]=2 525 B3R0.2 CC(C)I HR147635 [2,0,0,0,0,0|1,0,1]=4 526 B3R0.2 CC(C)N ABSA04801 [2,0,0,0,0,0|1,0,1]=4 527 B3R0.2 CC(C)[O-] HR101911 [2,0,0,0,0,0|0,0,2]=4 528 B3R0.2 CC(C)[O-] HR111090 [2,0,0,0,0,0|0,0,2]=4 529 B3R0.2 CC(C)[O-] HR123310 [2,0,0,0,0,0|0,0,2]=4 530 B3R0.2 CC(C)[O-] HR133912 [2,0,0,0,0,0|0,0,2]=4 531 B3R0.2 CC(C)[O-] HR136894 [2,0,0,0,0,0|0,0,2]=4 532 B3R0.2 CC(C)[O-] HR142627 [2,0,0,0,0,0|0,0,2]=4 533 B3R0.2 CC(C)[O-] HR147734 [2,0,0,0,0,0|0,0,2]=4 534 B3R0.2 CC(N)=O HR137897 [2,0,0,0,0,0|1,0,0]=3 535 B3R0.2 CC(N)=S FOXF01202 [2,0,0,0,0,0|1,1,0]=4 536 B3R0.2 CC([O-])=S HR123449 [2,0,0,0,0,0|1,0,1]=4 537 B3R0.2 CN(C)C HR101063 [2,0,0,0,0,0|2,0,0]=4 538 B3R0.2 CP(C)C HR109039 [2,0,0,0,0,0|2,0,0]=4 539 B3R0.2 CP(C)Cl HR114923 [2,0,0,0,0,0|2,0,0]=4 540 B3R0.2 CS(=O)O HR102459 [2,0,0,0,0,0|2,0,0]=4 541 B3R0.2 CS(C)=O HR127060 [2,0,0,0,0,0|1,0,0]=3 542 B3R0.2 C[AlH3](C)C HR147740 [2,0,0,0,0,0|2,0,0]=4 543 B3R0.2 C[Ga](C)C HR135051 [2,0,0,0,0,0|2,0,0]=4 544 B3R0.2 C[In](C)C HR135575 [2,0,0,0,0,0|2,0,0]=4 545 B3R0.2 C[P+](C)=O HR103883 [2,0,0,0,0,0|1,0,0]=3 546 B3R0.2 C[S+](C)C HR129979 [2,0,0,0,0,0|2,0,0]=4 547 B3R0.2 C[S+](C)C HR135958 [2,0,0,0,0,0|2,0,0]=4 548 B3R0.2 C[Sb](C)C HR136634 [2,0,0,0,0,0|2,0,0]=4 549 B3R0.2 C[SiH](C)C HR100161 [2,0,0,0,0,0|1,1,0]=4 550 B3R0.2 C[SiH](C)Cl HR133238 [2,0,0,0,0,0|1,1,0]=4 551 B3R0.2 C[Sn](C)=O HR100537 [2,0,0,0,0,0|1,0,0]=3 552 B3R0.2 NC(=O)Cl HR134935 [2,0,0,0,0,0|2,0,0]=4 553 B3R0.2 NC(N)=O AZXF00309 [2,0,0,0,0,0|2,0,0]=4 554 B3R0.2 NC(N)=O HR127948 [2,0,0,0,0,0|2,0,0]=4 555 B3R0.2 NC(N)=O HR147742 [2,0,0,0,0,0|2,0,0]=4 556 B3R0.2 O=C(Cl)Cl HR128987 [2,0,0,0,0,0|2,0,0]=4 557 B3R0.2 O=C(O)O HR100793 [2,0,0,0,0,0|2,0,0]=4 558 B3R0.2 O=C([O-])O HR100655 [2,0,0,0,0,0|2,0,0]=4 559 B3R0.2 O=C([O-])O HR100759 [2,0,0,0,0,0|2,0,0]=4 560 B3R0.2 O=C([O-])O HR101616 [2,0,0,0,0,0|2,0,0]=4 561 B3R0.2 O=C([O-])O HR101676 [2,0,0,0,0,0|2,0,0]=4 562 B3R0.2 O=C([O-])O HR101797 [2,0,0,0,0,0|2,0,0]=4 563 B3R0.2 O=C([O-])O HR115471 [2,0,0,0,0,0|2,0,0]=4 564 B3R0.2 O=C([O-])O HR118195 [2,0,0,0,0,0|2,0,0]=4 565 B3R0.2 O=C([O-])O HR122654 [2,0,0,0,0,0|2,0,0]=4 566 B3R0.2 O=C([O-])[O-] FEXF010 [2,0,0,0,0,0|2,0,0]=4 567 B3R0.2 O=C([O-])[O-] HR100418 [2,0,0,0,0,0|2,0,0]=4 568 B3R0.2 O=C([O-])[O-] HR100733 [2,0,0,0,0,0|2,0,0]=4 569 B3R0.2 O=C([O-])[O-] HR100927 [2,0,0,0,0,0|2,0,0]=4 570 B3R0.2 O=C([O-])[O-] HR101351 [2,0,0,0,0,0|2,0,0]=4 571 B3R0.2 O=C([O-])[O-] HR101390 [2,0,0,0,0,0|2,0,0]=4 572 B3R0.2 O=C([O-])[O-] HR101416 [2,0,0,0,0,0|2,0,0]=4 573 B3R0.2 O=C([O-])[O-] HR101644 [2,0,0,0,0,0|2,0,0]=4 574 B3R0.2 O=C([O-])[O-] HR102880 [2,0,0,0,0,0|2,0,0]=4 575 B3R0.2 O=C([O-])[O-] HR103510 [2,0,0,0,0,0|2,0,0]=4 576 B3R0.2 O=C([O-])[O-] HR108875 [2,0,0,0,0,0|2,0,0]=4 577 B3R0.2 O=C([O-])[O-] HR121817 [2,0,0,0,0,0|2,0,0]=4 578 B3R0.2 O=C([O-])[O-] HR122918 [2,0,0,0,0,0|2,0,0]=4 579 B3R0.2 O=C([O-])[O-] HR128512 [2,0,0,0,0,0|2,0,0]=4 580 B3R0.2 O=C([O-])[O-] HR128774 [2,0,0,0,0,0|2,0,0]=4 581 B3R0.2 O=C([O-])[O-] HR128951 [2,0,0,0,0,0|2,0,0]=4 582 B3R0.2 O=C([O-])[O-] HR129215 [2,0,0,0,0,0|2,0,0]=4 583 B3R0.2 O=C([O-])[O-] HR129240 [2,0,0,0,0,0|2,0,0]=4 584 B3R0.2 O=C([O-])[O-] HR129495 [2,0,0,0,0,0|2,0,0]=4 585 B3R0.2 O=C([O-])[O-] HR129753 [2,0,0,0,0,0|2,0,0]=4 586 B3R0.2 O=C([O-])[O-] HR130070 [2,0,0,0,0,0|2,0,0]=4 587 B3R0.2 O=C([O-])[O-] HR132486 [2,0,0,0,0,0|2,0,0]=4 588 B3R0.2 O=C([O-])[O-] HR132642 [2,0,0,0,0,0|2,0,0]=4 589 B3R0.2 O=C([O-])[O-] HR137979 [2,0,0,0,0,0|2,0,0]=4 590 B3R0.2 O=C([O-])[O-] HR138144 [2,0,0,0,0,0|2,0,0]=4 591 B3R0.2 O=C([O-])[O-] HR138405 [2,0,0,0,0,0|2,0,0]=4 592 B3R0.2 O=C([O-])[O-] HR145434 [2,0,0,0,0,0|2,0,0]=4 593 B3R0.2 [Li]C(C)C HR113525 [2,0,0,0,0,0|1,0,1]=4 594 B5R0.3 C#CC(=O)OC HR133415 [1,1,0,0,0,0|0,0,2]=4 595 B5R0.3 C=C(C=O)CC HR137788 [1,1,0,0,0,0|0,0,2]=4 596 B5R0.3 C=CC(=O)CBr HR146340 [1,1,0,0,0,0|0,0,0]=2 597 B5R0.3 C=CC(=O)CBr HR146362 [1,1,0,0,0,0|0,0,0]=2 598 B5R0.3 C=CC(=O)OC LECQ00902 [1,1,0,0,0,0|0,0,0]=2 599 B5R0.3 C=CC(C)C#N HR106044 [1,1,0,0,0,0|1,0,1]=4 600 B5R0.3 C=CC(N)CO HR146014 [1,1,0,0,0,0|1,0,1]=4 601 B5R0.3 C=CC(O)CC HR132478 [1,1,0,0,0,0|0,0,2]=4 602 B5R0.3 C=CC(O)CN HR146126 [1,1,0,0,0,0|0,0,2]=4 603 B5R0.3 C=CC(O)CN HR146127 [1,1,0,0,0,0|0,0,2]=4 604 B5R0.3 C=CC(O)CN