0 B8R0.28 C=C(C)CCCC(=O)O 2321-1-18 [0,0,0,0,0,0|2,0,2]=4 1 B8R0.28 CC(=O)CCCC(=O)O 2129-1-0X [0,0,0,0,0,0|3,0,1]=4 2 B8R0.28 CC(=O)CCCC(C)C 2117-1-0E [0,0,0,0,0,0|1,0,0]=1 3 B8R0.28 CC(=O)CCCN(C)C 4156-1-51 [0,0,0,0,0,0|2,0,0]=2 4 B8R0.28 CC(=O)CCOC(C)C 2117-1-0F [0,0,0,0,0,0|2,0,0]=2 5 B8R0.28 CC(=O)COCC(C)F 2117-3-1F [0,0,0,0,0,0|3,0,0]=3 6 B8R0.28 CC(=O)COCC(F)F 2117-3-1L [0,0,0,0,0,0|4,0,0]=4 7 B8R0.28 CC(=O)OCC=C(C)C 2323-1-0B [0,0,0,0,0,0|0,0,2]=2 8 B8R0.28 CC(=O)OCC=C(F)F 2324-3-97 [0,0,0,0,0,0|2,0,2]=4 9 B8R0.28 CC(=O)OCCN(C)C 4132-1-05 [0,0,0,0,0,0|1,0,0]=1 10 B8R0.28 CC(=O)OCOC(C)=O 2123-1-27 [0,0,0,0,0,0|2,0,1]=3 11 B8R0.28 CC(=O)\C=C\C=C(C)C 2317-1-09 [0,0,0,0,0,0|1,0,3]=4 12 B8R0.28 CC(C)CCCC(=O)O 2121-1-15 [0,0,0,0,0,0|2,0,0]=2 13 B8R0.28 CC(C)CCOC(=O)Cl 2116-5-27 [0,0,0,0,0,0|1,0,0]=1 14 B8R0.28 CC(C)CCO[N+](=O)[O-] 4254-1-03 [0,0,0,0,0,0|2,0,0]=2 15 B8R0.28 CC(C)CNCC(C)C 3133-5-09 [0,0,0,0,0,0|3,0,1]=4 16 B8R0.28 CC(C)COCC(C)C 2107-1-0D [0,0,0,0,0,0|3,0,1]=4 17 B8R0.28 CC(C)C[AlH4]CC(C)C 9113-1-01 [0,0,0,0,0,0|3,0,1]=4 18 B8R0.28 CN(C)C\C=C\C(=O)O 4358-5-32 [0,0,0,0,0,0|3,0,1]=4 19 B7R0.4 C=C(Br)CCCCC 1300-9-09 [1,0,0,0,0,0|2,0,1]=4 20 B7R0.4 C=C(C)CCCCC 1300-1-36 [1,0,0,0,0,0|2,0,0]=3 21 B7R0.4 C=C(Cl)CCCCC 1300-5-27 [1,0,0,0,0,0|2,0,1]=4 22 B7R0.4 C=CCCOC(C)=O 2323-1-1E [1,0,0,0,0,0|0,0,2]=3 23 B7R0.4 CC(=O)CCCC#N 4137-1-0V [1,0,0,0,0,0|2,0,1]=4 24 B7R0.4 CC(=O)CCCCCl 2117-5-05 [1,0,0,0,0,0|2,0,0]=3 25 B7R0.4 CC(=O)COCCBr 2117-9-07 [1,0,0,0,0,0|3,0,0]=4 26 B7R0.4 CC(=O)COCCCl 2117-5-0B [1,0,0,0,0,0|3,0,0]=4 27 B7R0.4 CC(=O)NCCCN 4148-5-0D [1,0,0,0,0,0|2,0,0]=3 28 B7R0.4 CC(=O)NCCCO 4156-1-Y9 [1,0,0,0,0,0|2,0,0]=3 29 B7R0.4 CC(=O)OCCCCl 2123-5-0U [1,0,0,0,0,0|1,0,0]=2 30 B7R0.4 CC(=O)OCCCF 2123-3-1D [1,0,0,0,0,0|1,0,0]=2 31 B7R0.4 CC(C)=CCOC=O 2323-1-28 [1,0,0,0,0,0|0,0,2]=3 32 B7R0.4 CC(C)OCCCCl 2107-5-0Y [1,0,0,0,0,0|2,0,1]=4 33 B7R0.4 CC(C)OCCCF 2107-3-6X [1,0,0,0,0,0|2,0,1]=4 34 B7R0.4 CCCCC=C(F)F 1300-3-97 [1,0,0,0,0,0|3,0,0]=4 35 B7R0.4 CCCCCC(C)=O 