0 B6R0.2 CC(=O)CC(=O)[O-] HR126081 [0,0,0,0,0,0|2,0,1]=3 1 B6R0.2 CC(=O)CC(C)=O AVJB01201 [0,0,0,0,0,0|1,0,1]=2 2 B6R0.2 CC(=O)CC(C)=O CUSA07105 [0,0,0,0,0,0|1,0,1]=2 3 B6R0.2 CC(=O)CC(C)=O HR108604 [0,0,0,0,0,0|1,0,1]=2 4 B6R0.2 CC(=O)CC(N)=O HR125580 [0,0,0,0,0,0|2,0,1]=3 5 B6R0.2 CC(=O)NC(=N)N HR3986 [0,0,0,0,0,0|3,0,1]=4 6 B6R0.2 CC(=O)NC(C)C ABSA04901 [0,0,0,0,0,0|1,0,0]=1 7 B6R0.2 CC(=O)OC(C)=O NASA01407 [0,0,0,0,0,0|2,0,1]=3 8 B6R0.2 CC(=O)OC(C)Br HR115050 [0,0,0,0,0,0|2,0,0]=2 9 B6R0.2 CC(=O)\C=C(/C)N HR105871 [0,0,0,0,0,0|1,0,2]=3 10 B6R0.2 CC(=O)\C=C(\C)[O-] HR100501 [0,0,0,0,0,0|1,0,2]=3 11 B6R0.2 CC(=O)\C=C(\C)[O-] HR107173 [0,0,0,0,0,0|1,0,2]=3 12 B6R0.2 CC(=O)\C=C(\C)[O-] HR113781 [0,0,0,0,0,0|1,0,2]=3 13 B6R0.2 CC(=O)\C=C(\C)[O-] HR117143 [0,0,0,0,0,0|1,0,2]=3 14 B6R0.2 CC(C)=CC(=O)Cl HR129281 [0,0,0,0,0,0|1,0,2]=3 15 B6R0.2 CC(C)=CC(=O)O HR21295 [0,0,0,0,0,0|1,0,2]=3 16 B6R0.2 CC(C)CB(O)O HR137992 [0,0,0,0,0,0|2,0,1]=3 17 B6R0.2 CC(C)CC(=O)O HR123359 [0,0,0,0,0,0|1,0,0]=1 18 B6R0.2 CC(C)CC(C)N HR121969 [0,0,0,0,0,0|1,0,1]=2 19 B6R0.2 CC(C)CC(N)=O HR109732 [0,0,0,0,0,0|1,0,0]=1 20 B6R0.2 CC(C)NC(C)C HR112890 [0,0,0,0,0,0|2,0,1]=3 21 B6R0.2 CC(C)NC(C)C HR124493 [0,0,0,0,0,0|2,0,1]=3 22 B6R0.2 CC(C)OC(=S)[S-] HR128420 [0,0,0,0,0,0|2,1,0]=3 23 B6R0.2 CC(C)PC(C)C HR107656 [0,0,0,0,0,0|2,0,1]=3 24 B6R0.2 CC(C)SC(C)C HR122292 [0,0,0,0,0,0|2,0,1]=3 25 B6R0.2 CC(Cl)CN(C)C HR127922 [0,0,0,0,0,0|2,0,1]=3 26 B6R0.2 CC(N)CC(=O)O HR103780 [0,0,0,0,0,0|2,0,0]=2 27 B6R0.2 CC(N)CC(=O)O HR116211 [0,0,0,0,0,0|2,0,0]=2 28 B6R0.2 CC(N)CC(=O)O HR120488 [0,0,0,0,0,0|2,0,0]=2 29 B6R0.2 CC(N)CC(=O)O HR124863 [0,0,0,0,0,0|2,0,0]=2 30 B6R0.2 CC(O)CC(=O)[O-] HR147106 [0,0,0,0,0,0|2,0,0]=2 31 B6R0.2 CN(C)CC(=O)O HR127289 [0,0,0,0,0,0|2,0,0]=2 32 B6R0.2 CN(C)CC(=O)[O-] HR134057 [0,0,0,0,0,0|2,0,0]=2 33 B6R0.2 CN(C)CC(N)=S HR134511 [0,0,0,0,0,0|2,1,0]=3 34 B6R0.2 CN(C)CN(C)C HR129350 [0,0,0,0,0,0|3,0,0]=3 35 B6R0.2 C[S+](C)CC(=O)[O-] HR107996 [0,0,0,0,0,0|2,0,0]=2 36 B6R0.2 C[SiH](C)O[SiH](C)C HR136692 [0,0,0,0,0,0|2,2,0]=4 37 B6R0.2 N=C(N)CC(N)=O HR137702 [0,0,0,0,0,0|3,0,1]=4 38 B6R0.2 NC(=O)CC(N)=O HR138203 [0,0,0,0,0,0|3,0,1]=4 39 B6R0.2 NC(=O)C[N+](=O)[O-] HR32032 [0,0,0,0,0,0|4,0,0]=4 40 B6R0.2 O=C(O)CC(=O)O DACQ01002 [0,0,0,0,0,0|3,0,1]=4 41 B6R0.2 O=C(O)CC(=O)O HR144418 [0,0,0,0,0,0|3,0,1]=4 42 B6R0.2 O=C([O-])CC(=O)[O-] HR125830 [0,0,0,0,0,0|3,0,1]=4 43 B6R0.2 O=C([O-])CC(=O)[O-] HR131351 [0,0,0,0,0,0|3,0,1]=4 44 B6R0.2 OC(=S)CC(F)F HR125326 [0,0,0,0,0,0|3,0,1]=4 45 B5R0.1 C#CCC(=O)O HR107056 [1,0,0,0,0,0|1,0,2]=4 46 B5R0.1 C=C(C)CCO HR139358 [1,0,0,0,0,0|2,0,0]=3 47 B5R0.1 C=C(C)C[Mg]Cl HR118348 [1,0,0,0,0,0|3,0,0]=4 48 B5R0.1 C=C(C)OCC HR135003 [1,0,0,0,0,0|2,0,0]=3 49 B5R0.1 C=CCC(=O)O HR124911 [1,0,0,0,0,0|1,0,2]=4 50 B5R0.1 C=CCC(C)O HR101482 [1,0,0,0,0,0|1,0,1]=3 51 B5R0.1 C=CCC(C)O HR144395 [1,0,0,0,0,0|1,0,1]=3 52 B5R0.1 C=CCN(C)C HR103500 [1,0,0,0,0,0|1,0,1]=3 53 B5R0.1 C=CC[SiH](C)C HR121456 [1,0,0,0,0,0|0,1,1]=3 54 B5R0.1 C=CNC(C)=O HR112565 [1,0,0,0,0,0|1,0,2]=4 55 B5R0.1 C=COC(C)C HR122658 [1,0,0,0,0,0|1,0,1]=3 56 B5R0.1 CC#CC(=O)O HR16226 [1,0,0,0,0,0|1,0,2]=4 57 B5R0.1 CC(=O)CCCl HR106274 [1,0,0,0,0,0|1,0,0]=2 58 B5R0.1 CC(=O)CCO HR131203 [1,0,0,0,0,0|1,0,0]=2 59 B5R0.1 CC(=O)NCO HR105862 [1,0,0,0,0,0|2,0,0]=3 60 B5R0.1 CC(=O)OC=O HR100841 [1,0,0,0,0,0|2,0,1]=4 61 B5R0.1 CC(=O)OCBr HR127457 [1,0,0,0,0,0|2,0,0]=3 62 B5R0.1 CC(=O)OCCl HR101207 [1,0,0,0,0,0|2,0,0]=3 63 B5R0.1 CC(=O)\C=N\O HR126710 [1,0,0,0,0,0|2,0,1]=4 64 B5R0.1 CC(Br)CCBr HR133153 [1,0,0,0,0,0|2,0,1]=4 65 B5R0.1 CC(C)=CC=O HR138342 [1,0,0,0,0,0|0,0,2]=3 66 B5R0.1 CC(C)=CCBr HR133883 [1,0,0,0,0,0|2,0,1]=4 67 B5R0.1 CC(C)=CCCl HR127820 [1,0,0,0,0,0|2,0,1]=4 68 B5R0.1 CC(C)=CCN HR114772 [1,0,0,0,0,0|2,0,1]=4 69 B5R0.1 CC(C)=CCO HR138609 [1,0,0,0,0,0|2,0,1]=4 70 B5R0.1 CC(C)=CCS HR143870 [1,0,0,0,0,0|2,0,1]=4 71 B5R0.1 CC(C)CCI HR3950 [1,0,0,0,0,0|1,0,1]=3 72 B5R0.1 CC(C)C[Mg]Br HR119050 [1,0,0,0,0,0|2,0,0]=3 73 B5R0.1 CC(C)N=C=S HR132780 [1,0,0,0,0,0|1,1,1]=4 74 B5R0.1 CC(C)O[AlH3]=O HR145538 [1,0,0,0,0,0|2,0,0]=3 75 B5R0.1 CC(N)CCO HR115385 [1,0,0,0,0,0|1,0,2]=4 76 B5R0.1 CC(N)CCO HR116440 [1,0,0,0,0,0|1,0,2]=4 77 B5R0.1 CC(N)CCO HR148505 [1,0,0,0,0,0|1,0,2]=4 78 B5R0.1 CC(O)CCO HR109448 [1,0,0,0,0,0|1,0,2]=4 79 B5R0.1 CC(O)CCO HR135973 [1,0,0,0,0,0|1,0,2]=4 80 B5R0.1 CCCB(O)O HR138252 [1,0,0,0,0,0|2,0,1]=4 81 B5R0.1 CCCC(=N)N HR126811 [1,0,0,0,0,0|2,0,0]=3 82 B5R0.1 CCCC(=O)Cl HR147587 [1,0,0,0,0,0|1,0,0]=2 83 B5R0.1 CCCC(=O)[O-] HR129884 [1,0,0,0,0,0|1,0,0]=2 84 B5R0.1 CCCC(=O)[O-] HR137474 [1,0,0,0,0,0|1,0,0]=2 85 B5R0.1 CCCC(C)Cl HR139357 [1,0,0,0,0,0|1,0,1]=3 86 B5R0.1 CCCC(C)N HR107397 [1,0,0,0,0,0|1,0,1]=3 87 B5R0.1 CCCC(C)O HR136841 [1,0,0,0,0,0|0,0,2]=3 88 B5R0.1 CCCC(C)O HR137349 [1,0,0,0,0,0|0,0,2]=3 89 B5R0.1 CCCC(C)S HR128554 [1,0,0,0,0,0|0,1,1]=3 90 B5R0.1 CCCC(N)=O HR137715 [1,0,0,0,0,0|1,0,0]=2 91 B5R0.1 CCNC(C)=O HR100775 [1,0,0,0,0,0|1,0,0]=2 92 B5R0.1 CCNC(N)=O HR126748 [1,0,0,0,0,0|2,0,0]=3 93 B5R0.1 CCNC(N)=[NH2+] HR145586 [1,0,0,0,0,0|3,0,0]=4 94 B5R0.1 CCOC(=N)N HR110036 [1,0,0,0,0,0|3,0,0]=4 95 B5R0.1 CCOC(=O)Cl IVSA07702 [1,0,0,0,0,0|2,0,0]=3 96 B5R0.1 CCOC(=S)[S-] HR127593 [1,0,0,0,0,0|2,1,0]=4 97 B5R0.1 CCOC(C)=N HR126641 [1,0,0,0,0,0|2,0,0]=3 98 B5R0.1 CCOC(N)=O HR123919 [1,0,0,0,0,0|2,0,0]=3 99 B5R0.1 CCSC(C)=O HR138399 [1,0,0,0,0,0|1,0,0]=2 100 B5R0.1 CCSC(C)=S HR129552 [1,0,0,0,0,0|1,1,0]=3 101 B5R0.1 CN(C)CCBr HR119410 [1,0,0,0,0,0|2,0,1]=4 102 B5R0.1 CN(C)CCCl HR136060 [1,0,0,0,0,0|2,0,1]=4 103 B5R0.1 CN(C)CCCl HR146713 [1,0,0,0,0,0|2,0,1]=4 104 B5R0.1 CN(C)CCN HR136677 [1,0,0,0,0,0|2,0,1]=4 105 B5R0.1 CN(C)CCO HR147675 [1,0,0,0,0,0|1,0,2]=4 106 B5R0.1 CN(C)CCS HR128457 [1,0,0,0,0,0|1,1,1]=4 107 B5R0.1 CN(C)CCS HR129079 [1,0,0,0,0,0|1,1,1]=4 108 B5R0.1 CNCC(=O)O HR132326 [1,0,0,0,0,0|2,0,0]=3 109 B5R0.1 CNCC(=O)[O-] HR133335 [1,0,0,0,0,0|2,0,0]=3 110 B5R0.1 COCC(=N)N HR105552 [1,0,0,0,0,0|3,0,0]=4 111 B5R0.1 COCC(=O)Cl HR138385 [1,0,0,0,0,0|2,0,0]=3 112 B5R0.1 COCC(=O)O HR137614 [1,0,0,0,0,0|2,0,0]=3 113 B5R0.1 COCC(C)=O HR124731 [1,0,0,0,0,0|1,0,0]=2 114 B5R0.1 COCC(C)N HR140312 [1,0,0,0,0,0|2,0,0]=3 115 B5R0.1 COCC(C)O HR106636 [1,0,0,0,0,0|2,0,0]=3 116 B5R0.1 COCC(C)O HR128113 [1,0,0,0,0,0|2,0,0]=3 117 B5R0.1 COCC(C)O HR1904 [1,0,0,0,0,0|2,0,0]=3 118 B5R0.1 CSCC(C)=O HR104929 [1,0,0,0,0,0|1,0,0]=2 119 B5R0.1 CSCC(N)=O HR105921 [1,0,0,0,0,0|2,0,0]=3 120 B5R0.1 C[AlH3](C)C[Ti]Cl HR142919 [1,0,0,0,0,0|3,0,0]=4 121 B5R0.1 C\C=C\C(=O)Cl HR100850 [1,0,0,0,0,0|1,0,2]=4 122 B5R0.1 C\C=C\C(=O)Cl HR133043 [1,0,0,0,0,0|1,0,2]=4 123 B5R0.1 N#CCC(=O)O HR146964 [1,0,0,0,0,0|2,0,1]=4 124 B5R0.1 N#CCC(N)=O HR124127 [1,0,0,0,0,0|2,0,1]=4 125 B5R0.1 NC(=O)CCO HR101159 [1,0,0,0,0,0|2,0,0]=3 126 B5R0.1 NC(=O)NCO HR121643 [1,0,0,0,0,0|3,0,0]=4 127 B5R0.1 NCCC(=O)O HR120135 [1,0,0,0,0,0|2,0,0]=3 128 B5R0.1 NCCC(=O)O HR136538 [1,0,0,0,0,0|2,0,0]=3 129 B5R0.1 NCCC(N)=O HR123050 [1,0,0,0,0,0|2,0,0]=3 130 B5R0.1 NOCC(=O)O HR107090 [1,0,0,0,0,0|3,0,0]=4 131 B5R0.1 O=C(Cl)CCBr HR132550 [1,0,0,0,0,0|2,0,0]=3 132 B5R0.1 O=C(Cl)CCCl HR125686 [1,0,0,0,0,0|2,0,0]=3 133 B5R0.1 O=C(O)CCBr HR146768 [1,0,0,0,0,0|2,0,0]=3 134 B5R0.1 O=C(O)CCI HR118002 [1,0,0,0,0,0|2,0,0]=3 135 B5R0.1 O=C(O)CCO HR12598 [1,0,0,0,0,0|2,0,0]=3 136 B5R0.1 O=C(O)CCS BACQ02107 [1,0,0,0,0,0|2,0,0]=3 137 B5R0.1 O=[N+]([O-])CCO HR122802 [1,0,0,0,0,0|3,0,0]=4 138 B7R0.2 C=CC(=O)NC(C)C HR138308 [0,1,0,0,0,0|1,0,1]=3 139 B7R0.2 CC(=O)NC(=O)CN HR100710 [0,1,0,0,0,0|2,0,1]=4 140 B7R0.2 CC(=O)OC(Br)CBr HR133286 [0,1,0,0,0,0|2,0,0]=3 141 B7R0.2 CC(=O)OC(Cl)CCl HR133017 [0,1,0,0,0,0|2,0,0]=3 142 B7R0.2 CC(=O)\C=C(\C)O[Ir] HR109248 [0,1,0,0,0,0|1,0,2]=4 143 B7R0.2 CC(=O)\C=C(\C)O[Rh] HR123460 [0,1,0,0,0,0|1,0,2]=4 144 B7R0.2 CC(=O)\C=C(\C)O[Rh] HR126751 [0,1,0,0,0,0|1,0,2]=4 145 B7R0.2 CC(C)CC(N)CO HR123929 [0,1,0,0,0,0|1,0,1]=3 146 B7R0.2 CC(C)CC(N)CO HR30172 [0,1,0,0,0,0|1,0,1]=3 147 B7R0.2 CC(C)NC(=O)CBr HR117083 [0,1,0,0,0,0|1,0,0]=2 148 B7R0.2 CC(C)OC(=O)CN HR105079 [0,1,0,0,0,0|1,0,0]=2 149 B7R0.2 CC(C)OC(=O)CN HR117760 [0,1,0,0,0,0|1,0,0]=2 150 B7R0.2 CC(C)OC(=O)CO HR105901 [0,1,0,0,0,0|1,0,0]=2 151 B7R0.2 CC(C)OC(=S)S[Na] HR128151 [0,1,0,0,0,0|2,1,0]=4 152 B7R0.2 CC(CCl)CN(C)C HR118838 [0,1,0,0,0,0|2,0,0]=3 153 B7R0.2 CC(CCl)CN(C)C HR145450 [0,1,0,0,0,0|2,0,0]=3 154 B7R0.2 CCC(=O)CC(C)=O HR133940 [0,1,0,0,0,0|1,0,1]=3 155 B7R0.2 CCC(C)CC(=O)O HR11273 [0,1,0,0,0,0|1,0,0]=2 156 B7R0.2 CCC(C)CC(=O)O HR135865 [0,1,0,0,0,0|1,0,0]=2 157 B7R0.2 CCC(C)CC(C)N HR121358 [0,1,0,0,0,0|1,0,1]=3 158 B7R0.2 CCC(C)CC(C)N HR123488 [0,1,0,0,0,0|1,0,1]=3 159 B7R0.2 CCC(C)NC(N)=O HR114250 [0,1,0,0,0,0|2,0,0]=3 160 B7R0.2 CCC(C)OC(=O)[O-] HR144165 [0,1,0,0,0,0|2,0,0]=3 161 B7R0.2 CCC(N)CC(=O)O HR114631 [0,1,0,0,0,0|2,0,0]=3 162 B7R0.2 CCC(N)CC(=O)O HR143295 [0,1,0,0,0,0|2,0,0]=3 163 B7R0.2 CCC(N)CC(=O)O HR147022 [0,1,0,0,0,0|2,0,0]=3 164 B7R0.2 CN(C)CC(O)CO HR136676 [0,1,0,0,0,0|1,0,2]=4 165 B7R0.2 CN(C)CC(O)CO HR145868 [0,1,0,0,0,0|1,0,2]=4 166 B7R0.2 CNC(=O)CC(C)=O HR100837 [0,1,0,0,0,0|1,0,1]=3 167 B7R0.2 COC(=O)C=C(C)C HR125078 [0,1,0,0,0,0|0,0,2]=3 168 B7R0.2 COC(=O)CC(C)=O TECQ03701 [0,1,0,0,0,0|1,0,1]=3 169 B7R0.2 COC(=O)CC(C)N HR119861 [0,1,0,0,0,0|1,0,0]=2 170 B7R0.2 COC(=O)CC(C)N HR143484 [0,1,0,0,0,0|1,0,0]=2 171 B7R0.2 COC(=O)CC(C)O HR138815 [0,1,0,0,0,0|1,0,0]=2 172 B7R0.2 COC(=O)CC(N)=O HR118636 [0,1,0,0,0,0|2,0,1]=4 173 B7R0.2 COC(=O)\C=C(/C)N HR138334 [0,1,0,0,0,0|1,0,2]=4 174 B7R0.2 CSC(=O)CC(C)C HR122226 [0,1,0,0,0,0|0,0,0]=1 175 B7R0.2 C\C(CC(C)C)=N/O HR128219 [0,1,0,0,0,0|0,0,1]=2 176 B7R0.2 NCC(O)CC(=O)O HR137304 [0,1,0,0,0,0|2,0,0]=3 177 B7R0.2 NCC(O)CC(=O)[O-] HR128768 [0,1,0,0,0,0|2,0,0]=3 178 B7R0.9 C=C(C)CC(C)(C)C HR113816 [0,1,0,0,0,0|1,0,0]=2 179 B7R0.9 C=C(C)CC(C)(C)C HR145423 [0,1,0,0,0,0|1,0,0]=2 180 B7R0.9 C=C(C)C[Si](C)(C)C HR112830 [0,1,0,0,0,0|1,1,0]=3 181 B7R0.9 CC(=O)CC(C)(C)S HR124484 [0,1,0,0,0,0|0,0,0]=1 182 B7R0.9 CC(=O)CC(F)(F)F HR109282 [0,1,0,0,0,0|2,0,0]=3 183 B7R0.9 CC(=O)N[Si](C)(C)C HR144225 [0,1,0,0,0,0|1,1,0]=3 184 B7R0.9 CC(=O)OC(C)(C)C HR147076 [0,1,0,0,0,0|1,0,0]=2 185 B7R0.9 CC(=O)O[Si](C)(C)C HR141690 [0,1,0,0,0,0|1,1,0]=3 186 B7R0.9 CC(C)(C)CC(=O)Cl HR124713 [0,1,0,0,0,0|1,0,0]=2 187 B7R0.9 CC(C)(C)CC(=O)O HR132975 [0,1,0,0,0,0|1,0,0]=2 188 B7R0.9 CC(C)(C)NC(N)=O HR126222 [0,1,0,0,0,0|2,0,0]=3 189 B7R0.9 CC(C)(C)OC(N)=O HR122401 [0,1,0,0,0,0|2,0,0]=3 190 B7R0.9 CC(C)(N)CC(=O)O HR107222 [0,1,0,0,0,0|1,0,0]=2 191 B7R0.9 CC(C)(N)CC(=O)O HR148652 [0,1,0,0,0,0|1,0,0]=2 192 B7R0.9 CC(C)(O)CC(=O)O HR136960 [0,1,0,0,0,0|1,0,0]=2 193 B7R0.9 CC(C)(O)CC(=O)[O-] HR140891 [0,1,0,0,0,0|1,0,0]=2 194 B7R0.9 CC(C)CS(=O)(=O)Cl HR120454 [0,1,0,0,0,0|2,0,0]=3 195 B7R0.9 CC(C)C[Si](C)(Cl)Cl HR111813 [0,1,0,0,0,0|1,1,0]=3 196 B7R0.9 CC(C)C[Si](Cl)(Cl)Cl HR112224 [0,1,0,0,0,0|2,1,0]=4 197 B7R0.9 CC(C)NC(C)(C)C HR141308 [0,1,0,0,0,0|2,0,1]=4 198 B7R0.9 CC(C)OC(C)(C)C HR118483 [0,1,0,0,0,0|2,0,1]=4 199 B7R0.9 CC(O)CC(C)(C)O HR128211 [0,1,0,0,0,0|0,0,2]=3 200 B7R0.9 CC(O)C[N+](C)(C)C HR145590 [0,1,0,0,0,0|1,0,2]=4 201 B7R0.9 C[N+](C)(C)CC(=O)O HR130542 [0,1,0,0,0,0|2,0,0]=3 202 B7R0.9 C[N+](C)(C)CC(=O)[O-] HR130963 [0,1,0,0,0,0|2,0,0]=3 203 B7R0.9 C[Si](C)(C)CC(=O)O HR108462 [0,1,0,0,0,0|1,1,0]=3 204 B7R0.9 O=C(O)CC(F)(F)F HR137531 [0,1,0,0,0,0|3,0,0]=4 205 B7R0.16 C=C(C)C(=O)N(C)C HR143638 [0,1,0,0,0,0|2,0,1]=4 206 B7R0.16 CC(=O)C(=O)C(C)C HR141113 [0,1,0,0,0,0|0,0,1]=2 207 B7R0.16 CC(=O)C(C)C(C)=O HR142176 [0,1,0,0,0,0|1,0,1]=3 208 B7R0.16 CC(=O)C(Cl)C(C)=O HR147348 [0,1,0,0,0,0|1,0,1]=3 209 B7R0.16 CC(Br)C(Br)C(=O)O HR127665 [0,1,0,0,0,0|2,0,0]=3 210 B7R0.16 CC(C)=C(Cl)N(C)C HR104790 [0,1,0,0,0,0|2,0,1]=4 211 B7R0.16 CC(C)C(=O)C(=O)O HR136485 [0,1,0,0,0,0|1,0,1]=3 212 B7R0.16 CC(C)C(=O)C(=O)[O-] HR127707 [0,1,0,0,0,0|1,0,1]=3 213 B7R0.16 CC(C)C(=O)C(=O)[O-] HR137721 [0,1,0,0,0,0|1,0,1]=3 214 B7R0.16 CC(C)C(Br)C(=O)Br HR136438 [0,1,0,0,0,0|1,0,0]=2 215 B7R0.16 CC(C)C(Br)C(=O)O HR115414 [0,1,0,0,0,0|1,0,0]=2 216 B7R0.16 CC(C)C(Br)C(=O)O HR124122 [0,1,0,0,0,0|1,0,0]=2 217 B7R0.16 CC(C)C(Br)C(=O)O HR137032 [0,1,0,0,0,0|1,0,0]=2 218 B7R0.16 CC(C)C(Cl)C(=O)O HR103881 [0,1,0,0,0,0|1,0,0]=2 219 B7R0.16 CC(C)C(F)C(=O)O HR116661 [0,1,0,0,0,0|1,0,0]=2 220 B7R0.16 CC(C)C(N)B(O)O HR32489 [0,1,0,0,0,0|2,0,1]=4 221 B7R0.16 CC(C)C(N)C(=O)O HR126445 [0,1,0,0,0,0|1,0,0]=2 222 B7R0.16 CC(C)C(N)C(=O)O HR130729 [0,1,0,0,0,0|1,0,0]=2 223 B7R0.16 CC(C)C(N)C(=O)O HR134362 [0,1,0,0,0,0|1,0,0]=2 224 B7R0.16 CC(C)C(N)C(=O)O HR141699 [0,1,0,0,0,0|1,0,0]=2 225 B7R0.16 CC(C)C(N)C(N)=O HR112915 [0,1,0,0,0,0|1,0,0]=2 226 B7R0.16 CC(C)C(N)C(N)=O HR122778 [0,1,0,0,0,0|1,0,0]=2 227 B7R0.16 CC(C)C(O)C(=O)O HR124143 [0,1,0,0,0,0|1,0,0]=2 228 B7R0.16 CC(C)C(O)C(C)C HR135657 [0,1,0,0,0,0|1,0,1]=3 229 B7R0.16 CC(C)N(C)C(C)C HR143569 [0,1,0,0,0,0|2,0,1]=4 230 B7R0.16 CC(C)P(Cl)C(C)C HR109669 [0,1,0,0,0,0|2,0,1]=4 231 B7R0.16 CC(C)[Si](Cl)C(C)C HR141834 [0,1,0,0,0,0|1,1,1]=4 232 B7R0.16 CC(O)C(N)C(=O)O HR126335 [0,1,0,0,0,0|2,0,0]=3 233 B7R0.16 CC(O)C(N)C(=O)O HR128851 [0,1,0,0,0,0|2,0,0]=3 234 B7R0.16 CC(O)C(N)C(=O)O HR129391 [0,1,0,0,0,0|2,0,0]=3 235 B7R0.16 CC(O)C(N)C(=O)O HR129491 [0,1,0,0,0,0|2,0,0]=3 236 B7R0.16 CC(O)C(N)C(=O)O HR135216 [0,1,0,0,0,0|2,0,0]=3 237 B7R0.16 CC(O)C(N)C(=O)O HR138779 [0,1,0,0,0,0|2,0,0]=3 238 B7R0.16 CC(O)C(N)C(N)=O RASA04107 [0,1,0,0,0,0|2,0,0]=3 239 B7R0.16 CN(C)C(=O)C(=O)O HR118982 [0,1,0,0,0,0|2,0,1]=4 240 B7R0.16 CN(C)C(=O)C(N)=O HR128536 [0,1,0,0,0,0|2,0,1]=4 241 B7R0.16 CN(C)C([SiH3])N(C)C HR115775 [0,1,0,0,0,0|3,0,0]=4 242 B7R0.16 [Li]N(C(C)C)C(C)C HR133765 [0,1,0,0,0,0|2,0,1]=4 243 B7R1.2 CC1=CC(=O)CC1 HR137516 [0,0,0,1,0,0|0,0,2]=3 244 B7R1.2 CC1=CC(=O)CO1 HR119186 [0,0,0,1,0,0|1,0,2]=4 245 B7R1.2 CC1=CC(=O)OC1 HR118210 [0,0,0,1,0,0|1,0,2]=4 246 B7R1.2 CC1=CCC(=O)O1 HR136942 [0,0,0,1,0,0|1,0,2]=4 247 B7R1.2 CC1=NNC(=O)C1 HR133577 [0,0,0,1,0,0|2,0,1]=4 248 B7R1.2 CC1CCC(=O)O1 HR126256 [0,0,0,1,0,0|1,0,0]=2 249 B7R1.2 CC1CCC(N)C1 HR109161 [0,0,0,1,0,0|1,0,1]=3 250 B7R1.2 CC1CNC(=O)C1 HR146359 [0,0,0,1,0,0|1,0,0]=2 251 B7R1.2 CC1CNC(=O)C1 HR146360 [0,0,0,1,0,0|1,0,0]=2 252 B7R1.2 CC1CNC(=O)C1 HR146369 [0,0,0,1,0,0|1,0,0]=2 253 B7R1.2 CC1COC(=O)O1 HR125363 [0,0,0,1,0,0|2,0,0]=3 254 B7R1.2 CC1COC(=O)O1 HR128407 [0,0,0,1,0,0|2,0,0]=3 255 B7R1.2 CC1COC(=O)O1 HR129273 [0,0,0,1,0,0|2,0,0]=3 256 B7R1.2 CC1COC(C)O1 HR111400 [0,0,0,1,0,0|1,0,2]=4 257 B7R1.2 CN1CCC(=O)C1 HR102484 [0,0,0,1,0,0|1,0,0]=2 258 B7R1.2 CN1CCC(N)C1 HR114870 [0,0,0,1,0,0|2,0,1]=4 259 B7R1.2 CN1CCC(O)C1 HR127095 [0,0,0,1,0,0|1,0,2]=4 260 B7R1.2 CN1CCC(O)C1 HR138502 [0,0,0,1,0,0|1,0,2]=4 261 B7R1.2 CN1CCC(O)C1 HR138762 [0,0,0,1,0,0|1,0,2]=4 262 B7R1.2 NC1CCC(=O)C1 HR145995 [0,0,0,1,0,0|1,0,0]=2 263 B7R1.2 NC1CCC(N)C1 HR146090 [0,0,0,1,0,0|2,0,1]=4 264 B7R1.2 NC1CCC(N)C1 HR146091 [0,0,0,1,0,0|2,0,1]=4 265 B7R1.2 NC1CCC(N)C1 HR146092 [0,0,0,1,0,0|2,0,1]=4 266 B7R1.2 NC1CCC(O)C1 HR146093 [0,0,0,1,0,0|1,0,2]=4 267 B7R1.2 NC1CCC(O)C1 HR146099 [0,0,0,1,0,0|1,0,2]=4 268 B7R1.2 NC1CCC(O)C1 HR146100 [0,0,0,1,0,0|1,0,2]=4 269 B7R1.2 NC1CCC(O)C1 HR146101 [0,0,0,1,0,0|1,0,2]=4 270 B7R1.2 NC1CCC(O)C1 