HR146128 [1,1,0,0,0,0|0,0,2]=4 605 B5R0.3 C=CC(O)CO HR120607 [1,1,0,0,0,0|0,0,2]=4 606 B5R0.3 CCC(=O)CBr HR101618 [1,1,0,0,0,0|0,0,1]=3 607 B5R0.3 CCC(=O)NC HR138361 [1,1,0,0,0,0|0,0,1]=3 608 B5R0.3 CCC(=S)OC HR134757 [1,1,0,0,0,0|0,1,1]=4 609 B5R0.3 CCC(C)C=O HR108130 [1,1,0,0,0,0|0,0,2]=4 610 B5R0.3 CCS(=O)CC HR101279 [1,1,0,0,0,0|1,0,1]=4 611 B5R0.3 CNC(=N)SC HR125414 [1,1,0,0,0,0|2,0,0]=4 612 B5R0.3 CNC(=O)CBr HR108109 [1,1,0,0,0,0|1,0,0]=3 613 B5R0.3 CNC(=O)NC HR124408 [1,1,0,0,0,0|1,0,0]=3 614 B5R0.3 CNC(=S)NC HR101565 [1,1,0,0,0,0|1,1,0]=4 615 B5R0.3 COC(=N)OC HR100139 [1,1,0,0,0,0|2,0,0]=4 616 B5R0.3 COC(=O)C=O HR131069 [1,1,0,0,0,0|1,0,0]=3 617 B5R0.3 COC(=O)CBr HR147010 [1,1,0,0,0,0|1,0,0]=3 618 B5R0.3 COC(=O)CCl HR147665 [1,1,0,0,0,0|1,0,0]=3 619 B5R0.3 COC(=O)CF HR147087 [1,1,0,0,0,0|1,0,0]=3 620 B5R0.3 COC(=O)CN VAJB00904 [1,1,0,0,0,0|1,0,0]=3 621 B5R0.3 COC(=O)CO HR136159 [1,1,0,0,0,0|1,0,0]=3 622 B5R0.3 COC(=O)CS HR136418 [1,1,0,0,0,0|1,0,0]=3 623 B5R0.3 COC(=O)NN HR17404 [1,1,0,0,0,0|2,0,0]=4 624 B5R0.3 COS(=O)OC HR128367 [1,1,0,0,0,0|2,0,0]=4 625 B5R0.3 CO[PH](=O)OC HR135600 [1,1,0,0,0,0|2,0,0]=4 626 B5R0.3 CS\C(C)=N\O HR131867 [1,1,0,0,0,0|1,0,1]=4 627 B5R0.3 C\C=C(\C)C=O HR112466 [1,1,0,0,0,0|0,0,0]=2 628 B5R0.3 C\C=C(\C)C=O HR139746 [1,1,0,0,0,0|0,0,0]=2 629 B5R0.3 C\C=C(\C)[Mg]Br HR118108 [1,1,0,0,0,0|1,0,0]=3 630 B5R0.3 N\C=C(/Cl)C=O HR110752 [1,1,0,0,0,0|2,0,0]=4 631 B5R0.3 O=C(CBr)CBr HR100914 [1,1,0,0,0,0|1,0,1]=4 632 B5R0.3 O=C(CCl)CCl HR147139 [1,1,0,0,0,0|1,0,1]=4 633 B5R0.3 O=C(CO)CO HR136414 [1,1,0,0,0,0|1,0,1]=4 634 B5R0.4 C=CC(C)(C)C HR133403 [1,1,0,0,0,0|1,0,1]=4 635 B5R0.4 C=CC(C)(C)O HR139173 [1,1,0,0,0,0|0,0,2]=4 636 B5R0.4 C=CP(=O)(Cl)Cl HR145595 [1,1,0,0,0,0|2,0,0]=4 637 B5R0.4 C=CP(=O)(O)O HR145223 [1,1,0,0,0,0|2,0,0]=4 638 B5R0.4 C=CS(=O)(=O)[O-] DIJL00101 [1,1,0,0,0,0|2,0,0]=4 639 B5R0.4 C=CS(C)(=O)=O HR125454 [1,1,0,0,0,0|1,0,0]=3 640 B5R0.4 C=C[Si](C)(C)C HR112606 [1,1,0,0,0,0|1,1,0]=4 641 B5R0.4 CCS(C)(=O)=O HR107675 [1,1,0,0,0,0|1,0,1]=4 642 B5R0.4 CNS(C)(=O)=O HR23217 [1,1,0,0,0,0|2,0,0]=4 643 B5R0.4 COS(C)(=O)=O HR131282 [1,1,0,0,0,0|2,0,0]=4 644 B5R0.4 CSS(C)(=O)=O HR111436 [1,1,0,0,0,0|2,0,0]=4 645 B5R0.5 C=C(C)C(=O)Cl HR138689 [1,1,0,0,0,0|1,0,0]=3 646 B5R0.5 C=C(C)C(=O)[O-] HR113778 [1,1,0,0,0,0|1,0,0]=3 647 B5R0.5 C=C(C)C(=O)[O-] HR114122 [1,1,0,0,0,0|1,0,0]=3 648 B5R0.5 C=C(C)C(=O)[O-] HR121033 [1,1,0,0,0,0|1,0,0]=3 649 B5R0.5 C=C(C)C(=O)[O-] HR122305 [1,1,0,0,0,0|1,0,0]=3 650 B5R0.5 C=C(C)C(=O)[O-] HR125115 [1,1,0,0,0,0|1,0,0]=3 651 B5R0.5 C=C(C)C(=O)[O-] HR135365 [1,1,0,0,0,0|1,0,0]=3 652 B5R0.5 C=C(C)C(N)=O HR124465 [1,1,0,0,0,0|1,0,0]=3 653 B5R0.5 C=C(Cl)C(=O)O HR132918 [1,1,0,0,0,0|1,0,0]=3 654 B5R0.5 C=C(Cl)C(=O)[O-] HR118858 [1,1,0,0,0,0|1,0,0]=3 655 B5R0.5 C=C(N)C(=O)O HR106545 [1,1,0,0,0,0|1,0,0]=3 656 B5R0.5 CC(=O)C(=O)O HR137803 [1,1,0,0,0,0|1,0,0]=3 657 B5R0.5 CC(=O)C(=O)[O-] HR112958 [1,1,0,0,0,0|1,0,0]=3 658 B5R0.5 CC(=O)C(=O)[O-] HR125137 [1,1,0,0,0,0|1,0,0]=3 659 B5R0.5 CC(=O)C(=O)[O-] HR130480 [1,1,0,0,0,0|1,0,0]=3 660 B5R0.5 CC(=O)C(=O)[O-] HR132795 [1,1,0,0,0,0|1,0,0]=3 661 B5R0.5 CC(=O)C(C)=O HR147207 [1,1,0,0,0,0|0,0,0]=2 662 B5R0.5 CC(=O)C(C)Br HR130439 [1,1,0,0,0,0|0,0,1]=3 663 B5R0.5 CC(=O)C(C)C HR147367 [1,1,0,0,0,0|0,0,1]=3 664 B5R0.5 CC(=O)C(C)Cl HR132014 [1,1,0,0,0,0|0,0,1]=3 665 B5R0.5 CC(=O)C(C)S HR123296 [1,1,0,0,0,0|0,0,1]=3 666 B5R0.5 CC(=O)N(C)C HR128416 [1,1,0,0,0,0|1,0,0]=3 667 B5R0.5 CC(Br)C(=O)Cl HR136180 [1,1,0,0,0,0|1,0,1]=4 668 B5R0.5 CC(Br)C(=O)O HR118834 [1,1,0,0,0,0|1,0,1]=4 669 B5R0.5 CC(Br)C(=O)O HR119145 [1,1,0,0,0,0|1,0,1]=4 670 B5R0.5 CC(C)C(=O)Cl DAJL01406 [1,1,0,0,0,0|1,0,1]=4 671 B5R0.5 CC(C)C(N)=O HR130010 [1,1,0,0,0,0|1,0,1]=4 672 B5R0.5 CC(Cl)C(=O)Cl HR127551 [1,1,0,0,0,0|1,0,1]=4 673 B5R0.5 CC(Cl)C(=O)O HR133703 [1,1,0,0,0,0|1,0,1]=4 674 B5R0.5 CC(Cl)C(=O)O HR5746 [1,1,0,0,0,0|1,0,1]=4 675 B5R0.5 CC(F)C(=O)O HR125319 [1,1,0,0,0,0|1,0,1]=4 676 B5R0.5 CC(N)C(=O)O HR127064 [1,1,0,0,0,0|1,0,1]=4 677 B5R0.5 CC(N)C(=O)O HR128842 [1,1,0,0,0,0|1,0,1]=4 678 B5R0.5 CC(N)C(=O)O HR135609 [1,1,0,0,0,0|1,0,1]=4 679 B5R0.5 CC(N)C(=O)O HR143449 [1,1,0,0,0,0|1,0,1]=4 680 B5R0.5 CC(N)C(N)=O HR121426 [1,1,0,0,0,0|1,0,1]=4 681 B5R0.5 CC(N)C(N)=O RAXM01501 [1,1,0,0,0,0|1,0,1]=4 