2117-1-14 [1,0,0,0,0,0|1,0,0]=2 36 B7R0.4 CCCCCC(C)N 3130-1-X7 [1,0,0,0,0,0|2,0,1]=4 37 B7R0.4 CCCCCC(C)O 2102-1-05 [1,0,0,0,0,0|1,0,2]=4 38 B7R0.4 CCCCCC(N)=O 4148-1-1F [1,0,0,0,0,0|2,0,0]=3 39 B7R0.4 CCCCOC(=O)Cl 2116-5-31 [1,0,0,0,0,0|1,0,0]=2 40 B7R0.4 CCCCOC(Cl)Cl 2107-5-12 [1,0,0,0,0,0|2,0,1]=4 41 B7R0.4 CCCCOC(N)=O 4156-1-2H [1,0,0,0,0,0|1,0,0]=2 42 B7R0.4 CCCCO[N+](=O)[O-] 4154-1-0C [1,0,0,0,0,0|2,0,0]=3 43 B7R0.4 CCCCSC(C)=O 6166-1-0F [1,0,0,0,0,0|0,1,0]=2 44 B7R0.4 CCCOCC(=O)O 2121-1-0F [1,0,0,0,0,0|3,0,0]=4 45 B7R0.4 CCC\C=C\C(C)=O 2317-1-0B [1,0,0,0,0,0|1,0,1]=3 46 B7R0.4 CCOCCC(=O)O 2121-1-0E [1,0,0,0,0,0|3,0,0]=4 47 B7R0.4 CNCCNC(C)C 3131-1-20 [1,0,0,0,0,0|3,0,0]=4 48 B7R0.4 COCCCC(=O)O 2121-1-51 [1,0,0,0,0,0|3,0,0]=4 49 B7R0.4 COCCCN(C)C 4156-1-53 [1,0,0,0,0,0|3,0,0]=4 50 B7R0.4 COCCNC(C)C 4156-1-3P [1,0,0,0,0,0|3,0,0]=4 51 B7R0.4 NCCCCC(=O)O 4157-1-22 [1,0,0,0,0,0|3,0,0]=4 52 B7R0.4 O=C(Cl)CCCCBr 2116-D-X0 [1,0,0,0,0,0|3,0,0]=4 53 B7R0.4 O=C(Cl)OCCCCl 2123-5-0S [1,0,0,0,0,0|2,0,0]=3 54 B7R0.4 O=C(O)CCCCCl 2121-5-05 [1,0,0,0,0,0|3,0,0]=4 55 B7R0.4 O=C([O-])CCCCO 2129-1-1E [1,0,0,0,0,0|3,0,0]=4 56 B9R0.1 C=CC(=O)OCCC(C)C 2123-1-1B [0,1,0,0,0,0|0,0,1]=2 57 B9R0.1 CC(C)=CCCC(C)C=O 2315-1-06 [0,1,0,0,0,0|2,0,1]=4 58 B9R0.1 CCC(C)CCOC(C)=O 2123-1-1C [0,1,0,0,0,0|0,0,0]=1 59 B9R0.1 COC(=O)COCC(C)F 2123-3-6K [0,1,0,0,0,0|3,0,0]=4 60 B9R0.1 COC(C)CCOC(C)=O 2123-1-1E [0,1,0,0,0,0|0,0,0]=1 61 B9R0.7 CC(=O)OCC(N)C(=O)O 4157-1-X8 [0,1,0,0,0,0|2,0,1]=4 62 B9R0.7 C[S+](C)CCC(N)C(=O)O 8166-9-00 [0,1,0,0,0,0|3,0,0]=4 63 B9R0.7 C[S+](C)CC[C@@H](N)C(=O)O 8166-9-R0 [0,1,0,0,0,0|3,0,0]=4 64 B9R0.53 CC(=O)CC(=O)CC(C)C 2118-1-06 [0,1,0,0,0,0|1,0,1]=3 65 B9R0.53 CC(C)CC(O)CC(C)C 2102-1-0A [0,1,0,0,0,0|2,0,1]=4 66 B9R0.53 CN(C)CC(O)CC(=O)O 4129-1-X1 [0,1,0,0,0,0|3,0,0]=4 67 B9R0.56 CC(=O)COCC(C)(F)F 2117-3-1P [0,1,0,0,0,0|3,0,0]=4 68 B9R0.56 CC(=O)OCC[B-](F)(F)F 6160-3-0F [0,1,0,0,0,0|3,0,0]=4 69 B9R0.56 CC(=O)SCC[N+](C)(C)C 8166-9-01 [0,1,0,0,0,0|1,1,0]=3 70 B9R0.56 