HR146102 [0,0,0,1,0,0|1,0,2]=4 271 B7R1.2 NC1CCC(O)C1 HR146103 [0,0,0,1,0,0|1,0,2]=4 272 B7R1.2 NC1CCC(O)C1 HR146104 [0,0,0,1,0,0|1,0,2]=4 273 B7R1.2 NC1CCC(O)C1 HR146105 [0,0,0,1,0,0|1,0,2]=4 274 B7R1.2 NC1CCC(O)C1 HR148648 [0,0,0,1,0,0|1,0,2]=4 275 B7R1.2 NC1CCC(O)C1 HR30204 [0,0,0,1,0,0|1,0,2]=4 276 B7R1.2 NC1COC(=O)C1 HR14757 [0,0,0,1,0,0|2,0,0]=3 277 B7R1.2 NC1COC(=O)C1 HR14758 [0,0,0,1,0,0|2,0,0]=3 278 B7R1.2 O=C1CC(O)CN1 HR138458 [0,0,0,1,0,0|2,0,0]=3 279 B7R1.2 O=C1CC(O)CN1 HR138722 [0,0,0,1,0,0|2,0,0]=3 280 B7R1.2 O=C1CC(O)CN1 HR145864 [0,0,0,1,0,0|2,0,0]=3 281 B7R1.2 O=C1CC(O)CO1 HR126625 [0,0,0,1,0,0|2,0,0]=3 282 B7R1.2 O=C1CC(O)CO1 HR127054 [0,0,0,1,0,0|2,0,0]=3 283 B7R1.2 O=C1CC(S)CN1 HR112550 [0,0,0,1,0,0|2,0,0]=3 284 B7R1.2 O=C1CCC(=O)C1 HR130125 [0,0,0,1,0,0|1,0,1]=3 285 B7R1.2 O=C1CCC(=O)N1 HR135734 [0,0,0,1,0,0|2,0,1]=4 286 B7R1.2 O=C1CCC(=O)O1 HR135468 [0,0,0,1,0,0|2,0,1]=4 287 B7R1.2 O=C1COC(=O)C1 HR100364 [0,0,0,1,0,0|2,0,1]=4 288 B7R1.2 O=C1OCC(Cl)O1 HR123970 [0,0,0,1,0,0|3,0,0]=4 289 B7R1.2 O=C1OCC(F)O1 HR135652 [0,0,0,1,0,0|3,0,0]=4 290 B7R1.16 CC1(C)CC(Br)C1 HR146351 [0,0,0,1,0,0|1,0,1]=3 291 B7R1.16 O=S1(=O)CC(Cl)C1 HR121278 [0,0,0,1,0,0|3,0,0]=4 292 B7R1.20 O=C(O)CC1CC1 HR136745 [0,0,0,1,0,0|1,0,0]=2 293 B5R0.5 C=C(C)C(=O)Cl HR138689 [0,0,0,0,1,0|1,0,2]=4 294 B5R0.5 C=C(C)C(=O)[O-] HR113778 [0,0,0,0,1,0|1,0,2]=4 295 B5R0.5 C=C(C)C(=O)[O-] HR114122 [0,0,0,0,1,0|1,0,2]=4 296 B5R0.5 C=C(C)C(=O)[O-] HR121033 [0,0,0,0,1,0|1,0,2]=4 297 B5R0.5 C=C(C)C(=O)[O-] HR122305 [0,0,0,0,1,0|1,0,2]=4 298 B5R0.5 C=C(C)C(=O)[O-] HR125115 [0,0,0,0,1,0|1,0,2]=4 299 B5R0.5 C=C(C)C(=O)[O-] HR135365 [0,0,0,0,1,0|1,0,2]=4 300 B5R0.5 C=C(C)C(N)=O HR124465 [0,0,0,0,1,0|1,0,2]=4 301 B5R0.5 CC(=O)C(=O)O HR137803 [0,0,0,0,1,0|2,0,1]=4 302 B5R0.5 CC(=O)C(=O)[O-] HR112958 [0,0,0,0,1,0|2,0,1]=4 303 B5R0.5 CC(=O)C(=O)[O-] HR125137 [0,0,0,0,1,0|2,0,1]=4 304 B5R0.5 CC(=O)C(=O)[O-] HR130480 [0,0,0,0,1,0|2,0,1]=4 305 B5R0.5 CC(=O)C(=O)[O-] HR132795 [0,0,0,0,1,0|2,0,1]=4 306 B5R0.5 CC(=O)C(C)=O HR147207 [0,0,0,0,1,0|1,0,1]=3 307 B5R0.5 CC(=O)C(C)Br HR130439 [0,0,0,0,1,0|1,0,0]=2 308 B5R0.5 CC(=O)C(C)C HR147367 [0,0,0,0,1,0|0,0,0]=1 309 B5R0.5 CC(=O)C(C)Cl HR132014 [0,0,0,0,1,0|1,0,0]=2 310 B5R0.5 CC(=O)C(C)S HR123296 [0,0,0,0,1,0|1,0,0]=2 311 B5R0.5 CC(=O)N(C)C HR128416 [0,0,0,0,1,0|1,0,0]=2 312 B5R0.5 CC(Br)C(=O)Cl HR136180 [0,0,0,0,1,0|2,0,0]=3 313 B5R0.5 CC(Br)C(=O)O HR118834 [0,0,0,0,1,0|2,0,0]=3 314 B5R0.5 CC(Br)C(=O)O HR119145 [0,0,0,0,1,0|2,0,0]=3 315 B5R0.5 CC(C)B(O)O HR125100 [0,0,0,0,1,0|2,0,1]=4 316 B5R0.5 CC(C)C(=N)N HR121738 [0,0,0,0,1,0|2,0,0]=3 317 B5R0.5 CC(C)C(=O)Cl DAJL01406 [0,0,0,0,1,0|1,0,0]=2 318 B5R0.5 CC(C)C(C)N HR121679 [0,0,0,0,1,0|1,0,1]=3 319 B5R0.5 CC(C)C(C)S HR123979 [0,0,0,0,1,0|0,1,1]=3 320 B5R0.5 CC(C)C(N)=O HR130010 [0,0,0,0,1,0|1,0,0]=2 321 B5R0.5 CC(C)C(N)=S HR103461 [0,0,0,0,1,0|1,1,0]=3 322 B5R0.5 CC(C)N(C)C HR142079 [0,0,0,0,1,0|2,0,0]=3 323 B5R0.5 CC(Cl)C(=O)Cl HR127551 [0,0,0,0,1,0|2,0,0]=3 324 B5R0.5 CC(Cl)C(=O)O HR133703 [0,0,0,0,1,0|2,0,0]=3 325 B5R0.5 CC(Cl)C(=O)O HR5746 [0,0,0,0,1,0|2,0,0]=3 326 B5R0.5 CC(F)C(=O)O HR125319 [0,0,0,0,1,0|2,0,0]=3 327 B5R0.5 CC(N)C(=O)O HR127064 [0,0,0,0,1,0|2,0,0]=3 328 B5R0.5 CC(N)C(=O)O HR128842 [0,0,0,0,1,0|2,0,0]=3 329 B5R0.5 CC(N)C(=O)O HR135609 [0,0,0,0,1,0|2,0,0]=3 330 B5R0.5 CC(N)C(=O)O HR143449 [0,0,0,0,1,0|2,0,0]=3 331 B5R0.5 CC(N)C(C)O HR115270 [0,0,0,0,1,0|1,0,2]=4 332 B5R0.5 CC(N)C(N)=O HR121426 [0,0,0,0,1,0|2,0,0]=3 333 B5R0.5 CC(N)C(N)=O RAXM01501 [0,0,0,0,1,0|2,0,0]=3 334 B5R0.5 CC(N)[13C](=O)O HR144974 [0,0,0,0,1,0|2,0,0]=3 335 B5R0.5 CC(O)C(=O)O HR122637 [0,0,0,0,1,0|2,0,0]=3 336 B5R0.5 CC(O)C(=O)O HR124397 [0,0,0,0,1,0|2,0,0]=3 337 B5R0.5 CC(O)C(=O)O HR137557 [0,0,0,0,1,0|2,0,0]=3 338 B5R0.5 CC(O)C(=O)[O-] HR101208 [0,0,0,0,1,0|2,0,0]=3 339 B5R0.5 CC(O)C(=O)[O-] HR124337 [0,0,0,0,1,0|2,0,0]=3 340 B5R0.5 CC(O)C(=O)[O-] HR125547 [0,0,0,0,1,0|2,0,0]=3 341 B5R0.5 CC(O)C(=O)[O-] HR126089 [0,0,0,0,1,0|2,0,0]=3 342 B5R0.5 CC(O)C(=O)[O-] HR127008 [0,0,0,0,1,0|2,0,0]=3 343 B5R0.5 CC(O)C(=O)[O-] HR127541 [0,0,0,0,1,0|2,0,0]=3 344 B5R0.5 CC(O)C(=O)[O-] HR127693 [0,0,0,0,1,0|2,0,0]=3 345 B5R0.5 CC(O)C(=O)[O-] HR132263 [0,0,0,0,1,0|2,0,0]=3 346 B5R0.5 CC(O)C(C)O HR128860 [0,0,0,0,1,0|1,0,2]=4 347 B5R0.5 CC(O)C(C)O HR129128 [0,0,0,0,1,0|1,0,2]=4 348 B5R0.5 CC(O)C(C)O HR130175 [0,0,0,0,1,0|1,0,2]=4 349 B5R0.5 CC(O)C(N)=O HR103895 [0,0,0,0,1,0|2,0,0]=3 350 B5R0.5 CC(O)C(N)=O HR125386 [0,0,0,0,1,0|2,0,0]=3 351 B5R0.5 CC(S)C(C)S HR129973 [0,0,0,0,1,0|1,1,1]=4 352 B5R0.5 CN(C)C(=N)N HR119808 [0,0,0,0,1,0|3,0,0]=4 353 B5R0.5 CN(C)C(=N)N HR141686 [0,0,0,0,1,0|3,0,0]=4 354 B5R0.5 CN(C)C(=S)Cl HR134613 [0,0,0,0,1,0|2,1,0]=4 355 B5R0.5 CN(C)C(=S)[S-] HR128944 [0,0,0,0,1,0|2,1,0]=4 356 B5R0.5 CN(C)C(=S)[S-] HR135353 [0,0,0,0,1,0|2,1,0]=4 357 B5R0.5 CN(C)C(N)=O HR126485 [0,0,0,0,1,0|2,0,0]=3 358 B5R0.5 CN(C)[Si](C)C HR116086 [0,0,0,0,1,0|2,1,0]=4 359 B5R0.5 C[13CH](N)C(=O)O HR143521 [0,0,0,0,1,0|2,0,0]=3 360 B5R0.5 NC(=O)C(Cl)Cl HR126778 [0,0,0,0,1,0|3,0,0]=4 361 B5R0.5 O=C(Cl)C(F)F HR103865 [0,0,0,0,1,0|3,0,0]=4 362 B5R0.5 O=C(O)C(F)F HR125822 [0,0,0,0,1,0|3,0,0]=4 363 B5R0.5 O=C([O-])C(Cl)Cl HR128840 [0,0,0,0,1,0|3,0,0]=4 364 B5R0.5 O=C([O-])C(F)F HR100204 [0,0,0,0,1,0|3,0,0]=4 365 B5R0.5 [13CH3]C(N)C(=O)O HR141384 [0,0,0,0,1,0|2,0,0]=3 366 B5R0.5 [13CH3]C(N)C(=O)O HR144202 [0,0,0,0,1,0|2,0,0]=3 367 B7R0.6 C=C(C)COC(C)=O HR110682 [0,0,0,0,0,1|0,0,2]=3 368 B7R0.6 CC(=O)CCC(=O)O HR127576 [0,0,0,0,0,1|2,0,1]=4 369 B7R0.6 CC(=O)CCC(=O)[O-] HR143916 [0,0,0,0,0,1|2,0,1]=4 370 B7R0.6 CC(=O)CCC(C)=O HR125376 [0,0,0,0,0,1|1,0,1]=3 371 B7R0.6 CC(=O)CNC(C)=O HR146276 [0,0,0,0,0,1|1,0,1]=3 372 B7R0.6 CC(=O)COC(C)=O HR123551 [0,0,0,0,0,1|1,0,1]=3 373 B7R0.6 CC(=O)NCC(=O)O HR138579 [0,0,0,0,0,1|2,0,1]=4 374 B7R0.6 CC(=O)NNC(C)=O HR131799 [0,0,0,0,0,1|2,0,1]=4 375 B7R0.6 CC(=O)OCC(=O)Cl HR135462 [0,0,0,0,0,1|2,0,1]=4 376 B7R0.6 CC(=O)OCC(=O)O HR120464 [0,0,0,0,0,1|2,0,1]=4 377 B7R0.6 CC(=O)\C=C\C(C)C HR142759 [0,0,0,0,0,1|0,0,1]=2 378 B7R0.6 CC(Br)CCC(C)Br HR138142 [0,0,0,0,0,1|2,0,1]=4 379 B7R0.6 CC(C)=CC=C(C)C HR147224 [0,0,0,0,0,1|1,0,2]=4 380 B7R0.6 CC(C)=CCC(=O)O HR108591 [0,0,0,0,0,1|1,0,1]=3 381 B7R0.6 CC(C)=NNC(N)=O AZXF00311 [0,0,0,0,0,1|2,0,1]=4 382 B7R0.6 CC(C)CCB(O)O HR142030 [0,0,0,0,0,1|2,0,1]=4 383 B7R0.6 CC(C)CCC(=O)Cl HR101969 [0,0,0,0,0,1|1,0,0]=2 384 B7R0.6 CC(C)CCC(=O)O HR141883 [0,0,0,0,0,1|1,0,0]=2 385 B7R0.6 CC(C)CCC(C)N HR130987 [0,0,0,0,0,1|1,0,1]=3 386 B7R0.6 CC(C)SSC(C)C HR132081 [0,0,0,0,0,1|2,0,1]=4 387 B7R0.6 CC(C)\C=C\C(=O)[O-] HR107648 [0,0,0,0,0,1|1,0,1]=3 388 B7R0.6 CC(O)CCC(C)O HR127516 [0,0,0,0,0,1|1,0,2]=4 389 B7R0.6 CC(O)CCC(C)O HR141439 [0,0,0,0,0,1|1,0,2]=4 390 B7R0.6 CC(O)CCC(C)O HR141535 [0,0,0,0,0,1|1,0,2]=4 391 B7R0.6 CN(C)CCC(=O)O HR114553 [0,0,0,0,0,1|2,0,0]=3 392 B7R0.6 CN(C)CCC(=O)O HR147791 [0,0,0,0,0,1|2,0,0]=3 393 B7R0.6 CN(C)CCN(C)C HR118595 [0,0,0,0,0,1|3,0,0]=4 394 B7R0.6 CN(C)CCN(C)C HR147049 [0,0,0,0,0,1|3,0,0]=4 395 B7R0.6 CP(C)CCP(C)C HR140666 [0,0,0,0,0,1|3,0,0]=4 396 B7R0.6 C[S+](C)CCC(=O)O HR107679 [0,0,0,0,0,1|2,0,0]=3 397 B7R0.6 C[S+](C)CCC(=O)[O-] HR144459 [0,0,0,0,0,1|2,0,0]=3 398 B7R0.6 O=C([O-])CSC(F)F HR116710 [0,0,0,0,0,1|3,0,0]=4 399 B4R0.1 C=C(C)CBr HR118272 [2,0,0,0,0,0|2,0,0]=4 400 B4R0.1 C=C(C)CN HR103061 [2,0,0,0,0,0|2,0,0]=4 401 B4R0.1 C=C(C)OC HR127251 [2,0,0,0,0,0|2,0,0]=4 402 B4R0.1 C=CC(C)=O NASA01402 [2,0,0,0,0,0|0,0,2]=4 403 B4R0.1 C=CC(C)N HR115106 [2,0,0,0,0,0|1,0,1]=4 404 B4R0.1 C=CC(C)N HR115412 [2,0,0,0,0,0|1,0,1]=4 405 