682 B5R0.5 CC(N)[13C](=O)O HR144974 [1,1,0,0,0,0|1,0,1]=4 683 B5R0.5 CC(O)C(=O)O HR122637 [1,1,0,0,0,0|1,0,1]=4 684 B5R0.5 CC(O)C(=O)O HR124397 [1,1,0,0,0,0|1,0,1]=4 685 B5R0.5 CC(O)C(=O)O HR137557 [1,1,0,0,0,0|1,0,1]=4 686 B5R0.5 CC(O)C(=O)[O-] HR101208 [1,1,0,0,0,0|1,0,1]=4 687 B5R0.5 CC(O)C(=O)[O-] HR124337 [1,1,0,0,0,0|1,0,1]=4 688 B5R0.5 CC(O)C(=O)[O-] HR125547 [1,1,0,0,0,0|1,0,1]=4 689 B5R0.5 CC(O)C(=O)[O-] HR126089 [1,1,0,0,0,0|1,0,1]=4 690 B5R0.5 CC(O)C(=O)[O-] HR127008 [1,1,0,0,0,0|1,0,1]=4 691 B5R0.5 CC(O)C(=O)[O-] HR127541 [1,1,0,0,0,0|1,0,1]=4 692 B5R0.5 CC(O)C(=O)[O-] HR127693 [1,1,0,0,0,0|1,0,1]=4 693 B5R0.5 CC(O)C(=O)[O-] HR132263 [1,1,0,0,0,0|1,0,1]=4 694 B5R0.5 CC(O)C(N)=O HR103895 [1,1,0,0,0,0|1,0,1]=4 695 B5R0.5 CC(O)C(N)=O HR125386 [1,1,0,0,0,0|1,0,1]=4 696 B5R0.5 CN(C)C(N)=O HR126485 [1,1,0,0,0,0|2,0,0]=4 697 B5R0.5 C[13CH](N)C(=O)O HR143521 [1,1,0,0,0,0|1,0,1]=4 698 B5R0.5 NC(=O)C(N)=O HR106809 [1,1,0,0,0,0|2,0,0]=4 699 B5R0.5 O=C(Cl)C(=O)Cl TIJL03003 [1,1,0,0,0,0|2,0,0]=4 700 B5R0.5 O=C(O)C(=O)O HR123261 [1,1,0,0,0,0|2,0,0]=4 701 B5R0.5 O=C([O-])C(=O)O HR136858 [1,1,0,0,0,0|2,0,0]=4 702 B5R0.5 O=C([O-])C(=O)[O-] HR100686 [1,1,0,0,0,0|2,0,0]=4 703 B5R0.5 O=C([O-])C(=O)[O-] HR100962 [1,1,0,0,0,0|2,0,0]=4 704 B5R0.5 O=C([O-])C(=O)[O-] HR101005 [1,1,0,0,0,0|2,0,0]=4 705 B5R0.5 O=C([O-])C(=O)[O-] HR102573 [1,1,0,0,0,0|2,0,0]=4 706 B5R0.5 O=C([O-])C(=O)[O-] HR110849 [1,1,0,0,0,0|2,0,0]=4 707 B5R0.5 O=C([O-])C(=O)[O-] HR128357 [1,1,0,0,0,0|2,0,0]=4 708 B5R0.5 O=C([O-])C(=O)[O-] HR129686 [1,1,0,0,0,0|2,0,0]=4 709 B5R0.5 O=C([O-])C(=O)[O-] HR129949 [1,1,0,0,0,0|2,0,0]=4 710 B5R0.5 O=C([O-])C(=O)[O-] HR132963 [1,1,0,0,0,0|2,0,0]=4 711 B5R0.5 O=C([O-])C(=O)[O-] HR134379 [1,1,0,0,0,0|2,0,0]=4 712 B5R0.5 O=C([O-])C(=O)[O-] HR136084 [1,1,0,0,0,0|2,0,0]=4 713 B5R0.5 O=C([O-])C(=O)[O-] HR136170 [1,1,0,0,0,0|2,0,0]=4 714 B5R0.5 O=C([O-])C(=O)[O-] HR136344 [1,1,0,0,0,0|2,0,0]=4 715 B5R0.5 O=C([O-])C(=O)[O-] HR136431 [1,1,0,0,0,0|2,0,0]=4 716 B5R0.5 O=C([O-])C(=O)[O-] HR136606 [1,1,0,0,0,0|2,0,0]=4 717 B5R0.5 O=C([O-])C(=O)[O-] HR136689 [1,1,0,0,0,0|2,0,0]=4 718 B5R0.5 O=C([O-])C(=O)[O-] HR136946 [1,1,0,0,0,0|2,0,0]=4 719 B5R0.5 O=C([O-])C(=O)[O-] HR138096 [1,1,0,0,0,0|2,0,0]=4 720 B5R0.5 O=C([O-])C(=O)[O-] HR138340 [1,1,0,0,0,0|2,0,0]=4 721 B5R0.5 [13CH3]C(N)C(=O)O HR141384 [1,1,0,0,0,0|1,0,1]=4 722 B5R0.5 [13CH3]C(N)C(=O)O HR144202 [1,1,0,0,0,0|1,0,1]=4 723 B5R0.2 BrC\C=C\CBr HR122767 [1,1,0,0,0,0|1,0,1]=4 724 B5R0.2 C#C\C=C\CO HR117798 [1,1,0,0,0,0|0,0,2]=4 725 B5R0.2 CCO\C=C\Br ATXF02514 [1,1,0,0,0,0|1,0,1]=4 726 B5R0.2 CC\C=C\C=O HR111713 [1,1,0,0,0,0|0,0,0]=2 727 B5R0.2 CC\C=C\C=O HR139459 [1,1,0,0,0,0|0,0,0]=2 728 B5R0.2 CC\C=C\CBr HR102032 [1,1,0,0,0,0|0,0,1]=3 729 B5R0.2 CO\C=C\C#N HR122816 [1,1,0,0,0,0|1,0,1]=4 730 B5R0.2 C\C=C\CCC HR121014 [1,1,0,0,0,0|0,0,1]=3 731 B5R0.2 C\C=C\OCC HR128979 [1,1,0,0,0,0|0,0,1]=3 732 B5R0.2 ClC\C=C\CCl HR122427 [1,1,0,0,0,0|1,0,1]=4 733 B5R0.2 ClC\C=C\CCl HR131704 [1,1,0,0,0,0|1,0,1]=4 734 B5R0.2 NC\C=C\CO HR108338 [1,1,0,0,0,0|0,0,2]=4 735 B5R0.2 O=CCCC=O HR100601 [1,1,0,0,0,0|1,0,1]=4 736 B5R0.2 O=CNNC=O HR123173 [1,1,0,0,0,0|2,0,0]=4 737 B5R0.2 O=COCCO HR145529 [1,1,0,0,0,0|1,0,1]=4 738 B5R0.2 OC\C=C\CCl HR102138 [1,1,0,0,0,0|0,0,2]=4 739 B5R0.2 OC\C=C\CO HR109258 [1,1,0,0,0,0|0,0,2]=4 740 B5R0.2 OC\C=C\CO HR127834 [1,1,0,0,0,0|0,0,2]=4 741 B5R0.2 OC\C=C\CO HR134158 [1,1,0,0,0,0|0,0,2]=4 742 B7R0.2 CC(=O)NC(=O)CN HR100710 [0,2,0,0,0,0|1,0,0]=3 743 B7R0.2 CC(=O)OC(Br)CBr HR133286 [0,2,0,0,0,0|1,0,1]=4 744 B7R0.2 CC(=O)OC(Cl)CCl HR133017 [0,2,0,0,0,0|1,0,1]=4 745 B7R0.2 CC(=O)\C=C(\C)O[Ir] HR109248 [0,2,0,0,0,0|0,0,0]=2 746 B7R0.2 CC(=O)\C=C(\C)O[Rh] HR123460 [0,2,0,0,0,0|0,0,0]=2 747 B7R0.2 CC(=O)\C=C(\C)O[Rh] HR126751 [0,2,0,0,0,0|0,0,0]=2 748 B7R0.2 CC(C)NC(=O)CBr HR117083 [0,2,0,0,0,0|1,0,1]=4 749 B7R0.2 CC(C)OC(=O)CN HR105079 [0,2,0,0,0,0|1,0,1]=4 750 B7R0.2 CC(C)OC(=O)CN HR117760 [0,2,0,0,0,0|1,0,1]=4 751 B7R0.2 CC(C)OC(=O)CO HR105901 [0,2,0,0,0,0|1,0,1]=4 752 B7R0.2 CCC(=O)CC(C)=O HR133940 [0,2,0,0,0,0|0,0,1]=3 753 B7R0.2 CNC(=O)CC(C)=O HR100837 [0,2,0,0,0,0|0,0,1]=3 754 B7R0.2 CNC(=O)NC(=O)[O-] HR129298 [0,2,0,0,0,0|2,0,0]=4 755 B7R0.2 COC(=O)C=C(C)C HR125078 [0,2,0,0,0,0|0,0,0]=2 756 B7R0.2 