CC(=O)SCC[N+](C)(C)C 8166-H-01 [0,1,0,0,0,0|1,1,0]=3 71 B9R0.56 CC(C)(C)OCCC(=O)O 2121-1-10 [0,1,0,0,0,0|3,0,0]=4 72 B9R0.56 CC(C)CCCC(C)(C)Cl 1100-5-43 [0,1,0,0,0,0|2,0,1]=4 73 B9R0.56 CN(C)CCCC(C)(C)Cl 3132-5-06 [0,1,0,0,0,0|3,0,0]=4 74 B9R1.35 CC(=O)N1CC[C@@H](O)C1 4H56-1-PC [0,0,0,1,0,0|2,0,0]=3 75 B9R1.35 CC(C)[C@@H]1COC(=S)N1 8H67-1-R1 [0,0,0,1,0,0|1,1,0]=3 76 B9R1.35 CC(C)[C@@H]1CSC(=S)N1 7H67-1-R3 [0,0,0,1,0,0|1,2,0]=4 77 B9R1.35 CC(C)[C@H]1COC(=S)N1 8H67-1-S1 [0,0,0,1,0,0|1,1,0]=3 78 B9R1.35 CC(C)[C@H]1CSC(=S)N1 7H67-1-S1 [0,0,0,1,0,0|1,2,0]=4 79 B9R1.35 CC1=NC(C(C)C)CO1 4H44-1-29 [0,0,0,1,0,0|1,0,0]=2 80 B9R1.35 CN1CCC(C(=O)O)C1 4H21-5-0C [0,0,0,1,0,0|3,0,0]=4 81 B9R1.35 CN1CC[C@@H](C(=O)O)C1 4H58-5-3S [0,0,0,1,0,0|3,0,0]=4 82 B9R1.35 C[C@@H]1CN[C@H](C(=O)O)C1 4H21-1-S3 [0,0,0,1,0,0|3,0,0]=4 83 B9R1.35 C[C@@H]1CN[C@H](C(=O)O)C1 4H21-5-0M [0,0,0,1,0,0|3,0,0]=4 84 B9R1.35 NC1CCC(C(=O)O)C1 4257-5-04 [0,0,0,1,0,0|3,0,0]=4 85 B9R1.35 N[C@H]1CC[C@@H](C(=O)O)C1 4257-1-09 [0,0,0,1,0,0|3,0,0]=4 86 B9R1.35 O=C1OCC(C(F)F)O1 2H28-3-21 [0,0,0,1,0,0|3,0,0]=4 87 B9R1.49 CN1CCCC(=O)CC1 4H56-5-AU [0,0,0,1,0,0|2,0,0]=3 88 B9R1.49 CN1CCNC(=O)CC1 4H48-1-1Z [0,0,0,1,0,0|2,0,0]=3 89 B9R1.49 O=C1CCC(O)CCN1 4H48-1-1G [0,0,0,1,0,0|2,0,0]=3 90 B9R1.53 CC(=O)OC1CC(=O)C1 2H29-1-32 [0,0,0,1,0,0|1,0,1]=3 91 B9R1.53 N[C@H]1C[C@@H](CC(=O)O)C1 4257-1-08 [0,0,0,1,0,0|3,0,0]=4 92 B9R1.66 CC1(C)CC(=O)CCO1 2H17-1-0A [0,0,0,1,0,0|2,0,0]=3 93 B9R1.66 CC1(C)CC(O)CCO1 2H02-1-05 [0,0,0,1,0,0|2,0,1]=4 94 B9R1.66 CC1(C)CCCC(=O)C1 2217-1-32 [0,0,0,1,0,0|1,0,0]=2 95 B9R1.66 CC1(C)CS(=O)CCN1 8H65-1-02 [0,0,0,1,0,0|3,0,0]=4 96 B9R1.66 CC1(C)CS(=O)CCN1 8H65-5-01 [0,0,0,1,0,0|3,0,0]=4 97 B9R1.161 CC(C)C1CC1C(=O)O 2221-1-14 [0,0,0,1,0,0|2,0,0]=3 98 B7R0.6 C=C(C)CCC(=O)O 2321-1-0E [0,0,0,0,1,0|1,0,2]=4 99 B7R0.6 C=C(C)COC(C)=O 2324-1-0F [0,0,0,0,1,0|0,0,2]=3 100 B7R0.6 CC(=O)CCC(C)C 2117-1-12 [0,0,0,0,1,0|0,0,0]=1 101 B7R0.6 CC(=O)OCC(C)F 2123-3-0L [0,0,0,0,1,0|1,0,0]=2 102 B7R0.6 CC(=O)ON=C(C)C 4156-1-59 [0,0,0,0,1,0|1,0,1]=3 103 B7R0.6 CC(C)CCB(O)O 6160-1-0B [0,0,0,0,1,0|2,0,1]=4 104 B7R0.6 CC(C)CCC(=N)N 3141-1-00 [0,0,0,0,1,0|2,0,0]=3 105 B7R0.6 CC(C)CCC(=O)O 2121-1-29 [0,0,0,0,1,0|1,0,0]=2 106 B7R0.6 CC(C)CCC(C)O 2102-1-0C [0,0,0,0,1,0|0,0,2]=3 107 B7R0.6 CC(Cl)CCC(=O)Cl 2116-5-0B [0,0,0,0,1,0|2,0,0]=3 108 B7R0.6 CC(F)COC(=O)Cl 2123-7-0B [0,0,0,0,1,0|2,0,0]=3 109 B7R0.6 CC(F)COC(C)C 2107-3-6W [0,0,0,0,1,0|2,0,1]=4 110 B7R0.6 CC(N)CCC(=O)O 4157-5-14 [0,0,0,0,1,0|2,0,0]=3 111 B7R0.6 C[C@@H](O)CC[C@@H](C)O 2104-1-33 [0,0,0,0,1,0|1,0,2]=4 112 B7R0.6 C[C@H](O)CC[C@H](C)O 2104-1-27 [0,0,0,0,1,0|1,0,2]=4 113 B7R0.6 O=C(O)CCC(F)F 2121-3-72 [0,0,0,0,1,0|3,0,0]=4 114 B9R0.55 CC(=N)NCCCN(C)C 3141-H-02 [0,0,0,0,0,1|3,0,0]=4 115 B9R0.55 CC(=O)CCOCC(C)C 2117-1-0G [0,0,0,0,0,1|1,0,0]=2 116 B9R0.55 CC(=O)CCOCC(C)F 2117-3-0M [0,0,0,0,0,1|2,0,0]=3 117 B9R0.55 CC(=O)CCOCC(F)F 2117-3-0S [0,0,0,0,0,1|3,0,0]=4 118 B9R0.55 CC(=O)NCCNC(C)=O 4148-1-27 [0,0,0,0,0,1|2,0,1]=4 119 B9R0.55 CC(=O)NCCOC(C)=O 4158-1-27 [0,0,0,0,0,1|1,0,1]=3 120 B9R0.55 CC(C)CCCCC(=O)Cl 2116-5-19 [0,0,0,0,0,1|2,0,0]=3 121 B9R0.55 CC(C)NCCNC(C)C 3131-1-16 [0,0,0,0,0,1|2,0,1]=4 122 B6R0.4 C#CCOC(C)=O 2523-1-01 [2,0,0,0,0,0|0,0,2]=4 123 B6R0.4 C=C(Br)CCCC 1300-9-19 [2,0,0,0,0,0|1,0,1]=4 124 B6R0.4 C=CCC[C@H](C)O 2302-1-S1 [2,0,0,0,0,0|1,0,1]=4 125 B6R0.4 C=COCC(C)F 2307-3-0A [2,0,0,0,0,0|1,0,1]=4 126 B6R0.4 CC(=O)CCCBr 2117-9-0A [2,0,0,0,0,0|1,0,0]=3 127 B6R0.4 CC(=O)OCC=O 2123-1-53 [2,0,0,0,0,0|1,0,1]=4 128 B6R0.4 CC(=O)OCCBr 2123-9-24 [2,0,0,0,0,0|1,0,0]=3 129 B6R0.4 CC(=O)OCCCl 2123-5-0M [2,0,0,0,0,0|1,0,0]=3 130 B6R0.4 CC(C)CCCCl 1100-5-44 [2,0,0,0,0,0|1,0,1]=4 131 B6R0.4 CC(C)CON=O 4145-1-01 [2,0,0,0,0,0|1,0,0]=3 132 B6R0.4 CC(F)COC=O 2123-3-0J [2,0,0,0,0,0|1,0,0]=3 133 B6R0.4 CCCCC(=N)N 3141-1-03 [2,0,0,0,0,0|2,0,0]=4 134 B6R0.4 CCCCC(=O)Br 2116-9-0A [2,0,0,0,0,0|1,0,0]=3 135 B6R0.4 CCCCC(C)=O 2117-1-11 [2,0,0,0,0,0|0,0,0]=2 136 B6R0.4 CCCCC(C)O 2102-1-07 [2,0,0,0,0,0|0,0,2]=4 137 B6R0.4 CCCCC(N)=O 4148-1-0P [2,0,0,0,0,0|1,0,0]=3 