B4R0.1 C=CC(C)O HR107775 [2,0,0,0,0,0|1,0,1]=4 406 B4R0.1 CC(=O)C=O HR138052 [2,0,0,0,0,0|1,0,1]=4 407 B4R0.1 CC(=O)CBr HR147584 [2,0,0,0,0,0|1,0,0]=3 408 B4R0.1 CC(=O)CCl HR146994 [2,0,0,0,0,0|1,0,0]=3 409 B4R0.1 CC(=O)CN HR103911 [2,0,0,0,0,0|1,0,0]=3 410 B4R0.1 CC(=O)CN HR120199 [2,0,0,0,0,0|1,0,0]=3 411 B4R0.1 CC(=O)CO HR130889 [2,0,0,0,0,0|1,0,0]=3 412 B4R0.1 CC(=O)NN HR137209 [2,0,0,0,0,0|2,0,0]=4 413 B4R0.1 CC(=O)NO HR132350 [2,0,0,0,0,0|2,0,0]=4 414 B4R0.1 CC(=O)OO HR147573 [2,0,0,0,0,0|2,0,0]=4 415 B4R0.1 CC(C)=C=O HR100570 [2,0,0,0,0,0|0,0,2]=4 416 B4R0.1 CC(C)NN ENSA06702 [2,0,0,0,0,0|2,0,0]=4 417 B4R0.1 CC(C)NO HR127909 [2,0,0,0,0,0|1,0,1]=4 418 B4R0.1 CC(C)NO HR128179 [2,0,0,0,0,0|1,0,1]=4 419 B4R0.1 CC(C)ON HR102359 [2,0,0,0,0,0|2,0,0]=4 420 B4R0.1 CC(C)[Mg]Br HR118032 [2,0,0,0,0,0|2,0,0]=4 421 B4R0.1 CC(C)[Mg]Cl HR133071 [2,0,0,0,0,0|2,0,0]=4 422 B4R0.1 CC(Cl)CO HR137607 [2,0,0,0,0,0|1,0,1]=4 423 B4R0.1 CC(Cl)CO HR145870 [2,0,0,0,0,0|1,0,1]=4 424 B4R0.1 CC(Cl)CO HR8287 [2,0,0,0,0,0|1,0,1]=4 425 B4R0.1 CC(N)CN HR107514 [2,0,0,0,0,0|2,0,0]=4 426 B4R0.1 CC(N)CN HR114377 [2,0,0,0,0,0|2,0,0]=4 427 B4R0.1 CC(N)CO HR128063 [2,0,0,0,0,0|1,0,1]=4 428 B4R0.1 CC(N)CO RESA03608 [2,0,0,0,0,0|1,0,1]=4 429 B4R0.1 CC(N)CO VAJB01501 [2,0,0,0,0,0|1,0,1]=4 430 B4R0.1 CC(O)CBr HR101360 [2,0,0,0,0,0|2,0,0]=4 431 B4R0.1 CC(O)CCl HR135269 [2,0,0,0,0,0|2,0,0]=4 432 B4R0.1 CC(O)CCl HR137859 [2,0,0,0,0,0|2,0,0]=4 433 B4R0.1 CC(O)CN HR124975 [2,0,0,0,0,0|2,0,0]=4 434 B4R0.1 CC(O)CN RESA03408 [2,0,0,0,0,0|2,0,0]=4 435 B4R0.1 CC(O)CO HR123224 [2,0,0,0,0,0|1,0,1]=4 436 B4R0.1 CC(O)CO HR134690 [2,0,0,0,0,0|1,0,1]=4 437 B4R0.1 CC(O)CO HR135390 [2,0,0,0,0,0|1,0,1]=4 438 B4R0.1 CC([NH3+])CO HR127458 [2,0,0,0,0,0|1,0,1]=4 439 B4R0.1 CCC(=N)N HR124081 [2,0,0,0,0,0|2,0,0]=4 440 B4R0.1 CCC(=O)[O-] HR100550 [2,0,0,0,0,0|1,0,0]=3 441 B4R0.1 CCC(=O)[O-] HR104439 [2,0,0,0,0,0|1,0,0]=3 442 B4R0.1 CCC(=O)[O-] HR133146 [2,0,0,0,0,0|1,0,0]=3 443 B4R0.1 CCC(=O)[O-] HR133686 [2,0,0,0,0,0|1,0,0]=3 444 B4R0.1 CCC(=O)[O-] HR140520 [2,0,0,0,0,0|1,0,0]=3 445 B4R0.1 CCC(=O)[O-] HR145618 [2,0,0,0,0,0|1,0,0]=3 446 B4R0.1 CCC(C)N HR146170 [2,0,0,0,0,0|1,0,0]=3 447 B4R0.1 CCC(C)O HR134477 [2,0,0,0,0,0|1,0,0]=3 448 B4R0.1 CCC(C)O HR138640 [2,0,0,0,0,0|1,0,0]=3 449 B4R0.1 CCC(C)[O-] HR123042 [2,0,0,0,0,0|1,0,0]=3 450 B4R0.1 CCC(N)=O HR135085 [2,0,0,0,0,0|1,0,0]=3 451 B4R0.1 CCC(N)=S HR103772 [2,0,0,0,0,0|1,1,0]=4 452 B4R0.1 CCC(N)N HR113560 [2,0,0,0,0,0|2,0,0]=4 453 B4R0.1 CCN(C)C HR137292 [2,0,0,0,0,0|1,0,0]=3 454 B4R0.1 CCS(=O)[O-] HR107475 [2,0,0,0,0,0|2,0,0]=4 455 B4R0.1 CC[N+](=O)[O-] ANSA06411 [2,0,0,0,0,0|2,0,0]=4 456 B4R0.1 CN(C)C=O HR147510 [2,0,0,0,0,0|1,0,0]=3 457 B4R0.1 CN(C)C=S HR147835 [2,0,0,0,0,0|1,1,0]=4 458 B4R0.1 CNC(=O)Cl HR124675 [2,0,0,0,0,0|2,0,0]=4 459 B4R0.1 CNC(C)=O HR133410 [2,0,0,0,0,0|1,0,0]=3 460 B4R0.1 CNC(C)C HR108788 [2,0,0,0,0,0|1,0,0]=3 461 B4R0.1 CNC(N)=O HR130491 [2,0,0,0,0,0|2,0,0]=4 462 B4R0.1 COC(=O)Cl ANSA06440 [2,0,0,0,0,0|2,0,0]=4 463 B4R0.1 COC(N)=O HR124182 [2,0,0,0,0,0|2,0,0]=4 464 B4R0.1 CO[SiH](C)C HR100966 [2,0,0,0,0,0|1,1,0]=4 465 B4R0.1 CSC(C)=O HR129778 [2,0,0,0,0,0|1,0,0]=3 466 B4R0.1 CSC(C)C HR129517 [2,0,0,0,0,0|1,0,0]=3 467 B4R0.1 C[N+](C)=CCl HR128587 [2,0,0,0,0,0|2,0,0]=4 468 B4R0.1 NC(=O)CBr HR101040 [2,0,0,0,0,0|2,0,0]=4 469 B4R0.1 NC(=O)CBr HR132005 [2,0,0,0,0,0|2,0,0]=4 470 B4R0.1 NC(=O)CCl HR138619 [2,0,0,0,0,0|2,0,0]=4 471 B4R0.1 NC(=O)CI HR127038 [2,0,0,0,0,0|2,0,0]=4 472 B4R0.1 NCC(=O)O HR123103 [2,0,0,0,0,0|2,0,0]=4 473 B4R0.1 NCC(=O)O HR134482 [2,0,0,0,0,0|2,0,0]=4 474 B4R0.1 NCC(=O)[O-] HR100672 [2,0,0,0,0,0|2,0,0]=4 475 B4R0.1 NCC(=O)[O-] HR132852 [2,0,0,0,0,0|2,0,0]=4 476 B4R0.1 NCC(=O)[O-] HR132860 [2,0,0,0,0,0|2,0,0]=4 477 B4R0.1 NCC(=O)[O-] HR134278 [2,0,0,0,0,0|2,0,0]=4 478 B4R0.1 NCC(=O)[O-] HR136299 [2,0,0,0,0,0|2,0,0]=4 479 B4R0.1 NCC(=O)[O-] HR9921 [2,0,0,0,0,0|2,0,0]=4 480 B4R0.1 NCC(N)=O HR123368 [2,0,0,0,0,0|2,0,0]=4 481 B4R0.1 NCC(N)=O SESA01801 [2,0,0,0,0,0|2,0,0]=4 482 B4R0.1 O=C(Br)CBr POCQ01902 [2,0,0,0,0,0|2,0,0]=4 483 B4R0.1 O=C(Cl)CBr POCQ01905 [2,0,0,0,0,0|2,0,0]=4 484 B4R0.1 O=C(Cl)CCl SQJB01602 [2,0,0,0,0,0|2,0,0]=4 485 B4R0.1 O=C(Cl)CF HR102086 [2,0,0,0,0,0|2,0,0]=4 486 B4R0.1 O=C(O)CBr HR147062 [2,0,0,0,0,0|2,0,0]=4 487 B4R0.1 O=C(O)CCl HR147508 [2,0,0,0,0,0|2,0,0]=4 488 B4R0.1 O=C(O)CO HR128939 [2,0,0,0,0,0|2,0,0]=4 489 B4R0.1 O=C(O)CS HR128237 [2,0,0,0,0,0|2,0,0]=4 490 B4R0.1 O=C([O-])CBr HR116499 [2,0,0,0,0,0|2,0,0]=4 491 B4R0.1 O=C([O-])CI HR131471 [2,0,0,0,0,0|2,0,0]=4 492 B4R0.1 O=C([O-])CO HR134522 [2,0,0,0,0,0|2,0,0]=4 493 B4R0.1 O=C([O-])CS HR135616 [2,0,0,0,0,0|2,0,0]=4 494 B4R0.1 O=C([O-])CS HR135882 [2,0,0,0,0,0|2,0,0]=4 495 B4R0.1 O=C([O-])CS HR136156 [2,0,0,0,0,0|2,0,0]=4 496 B4R0.1 O=C([O-])CS HR137167 [2,0,0,0,0,0|2,0,0]=4 497 B4R0.1 O=CC(Cl)Cl HR126253 [2,0,0,0,0,0|2,0,0]=4 498 B4R0.1 [Li]C(C)CC HR128023 [2,0,0,0,0,0|1,0,0]=3 499 B4R0.1 [Li]CC(C)C HR106513 [2,0,0,0,0,0|1,0,0]=3 500 B4R0.2 C=CCCBr HR124734 [2,0,0,0,0,0|1,0,1]=4 501 B4R0.2 C=CCCN HR116389 [2,0,0,0,0,0|1,0,1]=4 502 B4R0.2 C=CCCO HR127635 [2,0,0,0,0,0|1,0,1]=4 503 B4R0.2 C=CCOC HR111200 [2,0,0,0,0,0|1,0,1]=4 504 B4R0.2 C=CCSC HR122911 [2,0,0,0,0,0|1,0,1]=4 505 B4R0.2 C=COCC CESA03009 [2,0,0,0,0,0|1,0,1]=4 506 B4R0.2 CCCCN HR105634 [2,0,0,0,0,0|1,0,1]=4 507 B4R0.2 CCCCO HR138784 [2,0,0,0,0,0|0,0,2]=4 508 B4R0.2 CCCC[O-] HR125276 [2,0,0,0,0,0|0,0,2]=4 509 B4R0.2 CCCC[Si] HR100255 [2,0,0,0,0,0|0,1,1]=4 510 B4R0.2 CCCNC HR109098 [2,0,0,0,0,0|1,0,0]=3 511 B4R0.2 CCCSC HR128481 [2,0,0,0,0,0|1,0,0]=3 512 B4R0.2 CCC[Mg]Br HR101998 [2,0,0,0,0,0|2,0,0]=4 513 B4R0.2 CCC[Mg]Cl HR101421 [2,0,0,0,0,0|2,0,0]=4 514 B4R0.2 CCNC=O HR104364 [2,0,0,0,0,0|1,0,0]=3 515 B4R0.2 CCNCC HR101857 [2,0,0,0,0,0|1,0,1]=4 516 B4R0.2 CCNCC HR127000 [2,0,0,0,0,0|1,0,1]=4 517 B4R0.2 CCNCC HR132573 [2,0,0,0,0,0|1,0,1]=4 518 B4R0.2 CCOC=N HR105865 [2,0,0,0,0,0|2,0,0]=4 519 B4R0.2 CCPCC HR117135 [2,0,0,0,0,0|1,0,1]=4 520 B4R0.2 CCSCC HR120777 [2,0,0,0,0,0|1,0,1]=4 521 B4R0.2 CCSCC HR127285 [2,0,0,0,0,0|1,0,1]=4 522 B4R0.2 CCSSC HR129263 [2,0,0,0,0,0|2,0,0]=4 523 B4R0.2 CC\C=C\Br HR114361 [2,0,0,0,0,0|1,0,1]=4 524 B4R0.2 CNCCO HR131851 [2,0,0,0,0,0|2,0,0]=4 525 B4R0.2 COCCBr HR2138 [2,0,0,0,0,0|2,0,0]=4 526 B4R0.2 COCCCl HR130902 [2,0,0,0,0,0|2,0,0]=4 527 B4R0.2 COCCN HR101134 [2,0,0,0,0,0|2,0,0]=4 528 B4R0.2 CSCC=O HR129243 [2,0,0,0,0,0|1,0,0]=3 529 B4R0.2 CSCCN HR110636 [2,0,0,0,0,0|2,0,0]=4 530 B4R0.2 CSCCO HR125294 [2,0,0,0,0,0|2,0,0]=4 531 B4R0.2 CSCSC HR125290 [2,0,0,0,0,0|2,0,0]=4 532 B4R0.2 C\C=C\CC HR121335 [2,0,0,0,0,0|0,0,1]=3 533 B4R0.2 C\C=C\CC HR121956 [2,0,0,0,0,0|0,0,1]=3 534 B4R0.2 C\C=C\CCl HR130392 [2,0,0,0,0,0|1,0,1]=4 535 B4R0.2 C\C=C\CN HR109640 [2,0,0,0,0,0|1,0,1]=4 536 B4R0.2 C\C=C\OC HR102446 [2,0,0,0,0,0|1,0,1]=4 537 B4R0.2 N#CCC=O HR116464 [2,0,0,0,0,0|1,0,1]=4 538 B4R0.2 [Li]CCCC HR138942 [2,0,0,0,0,0|1,0,1]=4 539 B6R0.1 C#CC(=O)NCC HR116239 [1,1,0,0,0,0|1,0,1]=4 540 B6R0.1 C#CC(=O)OCC HR132600 [1,1,0,0,0,0|1,0,1]=4 541 B6R0.1 C=CC(=O)CCC HR100488 [1,1,0,0,0,0|0,0,1]=3 542 B6R0.1 CC#CC(=O)OC HR141249 [1,1,0,0,0,0|0,0,2]=4 543 B6R0.1 CC(CO)CCO HR114955 [1,1,0,0,0,0|0,0,2]=4 544 B6R0.1 CCC(=O)CC#N HR104780 [1,1,0,0,0,0|1,0,1]=4 545 B6R0.1 CCC(=O)CSC HR123442 [1,1,0,0,0,0|1,0,0]=3 546 B6R0.1 CCC(C)CCO HR120273 [1,1,0,0,0,0|0,0,2]=4 547 B6R0.1 CCCC(=O)NN HR113429 [1,1,0,0,0,0|1,0,0]=3 548 B6R0.1 CCCC(=O)SC HR136352 [1,1,0,0,0,0|0,0,0]=2 549 B6R0.1 CCCC(=S)OC HR122832 [1,1,0,0,0,0|0,1,0]=3 550 B6R0.1 CCCC(Br)CBr HR132339 [1,1,0,0,0,0|1,0,1]=4 