COC(=O)CC(C)=O TECQ03701 [0,2,0,0,0,0|0,0,1]=3 757 B7R0.2 COC(=O)CC(C)N HR119861 [0,2,0,0,0,0|0,0,2]=4 758 B7R0.2 COC(=O)CC(C)N HR143484 [0,2,0,0,0,0|0,0,2]=4 759 B7R0.2 COC(=O)CC(C)O HR138815 [0,2,0,0,0,0|0,0,2]=4 760 B7R0.2 COC(=O)CC(N)=O HR118636 [0,2,0,0,0,0|1,0,1]=4 761 B7R0.2 COC(=O)\C=C(/C)N HR138334 [0,2,0,0,0,0|0,0,0]=2 762 B7R0.2 CSC(=O)CC(C)C HR122226 [0,2,0,0,0,0|0,0,2]=4 763 B7R0.3 C=CCOC(=O)CBr HR103697 [0,2,0,0,0,0|0,0,2]=4 764 B7R0.3 C=CCOC(=O)CCl HR132199 [0,2,0,0,0,0|0,0,2]=4 765 B7R0.3 CCCOC(=O)CC HR127273 [0,2,0,0,0,0|0,0,2]=4 766 B7R0.3 COC(=O)CCC=O HR116651 [0,2,0,0,0,0|1,0,1]=4 767 B7R0.3 COC(=O)CCCBr HR134912 [0,2,0,0,0,0|0,0,2]=4 768 B7R0.3 COC(=O)CCCCl HR131361 [0,2,0,0,0,0|0,0,2]=4 769 B7R0.3 COC(=O)CCCN HR105959 [0,2,0,0,0,0|0,0,2]=4 770 B7R0.3 COC(=O)\C=C\CBr HR131230 [0,2,0,0,0,0|0,0,0]=2 771 B7R0.3 COCCC(=O)OC HR130750 [0,2,0,0,0,0|0,0,2]=4 772 B7R0.3 CO\C=C\C(=O)OC HR100409 [0,2,0,0,0,0|0,0,0]=2 773 B7R0.3 CO\C=C\C(=O)OC HR123737 [0,2,0,0,0,0|0,0,0]=2 774 B7R0.3 C\C=C\CC(=O)OC HR127455 [0,2,0,0,0,0|0,0,0]=2 775 B7R0.5 C=C(C)C(=O)NCO HR114687 [0,2,0,0,0,0|2,0,0]=4 776 B7R0.5 CCCC(=O)C(=O)O HR138596 [0,2,0,0,0,0|1,0,1]=4 777 B7R0.5 CCCC(=O)C(C)=O HR139186 [0,2,0,0,0,0|0,0,1]=3 778 B7R0.5 CCCC(=O)C(C)C HR130078 [0,2,0,0,0,0|0,0,2]=4 779 B7R0.5 CCOC(=O)C(=O)Cl HR138954 [0,2,0,0,0,0|1,0,1]=4 780 B7R0.5 CCOC(=O)C(C)=O HR135005 [0,2,0,0,0,0|0,0,1]=3 781 B7R0.5 CCOC(=O)C(C)Br HR123330 [0,2,0,0,0,0|1,0,1]=4 782 B7R0.5 CCOC(=O)C(C)C BEJL02302 [0,2,0,0,0,0|1,0,1]=4 783 B7R0.5 CCOC(=O)C(C)F HR137458 [0,2,0,0,0,0|1,0,1]=4 784 B7R0.5 CCOC(=O)C(C)N HR113453 [0,2,0,0,0,0|1,0,1]=4 785 B7R0.5 CCOC(=O)C(C)N HR123317 [0,2,0,0,0,0|1,0,1]=4 786 B7R0.5 CCOC(=O)C(C)N HR129365 [0,2,0,0,0,0|1,0,1]=4 787 B7R0.5 CCOC(=O)C(C)O HR100136 [0,2,0,0,0,0|1,0,1]=4 788 B7R0.5 CCOC(=O)C(C)O HR15558 [0,2,0,0,0,0|1,0,1]=4 789 B7R0.5 CCOC(=O)C(C)S HR126591 [0,2,0,0,0,0|1,0,1]=4 790 B7R0.5 CCOC(=O)C(F)Br HR137876 [0,2,0,0,0,0|1,0,1]=4 791 B7R0.5 CCOC(=O)C(F)Cl HR115827 [0,2,0,0,0,0|1,0,1]=4 792 B7R0.5 CCOC(=O)C(F)F HR123633 [0,2,0,0,0,0|1,0,1]=4 793 B7R0.5 CCOC(=S)C(N)=O HR125905 [0,2,0,0,0,0|1,0,1]=4 794 B7R0.5 CC\C=C(\C)C(=O)O HR131305 [0,2,0,0,0,0|0,0,1]=3 795 B7R0.5 CC\C=C(\C)C(=O)O HR138938 [0,2,0,0,0,0|0,0,1]=3 796 B7R0.7 C=C=CC(=O)OCC HR108306 [0,2,0,0,0,0|0,0,2]=4 797 B7R0.7 C=COC(=O)\C=C\C HR129020 [0,2,0,0,0,0|0,0,1]=3 798 B7R0.7 CC#CC(=O)OCC HR127977 [0,2,0,0,0,0|0,0,2]=4 799 B7R0.7 CCCC(=O)OCCl HR123267 [0,2,0,0,0,0|0,0,2]=4 800 B7R0.7 CCNC(=O)NCC HR128759 [0,2,0,0,0,0|1,0,1]=4 801 B7R0.7 CCOC(=O)CCBr HR132284 [0,2,0,0,0,0|1,0,1]=4 802 B7R0.7 CCOC(=O)CCCl HR147079 [0,2,0,0,0,0|1,0,1]=4 803 B7R0.7 CCOC(=O)CCI HR101944 [0,2,0,0,0,0|1,0,1]=4 804 B7R0.7 CCOC(=O)CCN HR129110 [0,2,0,0,0,0|1,0,1]=4 805 B7R0.7 CCOC(=O)CCS HR135162 [0,2,0,0,0,0|1,0,1]=4 806 B7R0.7 CCOC(=O)CNC HR138266 [0,2,0,0,0,0|1,0,1]=4 807 B7R0.7 CCOC(=O)CNN HR128003 [0,2,0,0,0,0|1,0,1]=4 808 B7R0.7 CCOC(=O)COC HR123443 [0,2,0,0,0,0|1,0,1]=4 809 B7R0.7 CCOC(=O)OCCl HR138904 [0,2,0,0,0,0|1,0,1]=4 810 B7R0.7 CCOC(=O)\C=C\I HR11670 [0,2,0,0,0,0|1,0,0]=3 811 B7R0.7 [C-]#[N+]CC(=O)OCC HR146955 [0,2,0,0,0,0|1,0,1]=4 812 B7R0.10 C=C(C#N)C(=O)OC HR100211 [0,2,0,0,0,0|1,0,1]=4 813 B7R0.10 C=C(CBr)C(=O)OC HR111903 [0,2,0,0,0,0|1,0,1]=4 814 B7R0.10 C=C(CCl)C(=O)OC HR109145 [0,2,0,0,0,0|1,0,1]=4 815 B7R0.10 C=C(CO)C(=O)OC HR105042 [0,2,0,0,0,0|1,0,1]=4 816 B7R0.10 CCC(=O)C(=O)CC HR122518 [0,2,0,0,0,0|0,0,1]=3 817 B7R0.10 CCC(Br)C(=O)OC HR123363 [0,2,0,0,0,0|0,0,2]=4 818 B7R0.10 CCC(C)C(=O)OC HR133876 [0,2,0,0,0,0|0,0,2]=4 819 B7R0.10 CCC(C)C(=O)OC HR143721 [0,2,0,0,0,0|0,0,2]=4 820 B7R0.10 CCC(C)C(=O)SC HR105243 [0,2,0,0,0,0|0,0,2]=4 821 B7R0.10 CCC(O)C(=O)OC HR144357 [0,2,0,0,0,0|0,0,2]=4 822 B7R0.10 COC(=O)C(=O)CBr HR122614 [0,2,0,0,0,0|1,0,0]=3 823 B7R0.10 COC(=O)C(=O)OC HR147608 [0,2,0,0,0,0|1,0,0]=3 824 B7R0.10 COC(=O)C(O)OC HR135004 [0,2,0,0,0,0|1,0,1]=4 825 B7R0.10 COC(=O)N(C)OC HR148866 [0,2,0,0,0,0|2,0,0]=4 826 B7R0.10 CON(C)C(=O)CCl HR107841 [0,2,0,0,0,0|2,0,0]=4 827 B7R0.10 C\C=C(/C)C(=O)OC HR129001 [0,2,0,0,0,0|0,0,0]=2 828 B7R0.9 CC(=O)CC(C)(C)S HR124484 [0,2,0,0,0,0|0,0,2]=4 829 B7R0.9 CC(=O)N[Si](C)(C)C HR144225 [0,2,0,0,0,0|1,1,0]=4 830 B7R0.9 CC(=O)OC(C)(C)C HR147076 [0,2,0,0,0,0|1,0,1]=4 831 