138 B6R0.4 CCCC[C@@H](C)N 3130-1-R0 [2,0,0,0,0,0|1,0,1]=4 139 B6R0.4 CCCC[C@H](C)N 3130-1-S0 [2,0,0,0,0,0|1,0,1]=4 140 B6R0.4 CCCC[C@H](C)O 2102-1-S0 [2,0,0,0,0,0|0,0,2]=4 141 B6R0.4 CCCNC(C)C 3131-1-0E [2,0,0,0,0,0|1,0,1]=4 142 B6R0.4 CCCNC(N)=O 4153-1-00 [2,0,0,0,0,0|2,0,0]=4 143 B6R0.4 CCCOC(=O)Cl 2116-5-30 [2,0,0,0,0,0|1,0,0]=3 144 B6R0.4 CCCOC(N)=O 4156-1-2G [2,0,0,0,0,0|1,0,0]=3 145 B6R0.4 CCCSC(C)=O 6166-1-0A [2,0,0,0,0,0|0,1,0]=3 146 B6R0.4 CCNCC(=O)O 4158-1-76 [2,0,0,0,0,0|2,0,0]=4 147 B6R0.4 CCOCC(=O)O 2121-1-20 [2,0,0,0,0,0|2,0,0]=4 148 B6R0.4 CCOCC(C)F 2107-3-8K [2,0,0,0,0,0|1,0,1]=4 149 B6R0.4 CNCCC(=O)O 4157-1-11 [2,0,0,0,0,0|2,0,0]=4 150 B6R0.4 CNCCN(C)C 3133-5-07 [2,0,0,0,0,0|2,0,0]=4 151 B6R0.4 COCCC(=O)Cl 2116-5-0C [2,0,0,0,0,0|2,0,0]=4 152 B6R0.4 COCCC(=O)O 2123-1-63 [2,0,0,0,0,0|2,0,0]=4 153 B6R0.4 COCCC(C)O 2107-1-13 [2,0,0,0,0,0|1,0,0]=3 154 B6R0.4 CSCCC(=O)Cl 6166-5-01 [2,0,0,0,0,0|2,0,0]=4 155 B6R0.4 CSCCC(C)=O 6166-1-0J [2,0,0,0,0,0|1,0,0]=3 156 B6R0.4 CSCCN(C)C 7166-1-04 [2,0,0,0,0,0|1,1,0]=4 157 B6R0.4 O=C(Cl)CCCBr 2116-D-01 [2,0,0,0,0,0|2,0,0]=4 158 B6R0.4 O=C(Cl)OCCBr 2123-D-00 [2,0,0,0,0,0|2,0,0]=4 159 B6R0.4 O=C(Cl)OCCCl 2123-5-0K [2,0,0,0,0,0|2,0,0]=4 160 B6R0.4 O=C(O)CCCBr 2121-9-05 [2,0,0,0,0,0|2,0,0]=4 161 B6R0.4 O=COCC(F)F 2123-3-C7 [2,0,0,0,0,0|2,0,0]=4 162 B6R0.6 C=CCCCCC 1300-1-X2 [2,0,0,0,0,0|1,0,1]=4 163 B6R0.6 C=COCCCCl 2307-5-06 [2,0,0,0,0,0|1,0,1]=4 164 B6R0.6 C=COCCCF 2307-3-1A [2,0,0,0,0,0|1,0,1]=4 165 B6R0.6 CC#CCCCC 1500-1-10 [2,0,0,0,0,0|1,0,1]=4 166 B6R0.6 CCCCCNC 3131-1-15 [2,0,0,0,0,0|2,0,0]=4 167 B6R0.6 CCC\C=C\C=O 2315-1-08 [2,0,0,0,0,0|1,0,1]=4 168 B6R0.6 CCOCCCCl 2107-5-10 [2,0,0,0,0,0|1,0,1]=4 169 B6R0.6 CCOCCCF 2107-3-8L [2,0,0,0,0,0|1,0,1]=4 170 B6R0.6 CCOCCCO 2107-1-09 [2,0,0,0,0,0|1,0,1]=4 171 B6R0.6 CCOCOCC 2108-1-11 [2,0,0,0,0,0|1,0,1]=4 172 B6R0.6 O=CCCCCCl 2115-5-00 [2,0,0,0,0,0|2,0,0]=4 173 B6R0.6 O=CCCCCO 2120-1-05 [2,0,0,0,0,0|2,0,0]=4 174 B6R0.6 O=COCCCCl 2123-5-0V [2,0,0,0,0,0|1,0,0]=3 175 