551 B6R0.1 CCCC(Br)CC HR118696 [1,1,0,0,0,0|1,0,1]=4 552 B6R0.1 CCCC(N)CO HR112281 [1,1,0,0,0,0|1,0,1]=4 553 B6R0.1 CCCC(O)CO HR126914 [1,1,0,0,0,0|0,0,2]=4 554 B6R0.1 CCOC(=N)CCl HR112327 [1,1,0,0,0,0|2,0,0]=4 555 B6R0.1 CCOC(=O)C=O HR130872 [1,1,0,0,0,0|1,0,1]=4 556 B6R0.1 CCOC(=O)CBr AMJB00601 [1,1,0,0,0,0|1,0,0]=3 557 B6R0.1 CCOC(=O)CCl HR147617 [1,1,0,0,0,0|1,0,0]=3 558 B6R0.1 CCOC(=O)CN HR134743 [1,1,0,0,0,0|1,0,0]=3 559 B6R0.1 CCOC(=O)CO HR127384 [1,1,0,0,0,0|1,0,0]=3 560 B6R0.1 CCOC(=O)CS HR136673 [1,1,0,0,0,0|1,0,0]=3 561 B6R0.1 CCOC(=O)NN HR102667 [1,1,0,0,0,0|2,0,0]=4 562 B6R0.1 CCOC(=O)NN HR138962 [1,1,0,0,0,0|2,0,0]=4 563 B6R0.1 CCOC(=O)OC HR138173 [1,1,0,0,0,0|1,0,0]=3 564 B6R0.1 CCO\C(C)=N/O SIJL01004 [1,1,0,0,0,0|1,0,1]=4 565 B6R0.1 CCSC(=O)CC HR138214 [1,1,0,0,0,0|1,0,0]=3 566 B6R0.1 CNC(=O)CC#N HR121877 [1,1,0,0,0,0|1,0,1]=4 567 B6R0.1 CNCC(=O)OC HR130436 [1,1,0,0,0,0|1,0,0]=3 568 B6R0.1 CNCC(O)CO HR129465 [1,1,0,0,0,0|2,0,0]=4 569 B6R0.1 COC(=O)CC#N OLSA05202 [1,1,0,0,0,0|1,0,1]=4 570 B6R0.1 COC(=O)CCBr HR133552 [1,1,0,0,0,0|1,0,0]=3 571 B6R0.1 COC(=O)CCN HR135038 [1,1,0,0,0,0|1,0,0]=3 572 B6R0.1 COC(=O)CCS HR133169 [1,1,0,0,0,0|1,0,0]=3 573 B6R0.1 COC(C)CCO HR100431 [1,1,0,0,0,0|0,0,2]=4 574 B6R0.1 COCC(=O)OC HR147666 [1,1,0,0,0,0|1,0,0]=3 575 B6R0.1 COCC(C)OC HR127461 [1,1,0,0,0,0|1,0,0]=3 576 B6R0.1 COCC(O)CO HR137691 [1,1,0,0,0,0|2,0,0]=4 577 B6R0.1 CSC(C)CC=O HR133413 [1,1,0,0,0,0|0,0,0]=2 578 B6R0.1 C\C=C\C(=O)CC HR108073 [1,1,0,0,0,0|0,0,2]=4 579 B6R0.1 O=C(CCl)NCO HR124394 [1,1,0,0,0,0|2,0,0]=4 580 B6R0.1 [C-]#[N+]CC(=O)OC HR110956 [1,1,0,0,0,0|1,0,1]=4 581 B6R0.3 C=C(CC)C(=O)O HR118672 [1,1,0,0,0,0|1,0,1]=4 582 B6R0.3 CC(C)C(N)CO HR108489 [1,1,0,0,0,0|0,0,2]=4 583 B6R0.3 CC(C)C(N)CO HR127327 [1,1,0,0,0,0|0,0,2]=4 584 B6R0.3 CC(C)C(N)CO HR146615 [1,1,0,0,0,0|0,0,2]=4 585 B6R0.3 CC(CN)C(=O)O HR133030 [1,1,0,0,0,0|2,0,0]=4 586 B6R0.3 CCC(=O)C(=O)O HR128819 [1,1,0,0,0,0|1,0,1]=4 587 B6R0.3 CCC(=O)C(C)=O HR131826 [1,1,0,0,0,0|0,0,1]=3 588 B6R0.3 CCC(Br)C(=O)Cl HR115509 [1,1,0,0,0,0|1,0,0]=3 589 B6R0.3 CCC(Br)C(=O)O HR123595 [1,1,0,0,0,0|1,0,0]=3 590 B6R0.3 CCC(C)C(=O)Cl HR144038 [1,1,0,0,0,0|1,0,0]=3 591 B6R0.3 CCC(C)C(=O)O HR124401 [1,1,0,0,0,0|1,0,0]=3 592 B6R0.3 CCC(C)C(=O)O HR124666 [1,1,0,0,0,0|1,0,0]=3 593 B6R0.3 CCC(C)C(N)=O HR115534 [1,1,0,0,0,0|1,0,0]=3 594 B6R0.3 CCC(Cl)C(=O)O HR104193 [1,1,0,0,0,0|1,0,0]=3 595 B6R0.3 CCC(Cl)C(=O)O HR104505 [1,1,0,0,0,0|1,0,0]=3 596 B6R0.3 CCC(N)C(=O)O HR100731 [1,1,0,0,0,0|1,0,0]=3 597 B6R0.3 CCC(N)C(=O)O HR128531 [1,1,0,0,0,0|1,0,0]=3 598 B6R0.3 CCC(N)C(=O)O HR128797 [1,1,0,0,0,0|1,0,0]=3 599 B6R0.3 CCC(N)C(=O)O HR130831 [1,1,0,0,0,0|1,0,0]=3 600 B6R0.3 CCC(N)C(=O)O VOJL00901 [1,1,0,0,0,0|1,0,0]=3 601 B6R0.3 CCC(N)C(N)=O HR113889 [1,1,0,0,0,0|1,0,0]=3 602 B6R0.3 CCC(N)C(N)=O HR133280 [1,1,0,0,0,0|1,0,0]=3 603 B6R0.3 CCC(O)C(=O)O HR145745 [1,1,0,0,0,0|1,0,0]=3 604 B6R0.3 CCC(O)C(=O)O HR8265 [1,1,0,0,0,0|1,0,0]=3 605 B6R0.3 CCC(S)C(C)=O HR124234 [1,1,0,0,0,0|0,0,0]=2 606 B6R0.3 CCN(C)C(=O)Cl HR16066 [1,1,0,0,0,0|2,0,0]=4 607 B6R0.3 CNC(C)C(=O)O HR126490 [1,1,0,0,0,0|2,0,0]=4 608 B6R0.3 CNC(C)C(=O)O HR131233 [1,1,0,0,0,0|2,0,0]=4 609 B6R0.3 CNC(C)C(=O)O HR138734 [1,1,0,0,0,0|2,0,0]=4 610 B6R0.3 CNC(C)C(=O)[O-] HR145674 [1,1,0,0,0,0|2,0,0]=4 611 B6R0.3 COC(=O)C(C)=O HR131015 [1,1,0,0,0,0|1,0,1]=4 612 B6R0.3 CON(C)C(C)=O HR136259 [1,1,0,0,0,0|2,0,0]=4 613 B6R0.3 CSC(C)C(C)=O HR133684 [1,1,0,0,0,0|1,0,0]=3 614 B6R0.3 NC(=O)C(Br)CBr HR125555 [1,1,0,0,0,0|2,0,0]=4 615 B6R0.3 NC(=O)C(N)CO HR115072 [1,1,0,0,0,0|2,0,0]=4 616 B6R0.3 NC(CO)C(=O)O HR10704 [1,1,0,0,0,0|2,0,0]=4 617 B6R0.3 NC(CO)C(=O)O HR11003 [1,1,0,0,0,0|2,0,0]=4 618 B6R0.3 NC(CO)C(=O)O HR136009 [1,1,0,0,0,0|2,0,0]=4 619 B6R0.3 NC(CS)C(=O)O HR125082 [1,1,0,0,0,0|2,0,0]=4 620 B6R0.3 NC(CS)C(=O)O HR125295 [1,1,0,0,0,0|2,0,0]=4 621 B6R0.3 NC(CS)C(=O)O HR125344 [1,1,0,0,0,0|2,0,0]=4 622 B6R0.3 NC(CS)C(=O)O HR129167 [1,1,0,0,0,0|2,0,0]=4 623 B6R0.3 NC(CS)C(=O)O HR129315 [1,1,0,0,0,0|2,0,0]=4 624 B6R0.3 NC(CS)C(=O)O HR129684 [1,1,0,0,0,0|2,0,0]=4 625 B6R0.3 NC(CS)C(=O)O HR135781 [1,1,0,0,0,0|2,0,0]=4 626 B6R0.3 NC(CS)C(=O)O HR136316 [1,1,0,0,0,0|2,0,0]=4 627 B6R0.3 NC(C[SeH])C(=O)O HR101211 [1,1,0,0,0,0|2,0,0]=4 628 B6R0.3 NCC(N)C(=O)O HR101827 [1,1,0,0,0,0|2,0,0]=4 629 B6R0.3 NCC(N)C(=O)O HR120379 [1,1,0,0,0,0|2,0,0]=4 630 B6R0.3 NCC(N)C(=O)O HR130162 [1,1,0,0,0,0|2,0,0]=4 631 B6R0.3 NCC(N)C(=O)O HR137268 [1,1,0,0,0,0|2,0,0]=4 632 B6R0.3 NCC(O)C(=O)O HR126827 [1,1,0,0,0,0|2,0,0]=4 633 B6R0.3 NCC(O)C(=O)O HR145757 [1,1,0,0,0,0|2,0,0]=4 634 B6R0.3 NCC(O)C(=O)O HR145758 [1,1,0,0,0,0|2,0,0]=4 635 B6R0.3 O=C(Cl)C(Br)CBr HR128333 [1,1,0,0,0,0|2,0,0]=4 636 B6R0.3 O=C(O)C(Br)CBr HR128067 [1,1,0,0,0,0|2,0,0]=4 637 B6R0.3 O=C(O)C(Br)CO HR121810 [1,1,0,0,0,0|2,0,0]=4 638 B6R0.3 O=C(O)C(Cl)CCl HR102337 [1,1,0,0,0,0|2,0,0]=4 639 B6R0.4 C#CCCC(=O)O HR101408 [1,1,0,0,0,0|1,0,1]=4 640 B6R0.4 C=C(C)CNCC HR128262 [1,1,0,0,0,0|1,0,0]=3 641 B6R0.4 C=CCCC(=O)Cl HR106043 [1,1,0,0,0,0|1,0,1]=4 642 B6R0.4 C=CCCC(=O)O HR128583 [1,1,0,0,0,0|1,0,1]=4 643 B6R0.4 CC(=O)CCCBr HR147487 [1,1,0,0,0,0|0,0,0]=2 644 B6R0.4 CC(=O)CCCCl HR100024 [1,1,0,0,0,0|0,0,0]=2 645 B6R0.4 CC(=O)CCCO HR136959 [1,1,0,0,0,0|0,0,0]=2 646 B6R0.4 CC(=O)NCCN HR128075 [1,1,0,0,0,0|1,0,0]=3 647 B6R0.4 CC(=O)NCCO HR100613 [1,1,0,0,0,0|1,0,0]=3 648 B6R0.4 CC(=O)OCCBr HR131354 [1,1,0,0,0,0|1,0,0]=3 649 B6R0.4 CC(Br)CCCBr HR123815 [1,1,0,0,0,0|1,0,1]=4 650 B6R0.4 CC(C)=NNC=O HR117540 [1,1,0,0,0,0|1,0,1]=4 651 B6R0.4 CC(C)CCC=O HR118427 [1,1,0,0,0,0|0,0,0]=2 652 B6R0.4 CC(C)CCCBr HR133659 [1,1,0,0,0,0|0,0,1]=3 653 B6R0.4 CC(C)NCCN HR8612 [1,1,0,0,0,0|1,0,1]=4 654 B6R0.4 CC(C)NCCO HR143524 [1,1,0,0,0,0|0,0,2]=4 655 B6R0.4 CC(O)CCCO HR139458 [1,1,0,0,0,0|0,0,2]=4 656 B6R0.4 CCCCC(=O)Cl HR147689 [1,1,0,0,0,0|1,0,0]=3 657 B6R0.4 CCCCC(=O)[O-] HR143929 [1,1,0,0,0,0|1,0,0]=3 658 B6R0.4 CCCCC(C)N HR107080 [1,1,0,0,0,0|1,0,1]=4 659 B6R0.4 CCCCC(C)O HR113264 [1,1,0,0,0,0|0,0,2]=4 660 B6R0.4 CCCCC(C)O HR141634 [1,1,0,0,0,0|0,0,2]=4 661 B6R0.4 CCCCC(N)=O HR110039 [1,1,0,0,0,0|1,0,0]=3 662 B6R0.4 CCCCN(C)C HR124181 [1,1,0,0,0,0|1,0,1]=4 663 B6R0.4 CCCC[Sn](=O)O HR135371 [1,1,0,0,0,0|2,0,0]=4 664 B6R0.4 CCCNC(N)=S HR109524 [1,1,0,0,0,0|1,1,0]=4 665 B6R0.4 CCCSC(C)=O HR137881 [1,1,0,0,0,0|0,0,0]=2 666 B6R0.4 CCNCC(=O)O HR105131 [1,1,0,0,0,0|1,0,0]=3 667 B6R0.4 CCOCC(=O)O HR123178 [1,1,0,0,0,0|1,0,0]=3 668 B6R0.4 CN(C)CCCBr HR107607 [1,1,0,0,0,0|1,0,1]=4 669 B6R0.4 CN(C)CCCBr HR147342 [1,1,0,0,0,0|1,0,1]=4 670 B6R0.4 CN(C)CCCCl HR109407 [1,1,0,0,0,0|1,0,1]=4 671 B6R0.4 CN(C)CCCCl HR137097 [1,1,0,0,0,0|1,0,1]=4 672 B6R0.4 CN(C)CCCS HR107362 [1,1,0,0,0,0|1,0,1]=4 673 B6R0.4 CN(C)\C=C\C=O HR126291 [1,1,0,0,0,0|1,0,1]=4 674 B6R0.4 CNCCC(=O)O HR100194 [1,1,0,0,0,0|1,0,0]=3 675 B6R0.4 COCCC(C)O HR129774 [1,1,0,0,0,0|0,0,2]=4 676 B6R0.4 CO\C=C\C(C)=O HR138997 [1,1,0,0,0,0|0,0,2]=4 677 B6R0.4 CSCCC(C)=O HR133952 [1,1,0,0,0,0|0,0,0]=2 678 B6R0.4 N#CCCC(=O)O HR103469 [1,1,0,0,0,0|1,0,1]=4 679 B6R0.4 NCCCC(=O)O HR130958 [1,1,0,0,0,0|1,0,0]=3 680 B6R0.4 O=C(Cl)CCCBr HR102428 [1,1,0,0,0,0|1,0,0]=3 681 B6R0.4 O=C(Cl)CCCCl HR129406 [1,1,0,0,0,0|1,0,0]=3 682 B6R0.4 O=C(Cl)OCCCl HR132842 [1,1,0,0,0,0|2,0,0]=4 683 B6R0.4 O=C(Cl)OCCCl HR17418 [1,1,0,0,0,0|2,0,0]=4 684 B6R0.4 O=C(O)CCCBr HR131673 [1,1,0,0,0,0|1,0,0]=3 685 B6R0.4 O=C(O)CCCCl HR120152 [1,1,0,0,0,0|1,0,0]=3 686 B6R0.4 O=CCCC(=O)O HR134907 [1,1,0,0,0,0|1,0,1]=4 687 B6R0.5 C=CC[N+](C)(C)C HR141687 [1,1,0,0,0,0|1,0,1]=4 688 B6R0.5 C=CC[Si](C)(C)C HR116782 [1,1,0,0,0,0|0,1,1]=4 