B7R0.9 CC(=O)O[Si](C)(C)C HR141690 [0,2,0,0,0,0|1,1,0]=4 832 B7R0.16 C=C(C)C(=O)N(C)C HR143638 [0,2,0,0,0,0|2,0,0]=4 833 B7R0.16 CC(=O)C(=O)C(C)C HR141113 [0,2,0,0,0,0|0,0,1]=3 834 B7R0.16 CC(=O)C(C)C(C)=O HR142176 [0,2,0,0,0,0|0,0,1]=3 835 B7R0.16 CC(=O)C(Cl)C(C)=O HR147348 [0,2,0,0,0,0|0,0,1]=3 836 B7R0.16 CC(C)=C(Cl)N(C)C HR104790 [0,2,0,0,0,0|2,0,0]=4 837 B7R0.16 CC(C)C(=O)C(=O)O HR136485 [0,2,0,0,0,0|1,0,1]=4 838 B7R0.16 CC(C)C(=O)C(=O)[O-] HR127707 [0,2,0,0,0,0|1,0,1]=4 839 B7R0.16 CC(C)C(=O)C(=O)[O-] HR137721 [0,2,0,0,0,0|1,0,1]=4 840 B7R0.16 CN(C)C(=O)C(=O)O HR118982 [0,2,0,0,0,0|2,0,0]=4 841 B7R0.16 CN(C)C(=O)C(N)=O HR128536 [0,2,0,0,0,0|2,0,0]=4 842 B7R0.16 O=C(O)C(=O)C(=O)O HR145722 [0,2,0,0,0,0|2,0,0]=4 843 B7R0.15 COC(OC)C(C)=O HR9977 [0,2,0,0,0,0|1,0,1]=4 844 B7R0.4 C=C\C=C\OC(C)=O HR141489 [0,2,0,0,0,0|0,0,1]=3 845 B7R0.4 CC(=O)CCCCBr HR125447 [0,2,0,0,0,0|0,0,2]=4 846 B7R0.4 CC(=O)CCCCCl HR124124 [0,2,0,0,0,0|0,0,2]=4 847 B7R0.4 CC(=O)OCCCCl HR130837 [0,2,0,0,0,0|0,0,2]=4 848 B7R0.4 CCC\C=C\C(C)=O HR30170 [0,2,0,0,0,0|0,0,0]=2 849 B7R0.4 CCOCC=C(C)C HR111947 [0,2,0,0,0,0|1,0,1]=4 850 B7R0.4 CCO[SiH2]C=C(C)C HR136449 [0,2,0,0,0,0|1,0,1]=4 851 B7R0.4 CCO\C=C\C(=O)Cl HR144705 [0,2,0,0,0,0|1,0,0]=3 852 B7R0.4 CCO\C=C\C(=O)O HR20958 [0,2,0,0,0,0|1,0,0]=3 853 B7R0.4 CC\C=C\CC(=O)O HR109903 [0,2,0,0,0,0|1,0,0]=3 854 B7R0.4 C\C=C\C=C\C(=O)O HR125524 [0,2,0,0,0,0|1,0,0]=3 855 B7R0.4 C\C=C\C=C\C(=O)[O-] HR124997 [0,2,0,0,0,0|1,0,0]=3 856 B7R0.4 C\C=C\C=C\C(=O)[O-] HR125264 [0,2,0,0,0,0|1,0,0]=3 857 B7R0.6 C=C(C)COC(C)=O HR110682 [0,2,0,0,0,0|0,0,1]=3 858 B7R0.6 CC(=O)CCC(=O)O HR127576 [0,2,0,0,0,0|1,0,1]=4 859 B7R0.6 CC(=O)CCC(=O)[O-] HR143916 [0,2,0,0,0,0|1,0,1]=4 860 B7R0.6 CC(=O)CCC(C)=O HR125376 [0,2,0,0,0,0|0,0,1]=3 861 B7R0.6 CC(=O)CNC(C)=O HR146276 [0,2,0,0,0,0|0,0,1]=3 862 B7R0.6 CC(=O)COC(C)=O HR123551 [0,2,0,0,0,0|0,0,1]=3 863 B7R0.6 CC(=O)NCC(=O)O HR138579 [0,2,0,0,0,0|1,0,1]=4 864 B7R0.6 CC(=O)NNC(C)=O HR131799 [0,2,0,0,0,0|1,0,0]=3 865 B7R0.6 CC(=O)OCC(=O)Cl HR135462 [0,2,0,0,0,0|1,0,1]=4 866 B7R0.6 CC(=O)OCC(=O)O HR120464 [0,2,0,0,0,0|1,0,1]=4 867 B7R0.6 CC(=O)\C=C\C(C)C HR142759 [0,2,0,0,0,0|0,0,0]=2 868 B7R0.6 CC(C)=CC=C(C)C HR147224 [0,2,0,0,0,0|1,0,0]=3 869 B7R0.6 CC(C)=CC=C(Cl)Cl HR111834 [0,2,0,0,0,0|1,0,1]=4 870 B7R0.6 CC(C)=CCC(=O)O HR108591 [0,2,0,0,0,0|1,0,0]=3 871 B7R0.6 CC(C)=NNC(N)=O AZXF00311 [0,2,0,0,0,0|2,0,0]=4 872 B7R0.6 CC(C)\C=C\C(=O)[O-] HR107648 [0,2,0,0,0,0|1,0,0]=3 873 B7R0.6 NC(=O)\C=C\C(=O)O HR128108 [0,2,0,0,0,0|1,0,1]=4 874 B7R0.6 NC(=O)\C=C\C(N)=O HR101772 [0,2,0,0,0,0|1,0,1]=4 875 B7R0.6 O=C(O)\C=C\C(=O)O AVCQ00606 [0,2,0,0,0,0|1,0,1]=4 876 B7R0.6 O=C(O)\C=C\C(=O)O HR130667 [0,2,0,0,0,0|1,0,1]=4 877 B7R0.6 O=C(O)\C=C\C(=O)O HR144505 [0,2,0,0,0,0|1,0,1]=4 878 B7R0.6 O=C([O-])\C=C\C(=O)O HR126362 [0,2,0,0,0,0|1,0,1]=4 879 B7R0.6 O=C([O-])\C=C\C(=O)O HR126685 [0,2,0,0,0,0|1,0,1]=4 880 B7R0.6 O=C([O-])\C=C\C(=O)O HR136832 [0,2,0,0,0,0|1,0,1]=4 881 B7R0.6 O=C([O-])\C=C\C(=O)[O-] HR100090 [0,2,0,0,0,0|1,0,1]=4 882 B7R0.6 O=C([O-])\C=C\C(=O)[O-] HR101400 [0,2,0,0,0,0|1,0,1]=4 883 B7R0.6 O=C([O-])\C=C\C(=O)[O-] HR108567 [0,2,0,0,0,0|1,0,1]=4 884 B7R0.6 O=C([O-])\C=C\C(=O)[O-] HR141890 [0,2,0,0,0,0|1,0,1]=4 885 B7R0.8 C[Si](C)(C)\C=C\CO HR141344 [0,2,0,0,0,0|1,1,0]=4 886 B5R1.2 O=C1CCC1 HR9021 [1,0,0,1,0,0|0,0,1]=3 887 B5R1.2 O=C1CCN1 HR128794 [1,0,0,1,0,0|1,0,0]=3 888 B5R1.2 O=C1CCO1 HR101496 [1,0,0,1,0,0|1,0,0]=3 889 B5R1.2 O=C1CNC1 HR108729 [1,0,0,1,0,0|1,0,1]=4 890 B5R1.2 O=C1CNC1 HR114873 [1,0,0,1,0,0|1,0,1]=4 891 B5R1.2 O=C1COC1 HR111276 [1,0,0,1,0,0|1,0,1]=4 892 B5R1.2 O=C1CSC1 HR105015 [1,0,0,1,0,0|1,0,1]=4 893 B5R1.1 C1=CCNC1 HR105680 [1,0,0,1,0,0|1,0,1]=4 894 B5R1.1 C1=CCNC1 HR134578 [1,0,0,1,0,0|1,0,1]=4 895 B5R1.1 C1=CCOC1 HR126187 [1,0,0,1,0,0|0,0,2]=4 896 B5R1.1 C1=CNC=C1 HR147707 [1,0,0,1,0,0|1,0,1]=4 897 B5R1.1 C1=CNN=C1 HR127099 [1,0,0,1,0,0|2,0,0]=4 898 B5R1.1 C1=COCC1 CEJL02606 [1,0,0,1,0,0|1,0,0]=3 899 B5R1.1 C1=CON=C1 HR8623 [1,0,0,1,0,0|1,0,1]=4 900 B5R1.1 C1=CSC=C1 HR147733 [1,0,0,1,0,0|0,1,1]=4 901 B5R1.1 C1=CSN=C1 HR114528 [1,0,0,1,0,0|1,1,0]=4 902 B5R1.1 C1=C[CH-]C=C1 HR101505 [1,0,0,1,0,0|0,0,2]=4 903 B5R1.1 C1=C[CH-]C=C1 HR138115 [1,0,0,1,0,0|0,0,2]=4 904 B5R1.1 C1=C[CH-]C=C1 HR141305 [1,0,0,1,0,0|0,0,2]=4 905 B5R1.1 C1=C[CH-]C=C1 HR144503 [1,0,0,1,0,0|0,0,2]=4 906 B7R1.1 BrCC1=CC=CS1 HR107794 [0,1,0,1,0,0|0,1,1]=4 907 B7R1.1 BrCC1=CC=NN1 HR119316 [0,1,0,1,0,0|2,0,0]=4 908 B7R1.1 BrCC1=CC=NO1 HR111380 [0,1,0,1,0,0|1,0,1]=4 909 B7R1.1 BrCC1=COC=C1 HR105237 [0,1,0,1,0,0|2,0,0]=4 910 B7R1.1 BrCC1=CSC=C1 HR126049 [0,1,0,1,0,0|2,0,0]=4 911 B7R1.1 CCC1=CC=CO1 HR125873 [0,1,0,1,0,0|0,0,2]=4 912 B7R1.1 CCC1=CC=CS1 HR111385 [0,1,0,1,0,0|0,1,1]=4 913 B7R1.1 CCC1=CSC=C1 HR124094 [0,1,0,1,0,0|2,0,0]=4 914 B7R1.1 COC1=CC=CS1 HR128854 [0,1,0,1,0,0|0,1,1]=4 915 B7R1.1 COC1=CSC=C1 HR138278 [0,1,0,1,0,0|2,0,0]=4 916 B7R1.1 CSC1=CC=CS1 HR119424 [0,1,0,1,0,0|0,1,1]=4 917 B7R1.1 CSC1=CSC=C1 HR153189 [0,1,0,1,0,0|2,0,0]=4 918 B7R1.1 ClCC1=CC=CS1 HR130983 [0,1,0,1,0,0|0,1,1]=4 919 B7R1.1 ClCC1=CC=NO1 HR106390 [0,1,0,1,0,0|1,0,1]=4 920 B7R1.1 ClCC1=COC=C1 HR104894 [0,1,0,1,0,0|2,0,0]=4 921 B7R1.1 ClCC1=NNC=C1 HR31924 [0,1,0,1,0,0|2,0,0]=4 922 B7R1.1 NCC1=CC=CN1 HR148675 [0,1,0,1,0,0|1,0,1]=4 923 B7R1.1 NCC1=CC=CS1 HR128270 [0,1,0,1,0,0|0,1,1]=4 924 B7R1.1 NCC1=CC=NN1 HR14846 [0,1,0,1,0,0|2,0,0]=4 925 B7R1.1 NCC1=CC=NO1 HR104828 [0,1,0,1,0,0|1,0,1]=4 926 B7R1.1 NCC1=CSC=C1 HR134337 [0,1,0,1,0,0|2,0,0]=4 927 B7R1.1 NCC1=NNC=C1 HR110853 [0,1,0,1,0,0|2,0,0]=4 928 B7R1.1 NCC1=NSC=C1 HR102659 [0,1,0,1,0,0|2,0,0]=4 929 B7R1.1 NCC1C=CCO1 HR104311 [0,1,0,1,0,0|0,0,2]=4 930 B7R1.1 NCc1ccno1 HR111646 [0,1,0,1,0,0|1,0,1]=4 931 B7R1.1 O=CC1=CC=CN1 HR133248 [0,1,0,1,0,0|1,0,1]=4 932 B7R1.1 O=CC1=CC=CO1 HR147284 [0,1,0,1,0,0|1,0,1]=4 933 B7R1.1 O=CC1=CCSC1 HR113279 [0,1,0,1,0,0|1,0,1]=4 934 B7R1.1 O=CC1=CNC=C1 HR129921 [0,1,0,1,0,0|1,0,1]=4 935 B7R1.1 O=CC1=COC=C1 HR125211 [0,1,0,1,0,0|1,0,1]=4 936 B7R1.1 O=CC1=CSC=C1 HR126177 [0,1,0,1,0,0|1,0,1]=4 937 B7R1.1 O=CC1=NNC=C1 HR114992 [0,1,0,1,0,0|2,0,0]=4 938 B7R1.1 O=CC1=NOC=C1 HR109323 [0,1,0,1,0,0|2,0,0]=4 939 B7R1.1 O=Cc1cccs1 HR125923 [0,1,0,1,0,0|1,0,1]=4 940 B7R1.1 OCC1=CC=CO1 HR147620 [0,1,0,1,0,0|0,0,2]=4 941 B7R1.1 OCC1=CC=CS1 HR136423 [0,1,0,1,0,0|0,1,1]=4 942 B7R1.1 OCC1=CC=NN1 HR118693 [0,1,0,1,0,0|2,0,0]=4 943 B7R1.1 OCC1=CC=NO1 HR105454 [0,1,0,1,0,0|1,0,1]=4 944 B7R1.1 OCC1=CC=NS1 HR114846 [0,1,0,1,0,0|1,1,0]=4 945 B7R1.1 OCC1=COC=C1 HR124594 [0,1,0,1,0,0|2,0,0]=4 946 B7R1.1 OCC1=CSC=C1 HR123712 [0,1,0,1,0,0|2,0,0]=4 947 B7R1.1 SCC1=CC=CS1 HR139099 [0,1,0,1,0,0|0,1,1]=4 948 B7R1.2 CC1=CC(=O)CC1 HR137516 [0,1,0,1,0,0|0,0,0]=2 949 B7R1.2 CC1=CC(=O)CO1 HR119186 [0,1,0,1,0,0|0,0,0]=2 950 B7R1.2 CC1=CC(=O)NN1 HR133409 [0,1,0,1,0,0|1,0,0]=3 951 B7R1.2 CC1=CC(=O)OC1 HR118210 [0,1,0,1,0,0|0,0,0]=2 952 B7R1.2 CC1=CC(Br)=CS1 HR129329 [0,1,0,1,0,0|0,1,1]=4 953 B7R1.2 CC1=CC(Br)=NN1 HR109901 [0,1,0,1,0,0|2,0,0]=4 954 B7R1.2 CC1=CC(C)=NN1 HR122101 [0,1,0,1,0,0|1,0,0]=3 955 B7R1.2 CC1=CC(C)=NO1 HR126201 [0,1,0,1,0,0|0,0,1]=3 956 B7R1.2 CC1=CC(N)=CS1 HR107971 [0,1,0,1,0,0|0,1,1]=4 957 B7R1.2 CC1=CC(N)=NN1 HR128329 [0,1,0,1,0,0|2,0,0]=4 958 B7R1.2 CC1=CC(N)=NO1 HR134442 [0,1,0,1,0,0|1,0,1]=4 959 B7R1.2 CC1=CC=C(Br)O1 HR117458 [0,1,0,1,0,0|0,0,2]=4 960 B7R1.2 CC1=CC=C(Br)S1 HR138580 [0,1,0,1,0,0|0,1,1]=4 961 B7R1.2 CC1=CC=C(C)N1 HR127998 [0,1,0,1,0,0|1,0,0]=3 962 B7R1.2 CC1=CC=C(C)S1 HR126900 [0,1,0,1,0,0|0,1,0]=3 963 B7R1.2 CC1=CC=C(Cl)S1 HR122756 [0,1,0,1,0,0|0,1,1]=4 964 B7R1.2 CC1=CC=C(I)S1 HR103673 [0,1,0,1,0,0|0,1,1]=4 965 B7R1.2 CC1=CCC(=O)O1 HR136942 [0,1,0,1,0,0|1,0,0]=3 966 B7R1.2 CC1=CN(C)N=C1 HR139700 [0,1,0,1,0,0|2,0,0]=4 967 B7R1.2 CC1=CN=C(Br)S1 HR106549 [0,1,0,1,0,0|1,1,0]=4 968 B7R1.2 CC1=CN=C(C)S1 HR137694 [0,1,0,1,0,0|0,1,0]=3 969 B7R1.2 CC1=CN=C(Cl)S1 HR146612 [0,1,0,1,0,0|1,1,0]=4 970 B7R1.2 CC1=CN=C(N)N1 HR113658 [0,1,0,1,0,0|2,0,0]=4 971 B7R1.2 CC1=CN=C(N)O1 HR115333 [0,1,0,1,0,0|1,0,1]=4 972 B7R1.2 CC1=CN=C(N)S1 HR132017 [0,1,0,1,0,0|1,1,0]=4 973 B7R1.2 CC1=CNC(C)=C1 HR129042 [0,1,0,1,0,0|1,0,0]=3 974 B7R1.2 CC1=CNC(C)=N1 HR126305 [0,1,0,1,0,0|1,0,0]=3 975 B7R1.2 CC1=CNC(I)=N1 HR122057 [0,1,0,1,0,0|2,0,0]=4 976 B7R1.2 CC1=COC(N)=N1 HR115657 [0,1,0,1,0,0|2,0,0]=4 977 B7R1.2 CC1=CSC(Br)=N1 HR115963 [0,1,0,1,0,0|2,0,0]=4 978 B7R1.2 CC1=CSC(C)=C1 HR101719 [0,1,0,1,0,0|0,1,0]=3 979 B7R1.2 CC1=CSC(C)=N1 HR133885 [0,1,0,1,0,0|1,0,0]=3 980 B7R1.2 CC1=CSC(N)=C1 HR103206 [0,1,0,1,0,0|1,0,1]=4 981 B7R1.2 CC1=CSC(N)=N1 HR100077 [0,1,0,1,0,0|2,0,0]=4 982 B7R1.2 CC1=CSC(N)=N1 HR125241 [0,1,0,1,0,0|2,0,0]=4 983 B7R1.2 CC1=NC(Br)=CN1 HR138270 [0,1,0,1,0,0|2,0,0]=4 984 B7R1.2 CC1=NC(Br)=CS1 HR108281 [0,1,0,1,0,0|2,0,0]=4 985 B7R1.2 CC1=NC(I)=CN1 HR111898 [0,1,0,1,0,0|2,0,0]=4 986 B7R1.2 CC1=NC(I)=CS1 HR30651 [0,1,0,1,0,0|2,0,0]=4 987 B7R1.2 CC1=NC=C(Br)S1 HR106603 [0,1,0,1,0,0|1,1,0]=4 988 B7R1.2 CC1=NC=C(I)S1 HR30443 [0,1,0,1,0,0|1,1,0]=4 989 B7R1.2 CC1=NC=C(N)S1 HR118663 [0,1,0,1,0,0|1,1,0]=4 990 B7R1.2 CC1=NN(C)C=C1 HR9119 [0,1,0,1,0,0|1,0,0]=3 991 B7R1.2 CC1=NNC(=O)C1 HR133577 [0,1,0,1,0,0|1,0,0]=3 992 B7R1.2 CC1=NNC(=O)O1 HR134101 [0,1,0,1,0,0|2,0,0]=4 993 B7R1.2 CC1=NNC(C)=N1 HR121391 [0,1,0,1,0,0|2,0,0]=4 994 B7R1.2 CC1=NNC(Cl)=C1 HR121939 [0,1,0,1,0,0|2,0,0]=4 995 B7R1.2 CC1=NOC(N)=C1 HR125110 [0,1,0,1,0,0|1,0,1]=4 996 B7R1.2 CC1=NSC(N)=C1 HR105438 [0,1,0,1,0,0|1,1,0]=4 997 B7R1.2 CC1=NSC(N)=C1 HR105753 [0,1,0,1,0,0|1,1,0]=4 998 B7R1.2 CC1CCC(=O)O1 HR126256 [0,1,0,1,0,0|1,0,1]=4 999 B7R1.2 CC1CNC(=O)C1 HR146359 [0,1,0,1,0,0|0,0,2]=4 1000 B7R1.2 CC1CNC(=O)C1 HR146360 [0,1,0,1,0,0|0,0,2]=4 1001 B7R1.2 CC1CNC(=O)C1 HR146369 [0,1,0,1,0,0|0,0,2]=4 1002 B7R1.2 CC1COC(=O)O1 HR125363 [0,1,0,1,0,0|1,0,1]=4 1003 B7R1.2 CC1COC(=O)O1 HR128407 [0,1,0,1,0,0|1,0,1]=4 1004 B7R1.2 CC1COC(=O)O1 HR129273 [0,1,0,1,0,0|1,0,1]=4 1005 B7R1.2 CN1C=CC(Br)=N1 HR119318 [0,1,0,1,0,0|2,0,0]=4 1006 B7R1.2 CN1C=CC(I)=N1 HR32790 [0,1,0,1,0,0|2,0,0]=4 1007 B7R1.2 CN1C=CC(N)=N1 HR9118 [0,1,0,1,0,0|2,0,0]=4 1008 B7R1.2 CN1C=C[N+](C)=C1 HR103731 [0,1,0,1,0,0|2,0,0]=4 1009 B7R1.2 CN1CCC(=O)C1 HR102484 [0,1,0,1,0,0|0,0,2]=4 1010 B7R1.2 Cc1cc(=O)no1 HR137393 [0,1,0,1,0,0|1,0,0]=3 1011 B7R1.2 Cc1coc(C)n1 HR130593 [0,1,0,1,0,0|1,0,0]=3 1012 B7R1.2 NC1=CC(=O)NN1 HR148354 [0,1,0,1,0,0|2,0,0]=4 1013 B7R1.2 NC1=NC(=O)CS1 HR101133 [0,1,0,1,0,0|2,0,0]=4 1014 B7R1.2 NC1CCC(=O)C1 HR145995 [0,1,0,1,0,0|0,0,2]=4 1015 B7R1.2 NC1COC(=O)C1 HR14757 [0,1,0,1,0,0|1,0,1]=4 1016 B7R1.2 NC1COC(=O)C1 HR14758 [0,1,0,1,0,0|1,0,1]=4 1017 B7R1.2 O=C1C=C(O)CN1 HR104155 [0,1,0,1,0,0|1,0,0]=3 1018 B7R1.2 O=C1C=C(O)CO1 HR100679 [0,1,0,1,0,0|1,0,0]=3 1019 B7R1.2 O=C1C=CC(=O)N1 HR130748 [0,1,0,1,0,0|1,0,1]=4 1020 B7R1.2 O=C1C=CC(=O)O1 HR146919 [0,1,0,1,0,0|1,0,1]=4 1021 B7R1.2 O=C1CC(O)CN1 HR138458 [0,1,0,1,0,0|1,0,1]=4 1022 B7R1.2 O=C1CC(O)CN1 HR138722 [0,1,0,1,0,0|1,0,1]=4 1023 B7R1.2 O=C1CC(O)CN1 HR145864 [0,1,0,1,0,0|1,0,1]=4 1024 B7R1.2 O=C1CC(O)CO1 HR126625 [0,1,0,1,0,0|1,0,1]=4 1025 B7R1.2 O=C1CC(O)CO1 HR127054 [0,1,0,1,0,0|1,0,1]=4 1026 B7R1.2 O=C1CC(S)CN1 HR112550 [0,1,0,1,0,0|1,0,1]=4 1027 B7R1.2 O=C1CCC(=O)C1 HR130125 [0,1,0,1,0,0|0,0,1]=3 1028 B7R1.2 O=C1CCC(=O)N1 HR135734 [0,1,0,1,0,0|1,0,0]=3 1029 B7R1.2 O=C1CCC(=O)O1 HR135468 [0,1,0,1,0,0|1,0,0]=3 1030 B7R1.2 O=C1CNC(=O)N1 HR128930 [0,1,0,1,0,0|2,0,0]=4 1031 B7R1.2 O=C1COC(=O)C1 HR100364 [0,1,0,1,0,0|1,0,1]=4 1032 B7R1.2 O=C1COC(=O)N1 HR103401 [0,1,0,1,0,0|2,0,0]=4 1033 B7R1.2 O=C1CSC(=O)N1 HR137564 [0,1,0,1,0,0|2,0,0]=4 1034 B7R1.2 O=C1CSC(=S)N1 HR125272 [0,1,0,1,0,0|2,0,0]=4 1035 B7R1.3 BrC1=CCCCC1 HR156605 [0,1,0,1,0,0|1,0,1]=4 1036 B7R1.3 BrC1C=CCCC1 HR103088 [0,1,0,1,0,0|1,0,1]=4 1037 B7R1.3 CC1=CC=CC=C1 HR141847 [0,1,0,1,0,0|1,0,1]=4 1038 B7R1.3 CC1=CC=CN=N1 HR118859 [0,1,0,1,0,0|1,0,1]=4 1039 B7R1.3 CC1=CC=NC=C1 ABXF00108 [0,1,0,1,0,0|1,0,1]=4 1040 B7R1.3 CC1=CCC=CC1 HR142661 [0,1,0,1,0,0|1,0,0]=3 1041 B7R1.3 CC1=CCCCC1 HR143913 [0,1,0,1,0,0|1,0,1]=4 1042 B7R1.3 CC1=CN=CN=C1 HR7207 [0,1,0,1,0,0|2,0,0]=4 1043 B7R1.3 CC1=CN=NC=C1 HR131519 [0,1,0,1,0,0|2,0,0]=4 1044 B7R1.3 CC1=NC=CC=C1 HR147066 [0,1,0,1,0,0|1,0,1]=4 1045 B7R1.3 CC1=NC=CC=N1 HR127988 [0,1,0,1,0,0|1,0,1]=4 1046 B7R1.3 CC1=NC=CN=C1 HR129440 [0,1,0,1,0,0|1,0,1]=4 1047 B7R1.3 CC1=NC=NC=C1 HR134623 [0,1,0,1,0,0|1,0,1]=4 1048 B7R1.3 CN1CC=CCC1 HR147169 [0,1,0,1,0,0|2,0,0]=4 1049 B7R1.3 Cc1ccccn1 HR136839 [0,1,0,1,0,0|1,0,1]=4 1050 B7R1.3 ClC1=CCCCC1 HR129641 [0,1,0,1,0,0|1,0,1]=4 1051 B7R1.3 O=C1C=CC=NN1 HR137023 [0,1,0,1,0,0|1,0,1]=4 1052 B7R1.3 O=C1C=CCCC1 HR146309 [0,1,0,1,0,0|0,0,0]=2 1053 B7R1.3 O=C1CCCCC1 SIJL01002 [0,1,0,1,0,0|0,0,2]=4 1054 B7R1.3 O=C1CCCCN1 HR126393 [0,1,0,1,0,0|0,0,2]=4 1055 B7R1.3 O=C1CCCCO1 HR128412 [0,1,0,1,0,0|0,0,2]=4 1056 B7R1.3 O=C1CCCNC1 HR108093 [0,1,0,1,0,0|0,0,2]=4 1057 B7R1.3 O=C1CCCNC1 