B6R0.6 O=COCCCF 2123-3-1F [2,0,0,0,0,0|1,0,0]=3 176 B8R0.6 C=CC(=O)OCCCCl 2324-5-0D [1,1,0,0,0,0|1,0,1]=4 177 B8R0.6 C=CC(=O)OCCCF 2324-3-1A [1,1,0,0,0,0|1,0,1]=4 178 B8R0.6 C=CC(=O)OCCOC 2324-1-30A [1,1,0,0,0,0|1,0,1]=4 179 B8R0.6 C=CC(=O)OCCOC 2324-1-30B [1,1,0,0,0,0|1,0,1]=4 180 B8R0.6 C=CC(=O)OCCOC 2324-1-30C [1,1,0,0,0,0|1,0,1]=4 181 B8R0.6 CCC(=O)OCCCCl 2123-5-0T [1,1,0,0,0,0|1,0,0]=3 182 B8R0.6 CCC(=O)OCCCF 2123-3-5Q [1,1,0,0,0,0|1,0,0]=3 183 B8R0.6 CCCCCC(=O)OC 2123-1-90 [1,1,0,0,0,0|1,0,0]=3 184 B8R0.6 CCCCCN(C)N=O 4152-1-05 [1,1,0,0,0,0|2,0,0]=4 185 B8R0.6 CCCCNC(=O)CC 4148-1-0Y [1,1,0,0,0,0|1,0,0]=3 186 B8R0.6 CCCCNC(=O)CCl 4148-5-0F [1,1,0,0,0,0|1,0,0]=3 187 B8R0.6 CCCCOC(=O)CF 2123-3-X1 [1,1,0,0,0,0|0,0,0]=2 188 B8R0.6 CCC\C=C\C(=O)OC 2323-1-0D [1,1,0,0,0,0|1,0,1]=4 189 B8R0.6 CCNCCC(=O)OC 4158-1-0D [1,1,0,0,0,0|2,0,0]=4 190 B8R0.6 COC(=O)CCCCBr 2123-9-14 [1,1,0,0,0,0|2,0,0]=4 191 B8R0.6 COC(=O)CCCCCl 2123-5-1C [1,1,0,0,0,0|2,0,0]=4 192 B8R0.6 COC(=O)CCCCN 4158-5-0A [1,1,0,0,0,0|2,0,0]=4 193 B8R0.6 COC(=O)OCCCCl 2128-5-0P [1,1,0,0,0,0|1,0,0]=3 194 B8R0.6 COCCCC(=O)OC G311-A-58 [1,1,0,0,0,0|2,0,0]=4 195 B8R0.6 COCCOC(=O)CCl 2123-5-1J [1,1,0,0,0,0|1,0,0]=3 196 B8R0.6 O=C(CO)OCCCCl 2129-5-0C [1,1,0,0,0,0|1,0,0]=3 197 B8R0.6 O=C(CO)OCCCF 2129-3-0N [1,1,0,0,0,0|1,0,0]=3 198 B8R0.7 C=C(C)CCCCCCl 1300-5-32 [1,1,0,0,0,0|2,0,0]=4 199 B8R0.7 CC(=O)CCOCCBr 2117-9-00 [1,1,0,0,0,0|2,0,0]=4 200 B8R0.7 CC(=O)CCOCCCl 2117-5-0A [1,1,0,0,0,0|2,0,0]=4 201 B8R0.7 CC(=O)COCCCCl 2117-5-0D [1,1,0,0,0,0|1,0,0]=3 202 B8R0.7 CC(=O)COCCCF 2117-3-1G [1,1,0,0,0,0|1,0,0]=3 203 B8R0.7 CC(=O)OCCCCBr 2123-9-19 [1,1,0,0,0,0|0,0,0]=2 204 B8R0.7 CC(=O)OCCCCCl 2123-5-0W [1,1,0,0,0,0|0,0,0]=2 205 B8R0.7 CC(=O)OCCCCI 2123-H-02 [1,1,0,0,0,0|0,0,0]=2 206 B8R0.7 CCCCC#CC(=O)O 2521-1-0A [1,1,0,0,0,0|2,0,0]=4 207 B8R0.7 CCCCCCC(C)=O 2117-1-X1 [1,1,0,0,0,0|1,0,0]=3 208 B8R0.7 CCCCCO[N+](=O)[O-] 4154-1-0B [1,1,0,0,0,0|2,0,0]=4 209 B8R0.7 CCCCOCC(=O)O 2121-1-52 [1,1,0,0,0,0|1,0,0]=3 210 B8R0.7 CCCCOCC(C)F 