689 B6R0.5 C=CC[Si](C)(C)C HR138301 [1,1,0,0,0,0|0,1,1]=4 690 B6R0.5 C=CC[Si](C)(C)Cl HR121768 [1,1,0,0,0,0|0,1,1]=4 691 B6R0.5 C=COC(C)(C)C HR121986 [1,1,0,0,0,0|1,0,1]=4 692 B6R0.5 CC(C)(C)CC=O HR3076 [1,1,0,0,0,0|0,0,0]=2 693 B6R0.5 CC(C)(C)CCBr HR131505 [1,1,0,0,0,0|1,0,1]=4 694 B6R0.5 CC(C)(C)CCCl HR127490 [1,1,0,0,0,0|1,0,1]=4 695 B6R0.5 CC(C)(C)CCO HR137816 [1,1,0,0,0,0|0,0,2]=4 696 B6R0.5 CC(C)(C)C[Mg]Cl HR101073 [1,1,0,0,0,0|2,0,0]=4 697 B6R0.5 CC(C)(C)ON=O HR137762 [1,1,0,0,0,0|2,0,0]=4 698 B6R0.5 CC(C)(N)CCO HR142292 [1,1,0,0,0,0|0,0,2]=4 699 B6R0.5 CC(C)(S)CCO HR125918 [1,1,0,0,0,0|0,0,2]=4 700 B6R0.5 CCCS(=O)(=O)Cl HR129518 [1,1,0,0,0,0|2,0,0]=4 701 B6R0.5 CCCS(=O)(=O)O HR120663 [1,1,0,0,0,0|2,0,0]=4 702 B6R0.5 CCCS(N)(=O)=O HR138225 [1,1,0,0,0,0|2,0,0]=4 703 B6R0.5 CCC[Si](C)(C)Cl HR107165 [1,1,0,0,0,0|0,1,1]=4 704 B6R0.5 CCNC(C)(C)C HR119788 [1,1,0,0,0,0|1,0,1]=4 705 B6R0.5 CCOC(C)(C)C HR135207 [1,1,0,0,0,0|1,0,1]=4 706 B6R0.5 CCOS(C)(=O)=O HR131022 [1,1,0,0,0,0|2,0,0]=4 707 B6R0.5 COC[Si](C)(C)C HR141442 [1,1,0,0,0,0|1,1,0]=4 708 B6R0.5 CS(=O)(=O)CCN HR129630 [1,1,0,0,0,0|2,0,0]=4 709 B6R0.5 CS(=O)(=O)CCN HR129894 [1,1,0,0,0,0|2,0,0]=4 710 B6R0.5 CS(=O)(=O)CCO HR132598 [1,1,0,0,0,0|2,0,0]=4 711 B6R0.5 C[N+](C)(C)CC=O HR100953 [1,1,0,0,0,0|1,0,0]=3 712 B6R0.7 CC(=O)C(C)(C)C HR147694 [0,1,0,0,1,0|0,0,0]=2 713 B6R0.7 CC(=O)C(C)(C)O HR125473 [0,1,0,0,1,0|0,0,0]=2 714 B6R0.7 CC(=O)C(Cl)(Cl)Cl HR122621 [0,1,0,0,1,0|2,0,0]=4 715 B6R0.7 CC(=O)C(F)(F)F HR150212 [0,1,0,0,1,0|2,0,0]=4 716 B6R0.7 CC(=O)[Si](C)(C)C HR104737 [0,1,0,0,1,0|0,1,0]=3 717 B6R0.7 CC(C)(Br)C(=O)Br HR133497 [0,1,0,0,1,0|1,0,0]=3 718 B6R0.7 CC(C)(Br)C(=O)O HR133224 [0,1,0,0,1,0|1,0,0]=3 719 B6R0.7 CC(C)(C)C(=N)N HR101725 [0,1,0,0,1,0|2,0,0]=4 720 B6R0.7 CC(C)(C)C(=O)Cl HR147696 [0,1,0,0,1,0|1,0,0]=3 721 B6R0.7 CC(C)(C)C(=O)O HR129720 [0,1,0,0,1,0|1,0,0]=3 722 B6R0.7 CC(C)(C)C(=O)S HR142293 [0,1,0,0,1,0|1,0,0]=3 723 B6R0.7 CC(C)(C)C(=O)[O-] HR116684 [0,1,0,0,1,0|1,0,0]=3 724 B6R0.7 CC(C)(C)C(=O)[O-] HR118949 [0,1,0,0,1,0|1,0,0]=3 725 B6R0.7 CC(C)(C)C(N)=O SEXF01404 [0,1,0,0,1,0|1,0,0]=3 726 B6R0.7 CC(C)(C)C(N)=S HR105495 [0,1,0,0,1,0|1,1,0]=4 727 B6R0.7 CC(C)(C)S(=O)Cl HR122983 [0,1,0,0,1,0|2,0,0]=4 728 B6R0.7 CC(C)(C)S(N)=O HR6057 [0,1,0,0,1,0|2,0,0]=4 729 B6R0.7 CC(C)(C)S(N)=O HR6058 [0,1,0,0,1,0|2,0,0]=4 730 B6R0.7 CC(C)(C)S(N)=O HR9911 [0,1,0,0,1,0|2,0,0]=4 731 B6R0.7 CC(C)(N)C(=O)O HR126357 [0,1,0,0,1,0|1,0,0]=3 732 B6R0.7 CC(C)(O)C(=O)O HR138865 [0,1,0,0,1,0|1,0,0]=3 733 B6R0.7 CC(C)(S)C(=O)O HR123342 [0,1,0,0,1,0|1,0,0]=3 734 B6R0.7 CC(C)S(=O)(=O)Cl HR128311 [0,1,0,0,1,0|2,0,0]=4 735 B6R0.7 CC(C)S(C)(=O)=O HR107037 [0,1,0,0,1,0|1,0,0]=3 736 B6R0.7 CC(C)S(N)(=O)=O HR16612 [0,1,0,0,1,0|2,0,0]=4 737 B6R0.7 CC(C)[Si](C)(C)Cl HR141837 [0,1,0,0,1,0|1,1,0]=4 738 B6R0.7 CC(Cl)(Cl)C(=O)O HR134854 [0,1,0,0,1,0|2,0,0]=4 739 B6R0.7 CC(Cl)(Cl)C(=O)[O-] HR100472 [0,1,0,0,1,0|2,0,0]=4 740 B6R0.7 CC(F)(F)C(=O)O HR137545 [0,1,0,0,1,0|2,0,0]=4 741 B6R0.7 C[SiH](C)C(C)(C)C HR140954 [0,1,0,0,1,0|1,1,0]=4 742 B8R0.9 C#CC(C)CNC(C)=O HR123193 [0,1,0,0,0,1|0,0,1]=3 743 B8R0.9 CC(=O)OCC(O)CO HR119576 [0,1,0,0,0,1|1,0,0]=3 744 B8R0.9 CC(C)COC(=S)S[K] HR139550 [0,1,0,0,0,1|1,1,0]=4 745 B8R0.9 CC(C)COC(=S)S[Na] HR130537 [0,1,0,0,0,1|1,1,0]=4 746 B8R0.9 CC(O)COC(C)CO HR100186 [0,1,0,0,0,1|0,0,2]=4 747 B8R0.9 CCC(=O)CCC(C)=O HR121178 [0,1,0,0,0,1|1,0,1]=4 748 B8R0.9 CCC(C)CCC(C)N HR118585 [0,1,0,0,0,1|1,0,1]=4 749 B8R0.9 CCC(C)COC(=O)Cl HR143745 [0,1,0,0,0,1|1,0,0]=3 750 B8R0.9 CCC(C)COC(C)=O HR104042 [0,1,0,0,0,1|0,0,0]=2 751 B8R0.9 CCC(C)COC(C)=O HR112686 [0,1,0,0,0,1|0,0,0]=2 752 B8R0.9 COC(=O)CCC(C)O HR125584 [0,1,0,0,0,1|1,0,0]=3 753 B8R0.9 COC(=O)\C=C\N(C)C HR127150 [0,1,0,0,0,1|1,0,1]=4 754 B8R0.9 COC(C)COC(C)=O HR143173 [0,1,0,0,0,1|0,0,0]=2 755 B8R0.9 C\C(CCC(C)C)=N/O HR100835 [0,1,0,0,0,1|0,0,1]=3 756 B8R0.23 C=C(C)C(=O)NC(C)C HR105518 [0,1,0,0,0,1|1,0,1]=4 757 B8R0.23 C=C(CC(C)C)C(C)=O HR119288 [0,1,0,0,0,1|0,0,0]=2 758 B8R0.23 CC(=O)CC(=O)C(F)F HR110661 [0,1,0,0,0,1|2,0,0]=4 759 B8R0.23 CC(=O)CC(=O)N(C)C HR110905 [0,1,0,0,0,1|1,0,0]=3 760 B8R0.23 CC(=O)OC(C)C(C)=O HR135424 [0,1,0,0,0,1|1,0,1]=4 761 B8R0.23 CC(C)C(N)CC(=O)O HR115576 [0,1,0,0,0,1|1,0,0]=3 762 B8R0.23 CC(C)C(N)CC(=O)O HR119755 [0,1,0,0,0,1|1,0,0]=3 763 B8R0.23 CC(C)CC(=O)C(=O)O HR122104 [0,1,0,0,0,1|1,0,0]=3 764 B8R0.23 CC(C)CC(=O)C(=O)[O-] HR105375 [0,1,0,0,0,1|1,0,0]=3 765 B8R0.23 CC(C)CC(=O)C(=O)[O-] HR138461 [0,1,0,0,0,1|1,0,0]=3 766 B8R0.23 CC(C)CC(=O)C(=O)[O-] HR138724 [0,1,0,0,0,1|1,0,0]=3 767 B8R0.23 CC(C)CC(Br)C(=O)O HR148644 [0,1,0,0,0,1|1,0,0]=3 768 B8R0.23 CC(C)CC(Cl)C(=O)O HR103256 [0,1,0,0,0,1|1,0,0]=3 769 B8R0.23 CC(C)CC(N)C(=O)O HR120455 [0,1,0,0,0,1|1,0,0]=3 770 B8R0.23 CC(C)CC(N)C(=O)O HR133560 [0,1,0,0,0,1|1,0,0]=3 771 B8R0.23 CC(C)CC(N)C(=O)O HR134259 [0,1,0,0,0,1|1,0,0]=3 772 B8R0.23 CC(C)CC(N)C(=O)O TYJB00201 [0,1,0,0,0,1|1,0,0]=3 773 B8R0.23 CC(C)CC(N)C(N)=O HR116634 [0,1,0,0,0,1|1,0,0]=3 774 B8R0.23 CC(C)CC(O)C(=O)O HR104232 [0,1,0,0,0,1|1,0,0]=3 775 B8R0.23 CC(C)CC(O)C(=O)O HR121662 [0,1,0,0,0,1|1,0,0]=3 776 B8R0.23 CC(O)C(N)CC(=O)O HR146732 [0,1,0,0,0,1|2,0,0]=4 777 B8R0.23 CN(C)C(=O)CC(N)=O HR120955 [0,1,0,0,0,1|2,0,0]=4 778 B8R0.29 CC(=O)C#C[Si](C)(C)C HR112263 [0,1,0,0,0,1|0,1,1]=4 779 B8R0.29 CC(C)(C)CCC(=O)Cl HR140153 [0,1,0,0,0,1|1,0,0]=3 780 B8R0.29 CC(C)(C)NCC(=O)Cl HR111711 [0,1,0,0,0,1|1,0,0]=3 781 B8R0.29 CC(C)(C)NCC(=O)O HR107503 [0,1,0,0,0,1|1,0,0]=3 782 B8R0.29 CC(C)(C)NCC(=O)O HR143867 [0,1,0,0,0,1|1,0,0]=3 783 B8R0.29 CC(C)(C)OCC(=O)O HR143671 [0,1,0,0,0,1|1,0,0]=3 784 B8R0.29 CC(C)COS(C)(=O)=O HR142226 [0,1,0,0,0,1|1,0,0]=3 785 B8R0.29 CC(O)COC(C)(C)C HR145156 [0,1,0,0,0,1|0,0,2]=4 786 B8R0.29 C[Si](C)(C)CCC(=O)O HR106616 [0,1,0,0,0,1|1,1,0]=4 787 B8R0.2 CCC(C)C(=O)C(=O)O HR136223 [0,2,0,0,0,0|1,0,1]=4 788 B8R0.2 CCC(C)C(=O)C(=O)[O-] HR105983 [0,2,0,0,0,0|1,0,1]=4 789 B8R0.2 CCC(C)C(Cl)C(=O)O HR103573 [0,2,0,0,0,0|1,0,0]=3 790 B8R0.2 CCC(C)C(N)C(=O)O HR122107 [0,2,0,0,0,0|1,0,0]=3 791 B8R0.2 CCC(C)C(N)C(=O)O HR126392 [0,2,0,0,0,0|1,0,0]=3 792 B8R0.2 CCC(C)C(N)C(=O)O HR126596 [0,2,0,0,0,0|1,0,0]=3 793 B8R0.2 CCC(C)C(N)C(=O)O HR129264 [0,2,0,0,0,0|1,0,0]=3 794 B8R0.2 CCC(C)C(N)C(=O)O HR134488 [0,2,0,0,0,0|1,0,0]=3 795 B8R0.2 CCC(C)C(N)C(N)=O HR114403 [0,2,0,0,0,0|1,0,0]=3 796 B8R0.2 COC(=O)C(=O)C(C)C HR104464 [0,2,0,0,0,0|0,0,1]=3 797 B8R0.2 COC(=O)C(Br)C(C)C HR135904 [0,2,0,0,0,0|0,0,0]=2 798 B8R0.2 COC(=O)C(Cl)C(C)=O HR139855 [0,2,0,0,0,0|1,0,1]=4 799 B8R0.2 COC(=O)C(N)C(C)=O HR121027 [0,2,0,0,0,0|1,0,1]=4 800 B8R0.2 COC(=O)C(N)C(C)C HR127472 [0,2,0,0,0,0|0,0,0]=2 801 B8R0.2 COC(=O)C(N)C(C)C HR129213 [0,2,0,0,0,0|0,0,0]=2 802 B8R0.2 COC(=O)C(N)C(C)C HR146735 [0,2,0,0,0,0|0,0,0]=2 803 B8R0.2 COC(=O)C(N)C(C)O HR116385 [0,2,0,0,0,0|1,0,0]=3 804 B8R0.2 COC(=O)C(N)C(C)O HR117464 [0,2,0,0,0,0|1,0,0]=3 805 B8R0.2 COC(=O)C(N)C(C)O HR134650 [0,2,0,0,0,0|1,0,0]=3 806 B8R0.2 COC(=O)C(N)C(C)O HR146545 [0,2,0,0,0,0|1,0,0]=3 807 B8R0.2 COC(=O)C(O)C(C)C HR115315 [0,2,0,0,0,0|0,0,0]=2 808 B8R0.2 COC(=O)C(O)C(C)C HR115628 [0,2,0,0,0,0|0,0,0]=2 809 B8R0.2 COC(C)C(N)C(=O)O HR109877 [0,2,0,0,0,0|1,0,0]=3 810 B8R0.2 COC(C)C(N)C(=O)O HR143103 [0,2,0,0,0,0|1,0,0]=3 811 B8R0.2 O=C(O)C(O)C(O)CO HR18483 [0,2,0,0,0,0|2,0,0]=4 812 B8R0.2 O=C([O-])C(O)C(O)CO HR106059 [0,2,0,0,0,0|2,0,0]=4 813 B8R0.2 O=C([O-])C(O)C(O)CO HR124090 [0,2,0,0,0,0|2,0,0]=4 814 B8R0.5 C#CCC(N)CC(=O)O HR107806 [0,2,0,0,0,0|2,0,0]=4 815 B8R0.5 C#CCC(N)CC(=O)O HR108120 [0,2,0,0,0,0|2,0,0]=4 816 B8R0.5 CC(C)OC(=O)CC#N HR136578 [0,2,0,0,0,0|1,0,0]=3 817 B8R0.5 CC(C)OC(=O)CCS HR117191 [0,2,0,0,0,0|1,0,0]=3 818 B8R0.5 CC(C)OC(=O)OCCl HR138445 [0,2,0,0,0,0|1,0,0]=3 819 B8R0.5 CC(C)OC(=O)\C=C\I SESA05104 [0,2,0,0,0,0|1,0,1]=4 820 B8R0.5 CCNC(=S)OC(C)C HR109488 [0,2,0,0,0,0|1,1,0]=4 821 B8R0.5 CCOC(=O)C=C(C)C HR123584 [0,2,0,0,0,0|0,0,2]=4 822 B8R0.5 CCOC(=O)CC(C)=O BRSA08315 [0,2,0,0,0,0|1,0,1]=4 823 B8R0.5 CCOC(=O)CC(C)=O HR134952 [0,2,0,0,0,0|1,0,1]=4 824 B8R0.5 CCOC(=O)CC(C)O HR103958 [0,2,0,0,0,0|1,0,0]=3 825 B8R0.5 CCOC(=O)CC(C)O HR115663 [0,2,0,0,0,0|1,0,0]=3 826 B8R0.5 CCOC(=O)CC(C)O HR126277 [0,2,0,0,0,0|1,0,0]=3 827 B8R0.5 CCOC(=O)CC(C)S HR114517 [0,2,0,0,0,0|1,0,0]=3 828 B8R0.5 CCOC(=O)CN(C)C HR135000 [0,2,0,0,0,0|1,0,0]=3 829 B8R0.5 CCOC(=O)OC(C)Cl HR127687 [0,2,0,0,0,0|2,0,0]=4 830 B8R0.5 CCOC(=O)OC(C)I HR138111 [0,2,0,0,0,0|2,0,0]=4 831 B8R0.5 CCOC(C)OC(C)=O HR121743 [0,2,0,0,0,0|1,0,0]=3 832 B8R0.5 COCC(=O)CC(C)=O HR134533 [0,2,0,0,0,0|1,0,1]=4 833 B8R0.5 COCC(C)OC(C)=O HR138591 [0,2,0,0,0,0|1,0,0]=3 834 B8R0.16 COC(CC(C)=O)OC HR122907 [0,2,0,0,0,0|0,0,0]=2 835 B8R0.16 COC(CN(C)C)OC HR126558 [0,2,0,0,0,0|2,0,0]=4 836 B8R0.16 COC(C[N+](=O)[O-])OC HR130105 [0,2,0,0,0,0|2,0,0]=4 837 B8R0.16 CO\C(C=O)=C/N(C)C HR106210 [0,2,0,0,0,0|1,0,1]=4 838 B8R0.19 CCC(=O)CC(=O)CC HR138277 [0,2,0,0,0,0|1,0,1]=4 839 B8R0.19 CCC(=O)CC(=O)OC HR126248 [0,2,0,0,0,0|1,0,1]=4 840 B8R0.19 CCC(C)CC(O)CC HR124313 [0,2,0,0,0,0|0,0,2]=4 841 B8R0.19 CCC(O)CC(=O)OC HR111480 [0,2,0,0,0,0|1,0,0]=3 842 B8R0.19 CN\C(C)=C\C(=O)OC HR106272 [0,2,0,0,0,0|0,0,2]=4 843 B8R0.19 COC(=O)CC(=O)CCl HR131628 [0,2,0,0,0,0|1,0,1]=4 844 B8R0.19 COC(=O)CC(=O)OC HR129679 [0,2,0,0,0,0|1,0,1]=4 845 B8R0.19 COC(=O)CC(O)CCl HR103451 [0,2,0,0,0,0|1,0,0]=3 846 B8R0.19 COC(=O)CC(O)CCl HR106667 [0,2,0,0,0,0|1,0,0]=3 847 B8R0.19 COC(=O)CC(O)CCl HR123616 [0,2,0,0,0,0|1,0,0]=3 848 B8R0.19 COC(=O)NC(C)CN ENSA06712 [0,2,0,0,0,0|1,0,0]=3 849 B8R0.24 C#CC(=O)OC(C)(C)C HR138337 [0,2,0,0,0,0|1,0,1]=4 850 B8R0.24 C=CC(=O)NC(C)(C)C HR142743 [0,2,0,0,0,0|1,0,1]=4 851 B8R0.24 CC(C)(C)OC(=O)CBr REJL01706 [0,2,0,0,0,0|1,0,0]=3 852 B8R0.24 CC(C)(C)OC(=O)CN HR122571 [0,2,0,0,0,0|1,0,0]=3 853 B8R0.24 CC(C)(C)OC(=O)CO HR113961 [0,2,0,0,0,0|1,0,0]=3 854 B8R0.24 CC(C)(C)OC(=O)NN ALSA02102 [0,2,0,0,0,0|2,0,0]=4 855 B8R0.24 CC(C)(C)OC(=O)NO HR134020 [0,2,0,0,0,0|2,0,0]=4 856 B8R0.24 CC(CP)CC(C)(C)C HR139123 [0,2,0,0,0,0|1,0,1]=4 857 B8R0.24 CCC(C)CS(=O)(=O)[O-] HR116952 [0,2,0,0,0,0|2,0,0]=4 858 B8R0.24 COC(=O)CS(C)(=O)=O HR114466 [0,2,0,0,0,0|2,0,0]=4 859 B8R0.24 COC(=O)N[Si](C)(C)C HR116405 [0,2,0,0,0,0|1,1,0]=4 860 B8R0.24 C[N+](C)(C)CC(=O)NN HR127892 [0,2,0,0,0,0|2,0,0]=4 861 B8R0.24 C[Si](C)(C)OC(=O)CBr HR100437 [0,2,0,0,0,0|1,1,0]=4 862 B8R0.34 C#CC(C)(O)CC(C)C HR134308 [0,2,0,0,0,0|0,0,2]=4 863 B8R0.34 CSC(C)(C)CC(C)=O HR124751 [0,2,0,0,0,0|0,0,0]=2 864 B8R0.27 CC(C)(C)C(=O)C(=O)O HR138192 [0,2,0,0,0,0|1,0,1]=4 865 B8R0.27 CC(C)(C)C(N)C(=O)O HR122176 [0,2,0,0,0,0|1,0,0]=3 866 B8R0.27 CC(C)(C)C(N)C(=O)O HR122428 [0,2,0,0,0,0|1,0,0]=3 867 B8R0.27 CC(C)(C)C(N)C(=O)O HR128603 [0,2,0,0,0,0|1,0,0]=3 868 B8R0.27 CC(C)(C)C(N)C(=O)O HR142898 [0,2,0,0,0,0|1,0,0]=3 869 B8R0.27 CC(C)(C)C(N)C(N)=O HR113541 [0,2,0,0,0,0|1,0,0]=3 870 B8R0.27 CC(C)(F)C(N)C(=O)O HR145132 [0,2,0,0,0,0|1,0,0]=3 871 B8R0.27 CC(C)(O)C(N)C(=O)O HR118044 [0,2,0,0,0,0|1,0,0]=3 872 B8R0.27 CC(C)(S)C(N)C(=O)O HR128482 [0,2,0,0,0,0|1,0,0]=3 873 B8R0.33 CC(C)(C)CC(C)(C)S HR139350 [0,2,0,0,0,0|0,1,1]=4 874 B8R0.33 CC(C)(N)CS(=O)(=O)O AUSA03814 [0,2,0,0,0,0|2,0,0]=4 875 B8R0.18 CC(C)C(CN)C(=O)O HR100533 [0,2,0,0,0,0|1,0,0]=3 876 B8R0.18 CNC(C(=O)O)C(C)C HR116560 [0,2,0,0,0,0|1,0,0]=3 877 B8R0.18 CNC(C(=O)O)C(C)O HR116881 [0,2,0,0,0,0|2,0,0]=4 878 B8R0.37 CC(C)C(C)(N)C(=O)O HR100972 [0,2,0,0,0,0|1,0,0]=3 879 B8R0.37 CC(C)C(C)(N)C(=O)O HR142699 [0,2,0,0,0,0|1,0,0]=3 880 B8R0.37 CC(C)C(C)(N)C(=O)O HR142798 [0,2,0,0,0,0|1,0,0]=3 881 B8R0.37 CC(C)C(C)(N)C(N)=O HR146757 [0,2,0,0,0,0|1,0,0]=3 882 B8R0.37 [2H]C(N)(C(=O)O)C(C)C HR139038 [0,2,0,0,0,0|1,0,0]=3 883 B6R1.2 BrC1CCCC1 HR146931 [1,0,0,1,0,0|1,0,1]=4 884 B6R1.2 BrC1CCOC1 HR32206 [1,0,0,1,0,0|2,0,0]=4 885 B6R1.2 CC1=NCCC1 HR128050 [1,0,0,1,0,0|1,0,0]=3 886 B6R1.2 CC1=NCCS1 HR124488 [1,0,0,1,0,0|1,1,0]=4 887 B6R1.2 CC1CCCN1 HR11117 [1,0,0,1,0,0|1,0,1]=4 888 B6R1.2 CC1CCCN1 HR136768 [1,0,0,1,0,0|1,0,1]=4 889 B6R1.2 CC1CCCN1 HR137719 [1,0,0,1,0,0|1,0,1]=4 890 B6R1.2 CC1CCCN1 HR137972 [1,0,0,1,0,0|1,0,1]=4 891 B6R1.2 CC1CCCN1 HR138237 [1,0,0,1,0,0|1,0,1]=4 892 B6R1.2 CC1CCCO1 HR10841 [1,0,0,1,0,0|0,0,2]=4 893 B6R1.2 CC1CCNC1 HR117788 [1,0,0,1,0,0|1,0,0]=3 894 B6R1.2 CC1CCNC1 HR121513 [1,0,0,1,0,0|1,0,0]=3 895 B6R1.2 CC1CCNC1 HR142801 [1,0,0,1,0,0|1,0,0]=3 896 B6R1.2 CC1CCNC1 HR142900 [1,0,0,1,0,0|1,0,0]=3 897 B6R1.2 CC1CCNC1 HR143674 [1,0,0,1,0,0|1,0,0]=3 898 B6R1.2 CC1CCOC1 HR144126 [1,0,0,1,0,0|1,0,0]=3 899 B6R1.2 CC1CCSC1 HR124140 [1,0,0,1,0,0|1,0,0]=3 900 B6R1.2 CC1COCO1 HR124771 [1,0,0,1,0,0|2,0,0]=4 901 B6R1.2 CN1CCCC1 HR130486 [1,0,0,1,0,0|1,0,1]=4 902 B6R1.2 ClC1=CCCC1 HR140861 [1,0,0,1,0,0|1,0,1]=4 903 B6R1.2 ClC1CCCC1 HR100908 [1,0,0,1,0,0|1,0,1]=4 904 B6R1.2 ClC1CCOC1 HR146389 [1,0,0,1,0,0|2,0,0]=4 905 B6R1.2 FC1CCNC1 HR108608 [1,0,0,1,0,0|2,0,0]=4 906 B6R1.2 FC1CCNC1 HR111906 [1,0,0,1,0,0|2,0,0]=4 907 B6R1.2 FC1CCNC1 HR113706 [1,0,0,1,0,0|2,0,0]=4 908 B6R1.2 FC1CCNC1 HR148267 [1,0,0,1,0,0|2,0,0]=4 909 B6R1.2 IC1CCOC1 HR121544 [1,0,0,1,0,0|2,0,0]=4 910 B6R1.2 NC1=NCCC1 HR112379 [1,0,0,1,0,0|2,0,0]=4 911 B6R1.2 NC1=NCCC1 HR112697 [1,0,0,1,0,0|2,0,0]=4 912 B6R1.2 NC1CC=CC1 HR106458 [1,0,0,1,0,0|1,0,1]=4 913 B6R1.2 NC1CCCC1 TRXM00901 [1,0,0,1,0,0|1,0,1]=4 914 B6R1.2 NC1CCNC1 HR122368 [1,0,0,1,0,0|2,0,0]=4 915 B6R1.2 NC1CCNC1 HR122634 [1,0,0,1,0,0|2,0,0]=4 916 B6R1.2 NC1CCNC1 HR123574 [1,0,0,1,0,0|2,0,0]=4 917 B6R1.2 NC1CCNC1 HR123838 [1,0,0,1,0,0|2,0,0]=4 918 B6R1.2 NC1CCNC1 HR136682 [1,0,0,1,0,0|2,0,0]=4 919 B6R1.2 NC1CCNC1 HR136939 [1,0,0,1,0,0|2,0,0]=4 920 B6R1.2 NC1CCOC1 HR110868 [1,0,0,1,0,0|2,0,0]=4 921 B6R1.2 NC1CCOC1 HR119912 [1,0,0,1,0,0|2,0,0]=4 922 B6R1.2 NC1CCOC1 HR145986 [1,0,0,1,0,0|2,0,0]=4 923 B6R1.2 NC1CCOC1 HR15126 [1,0,0,1,0,0|2,0,0]=4 924 B6R1.2 NC1CCOC1 HR15496 [1,0,0,1,0,0|2,0,0]=4 925 B6R1.2 NC1CCOC1 HR33445 [1,0,0,1,0,0|2,0,0]=4 926 B6R1.2 NC1CCOC1 HR33446 [1,0,0,1,0,0|2,0,0]=4 927 B6R1.2 NN1CCCC1 HR127037 [1,0,0,1,0,0|2,0,0]=4 928 B6R1.2 NN1CCCC1 HR4032 [1,0,0,1,0,0|2,0,0]=4 929 B6R1.2 O=C1C=CCC1 HR136753 [1,0,0,1,0,0|0,0,2]=4 930 B6R1.2 O=C1CC=CC1 HR111189 [1,0,0,1,0,0|0,0,2]=4 931 B6R1.2 O=C1CCCC1 HR147576 [1,0,0,1,0,0|0,0,0]=2 932 B6R1.2 O=C1CCCN1 HR144424 [1,0,0,1,0,0|1,0,0]=3 933 B6R1.2 O=C1CCCN1 HR147307 [1,0,0,1,0,0|1,0,0]=3 934 B6R1.2 O=C1CCNC1 HR126926 [1,0,0,1,0,0|1,0,0]=3 935 B6R1.2 O=C1CCNC1 HR127189 [1,0,0,1,0,0|1,0,0]=3 936 B6R1.2 O=C1CCNN1 HR146471 [1,0,0,1,0,0|2,0,0]=4 937 B6R1.2 O=C1CCOC1 HR109194 [1,0,0,1,0,0|1,0,0]=3 938 B6R1.2 O=C1CCSC1 HR5575 [1,0,0,1,0,0|1,0,0]=3 939 B6R1.2 O=C1CNCN1 HR114619 [1,0,0,1,0,0|2,0,0]=4 940 B6R1.2 O=C1NCCN1 HR124833 [1,0,0,1,0,0|2,0,0]=4 941 B6R1.2 O=C1NCCN1 HR138382 [1,0,0,1,0,0|2,0,0]=4 942 B6R1.2 O=C1NCCO1 HR134554 [1,0,0,1,0,0|2,0,0]=4 943 B6R1.2 O=C1NCCS1 HR14582 [1,0,0,1,0,0|2,0,0]=4 944 B6R1.2 O=C1OCCO1 APSA06102 [1,0,0,1,0,0|2,0,0]=4 945 B6R1.2 OC1CC=CC1 HR30107 [1,0,0,1,0,0|1,0,1]=4 946 B6R1.2 OC1CCNC1 HR122348 [1,0,0,1,0,0|2,0,0]=4 947 B6R1.2 OC1CCNC1 HR128986 [1,0,0,1,0,0|2,0,0]=4 948 B6R1.2 OC1CCNC1 HR135087 [1,0,0,1,0,0|2,0,0]=4 949 B6R1.2 OC1CCNC1 HR137212 [1,0,0,1,0,0|2,0,0]=4 950 B6R1.2 OC1CCNC1 HR137477 [1,0,0,1,0,0|2,0,0]=4 951 B6R1.2 OC1CCNC1 HR138968 [1,0,0,1,0,0|2,0,0]=4 952 B6R1.2 OC1CCOC1 HR133245 [1,0,0,1,0,0|2,0,0]=4 953 B6R1.2 OC1CCOC1 HR137216 [1,0,0,1,0,0|2,0,0]=4 954 B6R1.2 OC1CCOC1 HR16209 [1,0,0,1,0,0|2,0,0]=4 955 B6R1.2 OC1CCOC1 HR7071 [1,0,0,1,0,0|2,0,0]=4 956 B6R1.2 OC1CCSC1 HR122102 [1,0,0,1,0,0|2,0,0]=4 957 B6R1.2 SC1CCCC1 HR134369 [1,0,0,1,0,0|0,1,1]=4 958 B6R1.3 CCCC1CO1 HR102110 [1,0,0,1,0,0|0,0,2]=4 959 B6R1.3 COCC1CO1 HR136178 [1,0,0,1,0,0|2,0,0]=4 960 B6R1.3 COCC1CO1 HR5856 [1,0,0,1,0,0|2,0,0]=4 961 B6R1.3 N#CCC1CC1 HR136488 [1,0,0,1,0,0|1,0,1]=4 962 B6R1.3 NOCC1CC1 HR137251 [1,0,0,1,0,0|2,0,0]=4 963 B6R1.3 O=C=NC1CC1 HR109751 [1,0,0,1,0,0|1,0,1]=4 964 B6R1.3 O=CCC1CC1 HR139135 [1,0,0,1,0,0|0,0,0]=2 965 B6R1.3 OCCC1CC1 HR144840 [1,0,0,1,0,0|0,0,2]=4 966 B6R1.5 CC1CC(=O)C1 HR121137 [1,0,0,1,0,0|0,0,0]=2 967 B6R1.5 CC1CC(N)C1 HR108536 [1,0,0,1,0,0|1,0,1]=4 968 B6R1.5 NC1CC(=O)C1 HR145979 [1,0,0,1,0,0|1,0,0]=3 969 B6R1.5 O=C1CC(Br)C1 HR120509 [1,0,0,1,0,0|1,0,0]=3 970 B6R1.5 O=C1CC(O)C1 HR119245 [1,0,0,1,0,0|1,0,0]=3 971 B6R1.10 CC1(C)COC1 HR102392 [1,0,0,1,0,0|1,0,0]=3 972 B6R1.10 CC1(N)COC1 HR120021 [1,0,0,1,0,0|2,0,0]=4 973 B6R1.11 C=C(C)C1CO1 HR139225 [1,0,0,1,0,0|2,0,0]=4 974 B6R1.11 CC(=O)C1CC1 HR134464 [1,0,0,1,0,0|0,0,0]=2 975 B6R1.11 CC(C)C1CO1 HR145858 [1,0,0,1,0,0|1,0,0]=3 976 B6R1.11 CC(C)C1CO1 HR145875 [1,0,0,1,0,0|1,0,0]=3 977 B6R1.11 CC(C)C1CO1 HR145876 [1,0,0,1,0,0|1,0,0]=3 978 B6R1.11 CC(N)C1CC1 HR146098 [1,0,0,1,0,0|1,0,1]=4 979 B6R1.11 CC(O)C1CC1 HR101733 [1,0,0,1,0,0|0,0,2]=4 980 B6R1.11 N=C(N)C1CC1 HR137003 [1,0,0,1,0,0|2,0,0]=4 981 B6R1.11 NC(=O)C1CC1 HR21401 [1,0,0,1,0,0|1,0,0]=3 982 B6R1.11 O=C(Cl)C1CC1 FISA07805 [1,0,0,1,0,0|1,0,0]=3 983 B6R1.11 O=C(O)C1CC1 HR133116 [1,0,0,1,0,0|1,0,0]=3 984 B6R1.11 O=S([O-])C1CC1 HR105027 [1,0,0,1,0,0|2,0,0]=4 985 B8R1.3 C=C1CCN(C)CC1 HR107962 [0,0,0,1,0,1|2,0,0]=4 986 B8R1.3 CC1=CCC(=O)CC1 HR105835 [0,0,0,1,0,1|0,0,1]=3 987 B8R1.3 CC1=NNC(=O)CC1 HR117768 [0,0,0,1,0,1|1,0,1]=4 988 B8R1.3 CC1CCC(=O)CC1 HR123899 [0,0,0,1,0,1|0,0,0]=2 989 B8R1.3 CC1CCC(C)NC1 HR149823 [0,0,0,1,0,1|1,0,1]=4 990 B8R1.3 CC1CCC(N)CC1 HR127535 [0,0,0,1,0,1|1,0,1]=4 991 B8R1.3 CC1CCC(N)CC1 HR129524 [0,0,0,1,0,1|1,0,1]=4 992 B8R1.3 CC1CCC(O)CC1 HR102432 [0,0,0,1,0,1|0,0,2]=4 993 B8R1.3 CC1CCC(O)CC1 HR142762 [0,0,0,1,0,1|0,0,2]=4 994 B8R1.3 CC1CNC(=O)CO1 HR148882 [0,0,0,1,0,1|1,0,0]=3 995 B8R1.3 CC1CNC(C)CN1 HR112989 [0,0,0,1,0,1|1,0,1]=4 996 B8R1.3 CC1CNC(C)CN1 HR113905 [0,0,0,1,0,1|1,0,1]=4 997 B8R1.3 CC1CNC(C)CN1 HR123674 [0,0,0,1,0,1|1,0,1]=4 998 B8R1.3 CC1COC(C)CN1 HR146120 [0,0,0,1,0,1|0,0,2]=4 999 B8R1.3 CC1COC(C)CN1 HR146121 [0,0,0,1,0,1|0,0,2]=4 1000 B8R1.3 CN1CCC(=O)CC1 HR128468 [0,0,0,1,0,1|1,0,0]=3 1001 B8R1.3 NC1CCC(=O)CC1 HR108450 [0,0,0,1,0,1|1,0,0]=3 1002 B8R1.3 NC1CCC(=O)NC1 HR114241 [0,0,0,1,0,1|1,0,0]=3 1003 B8R1.3 O=C1CCC(=O)CC1 HR123033 [0,0,0,1,0,1|1,0,1]=4 1004 B8R1.3 O=C1CCC(=O)NC1 HR110594 [0,0,0,1,0,1|1,0,1]=4 1005 B8R1.3 O=C1CCC(O)CC1 HR132671 [0,0,0,1,0,1|1,0,0]=3 1006 B8R1.3 O=C1CCC(O)CN1 HR104378 [0,0,0,1,0,1|1,0,0]=3 1007 B8R1.23 CC(=O)N1CC(O)C1 HR102223 [0,0,0,1,0,1|1,0,0]=3 1008 B8R1.23 CC(C)N1CC(O)C1 HR110897 [0,0,0,1,0,1|0,0,2]=4 1009 B8R1.23 CC1CC(C(=O)O)C1 HR111453 [0,0,0,1,0,1|1,0,0]=3 1010 B8R1.23 CN1CC(C(=O)O)C1 HR148501 [0,0,0,1,0,1|2,0,0]=4 1011 B8R1.23 NC1CC(C(=O)O)C1 HR109482 [0,0,0,1,0,1|2,0,0]=4 1012 B8R1.23 NC1CC(C(=O)O)C1 HR146903 [0,0,0,1,0,1|2,0,0]=4 1013 B8R1.23 O=C(O)C1CC(F)C1 HR107590 [0,0,0,1,0,1|2,0,0]=4 1014 B8R1.23 O=C(O)C1CC(O)C1 HR139037 [0,0,0,1,0,1|2,0,0]=4 1015 B8R1.23 O=C(O)C1CC(O)C1 HR148529 [0,0,0,1,0,1|2,0,0]=4 1016 B8R1.35 O=C(O)CCC1CC1 HR105458 [0,0,0,1,0,1|1,0,0]=3 1017 B8R1.51 CC1(C)CCC(=O)N1 HR104854 [0,0,0,1,0,1|1,0,0]=3 1018 B8R1.51 CC1(C)CNC(=O)C1 HR121474 [0,0,0,1,0,1|0,0,0]=2 1019 B8R1.51 CC1(C)CNC(=O)N1 HR33167 [0,0,0,1,0,1|1,0,0]=3 1020 B8R1.51 CC1=NC(C)(C)CO1 HR139753 [0,0,0,1,0,1|1,0,0]=3 1021 B8R1.77 CC1(C)CC1C(=O)O HR125256 [0,0,0,1,0,1|1,0,0]=3 1022 B8R1.77 CC1(C)CC1C(=O)O HR138282 [0,0,0,1,0,1|1,0,0]=3 1023 B8R1.77 CC1(C)CC1C(N)=O HR124986 [0,0,0,1,0,1|1,0,0]=3 1024 B8R1.1 C=CC1CCC(=O)N1 HR117010 [0,1,0,1,0,0|1,0,1]=4 1025 B8R1.1 C=CC1CCC(=O)O1 HR127408 [0,1,0,1,0,0|1,0,1]=4 1026 B8R1.1 CCC1CCC(=O)O1 HR137195 [0,1,0,1,0,0|1,0,0]=3 1027 B8R1.1 CCN1CCC(=O)C1 HR113880 [0,1,0,1,0,0|1,0,0]=3 1028 B8R1.1 CN1CCC(CN)C1 HR131003 [0,1,0,1,0,0|2,0,0]=4 1029 B8R1.1 CN1CCC(CO)C1 HR119306 [0,1,0,1,0,0|2,0,0]=4 1030 B8R1.1 O=C1CCC(CBr)N1 HR147112 [0,1,0,1,0,0|1,0,0]=3 1031 B8R1.1 O=C1CCC(CO)N1 HR107754 [0,1,0,1,0,0|1,0,0]=3 1032 B8R1.1 O=C1CCC(CO)N1 HR126441 [0,1,0,1,0,0|1,0,0]=3 1033 B8R1.1 O=C1CCC(CO)N1 HR130096 [0,1,0,1,0,0|1,0,0]=3 1034 B8R1.1 O=C1CCC(CO)O1 HR113766 [0,1,0,1,0,0|1,0,0]=3 1035 B8R1.1 O=C1CCC(CO)O1 HR145842 [0,1,0,1,0,0|1,0,0]=3 1036 B8R1.1 O=C1CCC(CO)O1 HR145872 [0,1,0,1,0,0|1,0,0]=3 1037 B8R1.1 O=C1NC(CI)CO1 HR146345 [0,1,0,1,0,0|2,0,0]=4 1038 B8R1.1 O=C1NCC(CCl)O1 HR101243 [0,1,0,1,0,0|2,0,0]=4 1039 B8R1.1 O=C1NCC(CCl)O1 HR105324 [0,1,0,1,0,0|2,0,0]=4 1040 B8R1.1 O=C1OCC(CO)O1 HR107356 [0,1,0,1,0,0|2,0,0]=4 1041 B8R1.4 CC1=CC(=O)CCC1 HR142178 [0,1,0,1,0,0|0,0,2]=4 1042 B8R1.4 CC1CC(=O)CCN1 HR120677 [0,1,0,1,0,0|0,0,0]=2 1043 B8R1.4 CC1CC(=O)CCN1 HR140081 [0,1,0,1,0,0|0,0,0]=2 1044 B8R1.4 CC1CC(O)CCO1 HR120725 [0,1,0,1,0,0|0,0,2]=4 1045 B8R1.4 CC1CC(O)CCO1 HR121039 [0,1,0,1,0,0|0,0,2]=4 1046 B8R1.4 CC1CCCC(=O)C1 HR143817 [0,1,0,1,0,0|0,0,0]=2 1047 B8R1.4 CC1CCCC(C)C1 HR101015 [0,1,0,1,0,0|1,0,1]=4 1048 B8R1.4 CC1CCCC(N)C1 HR115864 [0,1,0,1,0,0|1,0,1]=4 1049 B8R1.4 CC1CCNC(C)C1 HR147221 [0,1,0,1,0,0|1,0,1]=4 1050 B8R1.4 CC1CNCC(C)C1 HR135144 [0,1,0,1,0,0|1,0,1]=4 1051 B8R1.4 CN1CCC=C(Br)C1 HR149222 [0,1,0,1,0,0|2,0,0]=4 1052 B8R1.4 CN1CCCC(=O)C1 HR120165 [0,1,0,1,0,0|1,0,0]=3 1053 B8R1.4 CN1CCNC(=O)C1 HR119613 [0,1,0,1,0,0|1,0,0]=3 1054 B8R1.4 NC1CCNC(=O)C1 HR107374 [0,1,0,1,0,0|1,0,0]=3 1055 B8R1.4 NC1CCNC(=O)C1 HR113606 [0,1,0,1,0,0|1,0,0]=3 1056 B8R1.4 O=C1CC(O)CCN1 HR110819 [0,1,0,1,0,0|1,0,0]=3 1057 B8R1.4 O=C1CCCC(=O)C1 HR129932 [0,1,0,1,0,0|1,0,1]=4 1058 B8R1.4 O=C1CCNC(=O)C1 HR127778 [0,1,0,1,0,0|1,0,1]=4 1059 B8R1.4 O=C1COCC(=O)C1 HR103955 [0,1,0,1,0,0|1,0,1]=4 1060 B8R1.18 CC1CC(=O)N(C)C1 HR102594 [0,1,0,1,0,0|0,0,0]=2 1061 B8R1.34 O=C(O)CC1CCC1 HR133624 [0,1,0,1,0,0|1,0,0]=3 1062 B8R1.34 O=C(O)CC1COC1 HR145748 [0,1,0,1,0,0|1,0,0]=3 1063 B8R1.40 NCC(=O)NC1CC1 HR145980 [0,1,0,1,0,0|1,0,0]=3 1064 B8R1.50 CC1=C(O)C(=O)CC1 HR129501 [0,1,0,1,0,0|0,0,2]=4 1065 B8R1.50 CC1C(=O)CCC1=O HR137820 [0,1,0,1,0,0|1,0,1]=4 1066 B8R1.50 CC1CCC(=O)C1=O HR129446 [0,1,0,1,0,0|0,0,1]=3 1067 B8R1.50 CC1CCC(=O)N1C HR142184 [0,1,0,1,0,0|1,0,0]=3 1068 B8R1.50 O=C1OCC(O)C1O HR120212 [0,1,0,1,0,0|2,0,0]=4 1069 B8R1.54 NC(C(=O)O)C1CC1 HR125656 [0,1,0,1,0,0|1,0,0]=3 1070 B8R1.54 NC(C(=O)O)C1CC1 HR126714 [0,1,0,1,0,0|1,0,0]=3 1071 B8R2.18 OC1CC2CC2C1 HR145840 [0,0,0,2,0,0|0,0,2]=4 1072 B8R2.34 C1CC2CC1CN2 HR105019 [0,0,0,2,0,0|1,0,1]=4 1073 B8R2.34 C1CC2CC1CN2 HR120772 [0,0,0,2,0,0|1,0,1]=4 1074 B8R0.28 CC(=O)CCC=C(C)C HR127537 [0,0,0,0,0,2|0,0,1]=3 1075 B8R0.28 CC(=O)CCCC(C)C HR145408 [0,0,0,0,0,2|0,0,0]=2 1076 B8R0.28 CC(=O)OCC=C(C)C HR128839 [0,0,0,0,0,2|0,0,1]=3 1077 B8R0.28 CC(=O)\C=C\C=C(C)C HR115321 [0,0,0,0,0,2|0,0,2]=4 1078 B8R0.28 CC(C)CCCC(C)N HR128847 [0,0,0,0,0,2|1,0,1]=4 1079 B8R0.28 CC(C)CCOC(=O)Cl HR143844 [0,0,0,0,0,2|1,0,0]=3 1080 B8R0.28 CC(C)C[AlH4]CC(C)C HR129091 [0,0,0,0,0,2|1,0,1]=4 1081 B8R0.28 CN(C)CCCC(=O)O HR125161 [0,0,0,0,0,2|2,0,0]=4 1082 B8R0.28 CN(C)C\C=C\C(=O)O HR112008 [0,0,0,0,0,2|2,0,0]=4 1083 B8R0.28 CN(C)C\C=C\C(=O)O HR138898 [0,0,0,0,0,2|2,0,0]=4