HR116769 [0,1,0,1,0,0|0,0,2]=4 1058 B7R1.3 O=C1CCCOC1 HR104744 [0,1,0,1,0,0|0,0,2]=4 1059 B7R1.3 O=C1CCNCC1 CESA03001 [0,1,0,1,0,0|0,0,2]=4 1060 B7R1.3 O=C1CCNCC1 HR105315 [0,1,0,1,0,0|0,0,2]=4 1061 B7R1.3 O=C1CCNCC1 HR7756 [0,1,0,1,0,0|0,0,2]=4 1062 B7R1.3 O=C1CCOCC1 HR9557 [0,1,0,1,0,0|0,0,2]=4 1063 B7R1.3 O=C1CCSCC1 HR123861 [0,1,0,1,0,0|0,0,2]=4 1064 B7R1.3 O=C1CC[NH2+]CC1 HR127185 [0,1,0,1,0,0|0,0,2]=4 1065 B7R1.3 O=C1CNCCN1 HR132423 [0,1,0,1,0,0|1,0,1]=4 1066 B7R1.3 O=C1CNCCO1 HR30209 [0,1,0,1,0,0|1,0,1]=4 1067 B7R1.3 O=C1COCCN1 HR115059 [0,1,0,1,0,0|1,0,1]=4 1068 B7R1.3 O=C1COCCO1 HR127683 [0,1,0,1,0,0|1,0,1]=4 1069 B7R1.3 O=C1CSCCN1 HR147732 [0,1,0,1,0,0|1,0,1]=4 1070 B7R1.3 O=C1NCCCN1 HR123216 [0,1,0,1,0,0|1,0,1]=4 1071 B7R1.3 OC1C=CCCC1 HR108292 [0,1,0,1,0,0|0,0,2]=4 1072 B7R1.4 BrC1=C(Br)CCC1 HR137703 [0,1,0,1,0,0|1,0,1]=4 1073 B7R1.4 C=C1CCOC1=O HR130328 [0,1,0,1,0,0|1,0,1]=4 1074 B7R1.4 CC1=C(Br)C=CS1 HR128369 [0,1,0,1,0,0|0,1,1]=4 1075 B7R1.4 CC1=C(Br)C=NO1 HR120798 [0,1,0,1,0,0|1,0,1]=4 1076 B7R1.4 CC1=C(Br)SC=C1 HR5191 [0,1,0,1,0,0|2,0,0]=4 1077 B7R1.4 CC1=C(C)ON=C1 HR105616 [0,1,0,1,0,0|1,0,1]=4 1078 B7R1.4 CC1=C(Cl)SC=C1 HR130722 [0,1,0,1,0,0|2,0,0]=4 1079 B7R1.4 CC1=C(I)C=NO1 HR103358 [0,1,0,1,0,0|1,0,1]=4 1080 B7R1.4 CC1=C(N)C=NO1 HR112122 [0,1,0,1,0,0|1,0,1]=4 1081 B7R1.4 CC1=C(S)C=CO1 HR127105 [0,1,0,1,0,0|0,0,2]=4 1082 B7R1.4 CC1=C(S)C=CO1 HR138863 [0,1,0,1,0,0|0,0,2]=4 1083 B7R1.4 CC1=C(S)C=CS1 HR109926 [0,1,0,1,0,0|0,1,1]=4 1084 B7R1.4 CC1=C(S)CCO1 HR124755 [0,1,0,1,0,0|0,0,2]=4 1085 B7R1.4 CC1=CC=NN1C HR125646 [0,1,0,1,0,0|2,0,0]=4 1086 B7R1.4 CC1=CCCC1=O HR114448 [0,1,0,1,0,0|0,0,0]=2 1087 B7R1.4 CC1=CNN=C1C HR107041 [0,1,0,1,0,0|2,0,0]=4 1088 B7R1.4 CC1=CSC=C1Br HR30444 [0,1,0,1,0,0|2,0,0]=4 1089 B7R1.4 CC1=CSC=C1C HR112647 [0,1,0,1,0,0|2,0,0]=4 1090 B7R1.4 CC1=CSC=C1N HR106606 [0,1,0,1,0,0|2,0,0]=4 1091 B7R1.4 CC1=NNC=C1Br HR131439 [0,1,0,1,0,0|2,0,0]=4 1092 B7R1.4 CC1=NNC=C1I HR131707 [0,1,0,1,0,0|2,0,0]=4 1093 B7R1.4 CC1CCCC1=O HR112329 [0,1,0,1,0,0|0,0,2]=4 1094 B7R1.4 CC1CCNC1=O HR103871 [0,1,0,1,0,0|1,0,1]=4 1095 B7R1.4 CC1OCCC1=O HR131028 [0,1,0,1,0,0|1,0,1]=4 1096 B7R1.4 CC1SCCC1=O HR124610 [0,1,0,1,0,0|1,0,1]=4 1097 B7R1.4 CN1CCCC1=O HR130754 [0,1,0,1,0,0|0,0,2]=4 1098 B7R1.4 CN1CCOC1=O HR132150 [0,1,0,1,0,0|1,0,1]=4 1099 B7R1.4 CN1N=CC=C1Br HR103779 [0,1,0,1,0,0|2,0,0]=4 1100 B7R1.4 CN1N=CC=C1I HR109583 [0,1,0,1,0,0|2,0,0]=4 1101 B7R1.4 CN1N=CC=C1N HR120280 [0,1,0,1,0,0|2,0,0]=4 1102 B7R1.4 CN1N=CC=C1O HR119356 [0,1,0,1,0,0|1,0,1]=4 1103 B7R1.4 CN1SC=CC1=O HR137410 [0,1,0,1,0,0|1,0,0]=3 1104 B7R1.4 NC1CCNC1=O HR148583 [0,1,0,1,0,0|1,0,1]=4 1105 B7R1.4 NC1CCOC1=O HR103069 [0,1,0,1,0,0|1,0,1]=4 1106 B7R1.4 NC1CCOC1=O HR134625 [0,1,0,1,0,0|1,0,1]=4 1107 B7R1.4 NC1CCOC1=O HR137954 [0,1,0,1,0,0|1,0,1]=4 1108 B7R1.4 NC1CCOC1=O HR146738 [0,1,0,1,0,0|1,0,1]=4 1109 B7R1.4 NC1CCSC1=O HR137672 [0,1,0,1,0,0|1,0,1]=4 1110 B7R1.4 NC1CONC1=O HR101265 [0,1,0,1,0,0|2,0,0]=4 1111 B7R1.4 NC1CONC1=O HR127398 [0,1,0,1,0,0|2,0,0]=4 1112 B7R1.4 NC1CONC1=O HR136196 [0,1,0,1,0,0|2,0,0]=4 1113 B7R1.4 NN1CCCC1=O GASA04306 [0,1,0,1,0,0|1,0,1]=4 1114 B7R1.4 O=C1CCC=C1O HR148600 [0,1,0,1,0,0|0,0,0]=2 1115 B7R1.4 O=C1CCCC1Br HR121144 [0,1,0,1,0,0|0,0,2]=4 1116 B7R1.4 O=C1CCCC1Cl HR112783 [0,1,0,1,0,0|0,0,2]=4 1117 B7R1.4 O=C1NCCC1O HR102172 [0,1,0,1,0,0|1,0,1]=4 1118 B7R1.4 O=C1NCCC1O HR113273 [0,1,0,1,0,0|1,0,1]=4 1119 B7R1.4 O=C1NCCC1O HR113406 [0,1,0,1,0,0|1,0,1]=4 1120 B7R1.4 O=C1NCCC1O HR147016 [0,1,0,1,0,0|1,0,1]=4 1121 B7R1.4 O=C1OCC=C1Br HR102966 [0,1,0,1,0,0|1,0,0]=3 1122 B7R1.4 O=C1OCCC1Br HR10714 [0,1,0,1,0,0|1,0,1]=4 1123 B7R1.10 COC1CC(=O)C1 HR114228 [0,1,0,1,0,0|0,0,2]=4 1124 B7R1.10 O=C1CC(CBr)C1 HR119561 [0,1,0,1,0,0|0,0,2]=4 1125 B7R1.10 O=C1CC(CCl)C1 HR119882 [0,1,0,1,0,0|0,0,2]=4 1126 B7R1.10 O=C1CC(CO)C1 HR103458 [0,1,0,1,0,0|0,0,2]=4 1127 B7R1.22 CCC(=O)C1CC1 HR104134 [0,1,0,1,0,0|0,0,2]=4 1128 B7R1.22 COC(=O)C1CC1 HR128125 [0,1,0,1,0,0|0,0,2]=4 1129 B7R1.22 COC(=O)C1CN1 HR112447 [0,1,0,1,0,0|1,0,1]=4 1130 B7R1.22 COC(=O)C1CO1 HR129937 [0,1,0,1,0,0|1,0,1]=4 1131 B7R1.22 O=C(CBr)C1CC1 HR125713 [0,1,0,1,0,0|0,0,2]=4 1132 B7R1.18 CC(=O)C1CCC1 HR143826 [0,1,0,1,0,0|0,0,2]=4 1133 B7R1.14 O=S1(=O)C=CCO1 HR119783 [0,1,0,1,0,0|2,0,0]=4