2107-3-6C [1,1,0,0,0,0|1,0,1]=4 211 B8R0.7 COCCOCC(=O)Cl 2116-5-12 [1,1,0,0,0,0|2,0,0]=4 212 B8R0.7 COCCOCC(=O)O 2121-1-33A [1,1,0,0,0,0|2,0,0]=4 213 B8R0.7 COCCOCC(=O)O 2121-1-33B [1,1,0,0,0,0|2,0,0]=4 214 B8R0.7 COCCOCC(=O)O 2121-1-33C [1,1,0,0,0,0|2,0,0]=4 215 B8R0.7 CSCCCOC(C)=O 6166-1-0K [1,1,0,0,0,0|0,0,0]=2 216 B8R0.7 NC(=O)CCCCCBr 4148-9-07 [1,1,0,0,0,0|2,0,0]=4 217 B8R0.7 NCCCCCC(=O)O 4157-1-0B [1,1,0,0,0,0|2,0,0]=4 218 B8R0.7 O=C(O)CCCCCCl 2121-5-06 [1,1,0,0,0,0|2,0,0]=4 219 B8R0.7 O=C(O)CCCCCO 2129-1-0D [1,1,0,0,0,0|2,0,0]=4 220 B8R0.8 CC(=O)N(C)CCCN 4148-5-0E [1,1,0,0,0,0|2,0,0]=4 221 B8R0.8 CCCCC(Br)C(=O)O 2121-9-16 [1,1,0,0,0,0|2,0,0]=4 222 B8R0.8 CCCCC(C)C(=O)O 2121-1-0S [1,1,0,0,0,0|2,0,0]=4 223 B8R0.9 CC(=O)OCC(=O)CCl 2129-5-0G [1,1,0,0,0,0|1,0,1]=4 224 B8R0.9 CC(=O)OCC(C)CBr 2123-9-0N [1,1,0,0,0,0|1,0,0]=3 225 B8R0.9 CCC(C)CCC(C)C 1100-1-26 [1,1,0,0,0,0|1,0,1]=4 226 B8R0.9 CCC(C)COC(=O)Cl 2116-5-28 [1,1,0,0,0,0|1,0,0]=3 227 B8R0.9 CCC(Cl)CCC(=O)Cl 2116-5-23 [1,1,0,0,0,0|2,0,0]=4 228 B8R0.9 CCC(O)CCC(C)C 2102-1-0B [1,1,0,0,0,0|1,0,1]=4 229 B8R0.21 CCCCOS(C)(=O)=O 6164-1-23 [1,1,0,0,0,0|1,0,0]=3 230 B8R0.21 COCCOS(C)(=O)=O 6164-1-06A [1,1,0,0,0,0|2,0,0]=4 231 B8R0.21 COCCOS(C)(=O)=O 6164-1-06B [1,1,0,0,0,0|2,0,0]=4 232 B8R0.21 COCCOS(C)(=O)=O 6164-1-06C [1,1,0,0,0,0|2,0,0]=4 233 B8R0.21 CS(=O)(=O)OCCCCl 6164-5-08 [1,1,0,0,0,0|2,0,0]=4 234 B8R0.21 O=COCCC(F)(F)F 2123-3-1P [1,1,0,0,0,0|2,0,0]=4 235 B8R0.23 CC(C)C(N)CC(=O)O 4157-1-40 [0,1,0,0,1,0|1,0,0]=3 236 B8R0.23 CC(C)CC(Br)C(=O)O 2121-9-0D [0,1,0,0,1,0|1,0,0]=3 237 B8R0.23 CC(C)CC(O)C(=O)O 2129-1-0U [0,1,0,0,1,0|1,0,0]=3 238 B8R0.23 CC(C)C[C@@H](O)C(=O)O 2129-1-RB [0,1,0,0,1,0|1,0,0]=3 239 B8R0.23 CC(C)C[C@H](Cl)C(=O)O 2121-5-S2 [0,1,0,0,1,0|1,0,0]=3 240 B8R0.23 CC(C)C[C@H](F)C(=O)O 2121-3-S2 [0,1,0,0,1,0|1,0,0]=3 241 B8R0.23 CC(C)C[C@H](N)C(N)=O 4158-5-02 [0,1,0,0,1,0|1,0,0]=3 242 B8R0.23 CC(C)[C@H](N)CC(=O)O 4157-1-R40 [0,1,0,0,1,0|1,0,0]=3 243 B8R0.23 CC(C)[C@H](N)CC(=O)O 4157-5-10 [0,1,0,0,1,0|1,0,0]=3 244 B8R0.29 CC(=O)CSC(C)(C)C 6166-1-03 [0,1,0,0,1,0|1,0,0]=3 245 B8R0.29 CC(=O)OCC(C)(F)F 2123-3-6W [0,1,0,0,1,0|1,0,0]=3 246 B8R0.29 CC(=O)OCC(Cl)(Cl)Cl 2123-5-0E [0,1,0,0,1,0|2,0,0]=4 247 B8R0.29 CC(=O)OC[Si](C)(C)C 6180-1-04 [0,1,0,0,1,0|0,1,0]=3 248 B8R0.29 CC(=O)ONC(C)(C)C 4156-5-0H [0,1,0,0,1,0|1,0,0]=3 249 B8R0.29 CC(C)(C)CCC(=O)O 2121-1-36 [0,1,0,0,1,0|1,0,0]=3 250 B8R0.29 CC(C)(N)CCC(=O)O 4157-1-32 [0,1,0,0,1,0|1,0,0]=3 251 B8R0.29 CC(C)(N)CCC(=O)O 4157-5-13 [0,1,0,0,1,0|1,0,0]=3 252 B8R0.29 CC(F)(F)COC(=O)Cl 2123-7-0L [0,1,0,0,1,0|2,0,0]=4 253 B8R0.29 CC(F)COS(C)(=O)=O 6164-3-0E [0,1,0,0,1,0|2,0,0]=4 254 B10R0.15 CC(=O)CCOCC(C)(F)F 2117-3-1N [0,1,0,0,0,1|2,0,0]=4 255 B10R0.15 CC(=O)OCCC[Si](C)(Cl)Cl 6181-5-00 [0,1,0,0,0,1|1,1,0]=4 256 B10R0.15 CC(=O)SCCC[N+](C)(C)C 8166-H-02 [0,1,0,0,0,1|1,1,0]=4 257 B10R0.15 CC(C)OCCOS(C)(=O)=O 6164-1-0C [0,1,0,0,0,1|1,0,0]=3 258 B10R0.96 CC(=O)OCC(C)OC(C)=O 2123-1-83 [0,1,0,0,0,1|1,0,1]=4 259 B10R0.98 CC(C)CCOC(=O)C(C)O 2129-1-1H [0,1,0,0,0,1|0,0,2]=4 260 B10R0.3 CC(C)=CCCC(C)CCO 2301-1-07 [0,2,0,0,0,0|2,0,0]=4 261 B10R0.3 CC(C)=CCC[C@@H](C)CC=O 2315-1-R0 [0,2,0,0,0,0|2,0,0]=4 262 B10R0.3 CC(C)=CCC[C@H](C)CC=O 2315-1-S0 [0,2,0,0,0,0|2,0,0]=4 263 B10R0.3 CCCC(S)CCOC(C)=O 6160-1-X2 [0,2,0,0,0,0|1,0,0]=3 264 B10R0.3 CCOC(=O)CCCN(C)C 4158-1-35 [0,2,0,0,0,0|2,0,0]=4 265 B10R0.65 CCC(C)(O)CCC=C(C)C 2303-1-02 [0,2,0,0,0,0|2,0,0]=4 266 B10R0.12 CC(=O)OCC(Br)C(F)(F)Br 2123-B-32 [0,2,0,0,0,0|2,0,0]=4 267 B10R0.43 CC(=O)OCC(F)(F)C(F)F 2123-3-8A [0,2,0,0,0,0|2,0,0]=4 268 B10R0.31 CC(=O)OC(C)C[N+](C)(C)C 4156-5-17 [0,2,0,0,0,0|1,0,0]=3 269 B10R0.31 CC(CC(=O)O)CC(C)(C)C 2121-1-0Q [0,2,0,0,0,0|2,0,0]=4 270 B8R1.1 C=C[C@H]1COC(=O)C1 2H25-1-60 [1,0,0,1,0,0|0,0,2]=4 271 B8R1.1 CCC1CCC(=O)O1 2H25-1-20 [1,0,0,1,0,0|2,0,0]=4 272 B8R1.1 NC[C@H]1CNC(=O)C1 4H48-1-SC [1,0,0,1,0,0|2,0,0]=4 273 B8R1.1 NC[C@H]1CNC(=O)C1 4H48-5-S7 [1,0,0,1,0,0|2,0,0]=4 274 B8R1.1 O=C1CC(CO)CN1 4H48-1-93 [1,0,0,1,0,0|2,0,0]=4 275 B8R1.1 O=C1NC(CO)CO1 4H56-1-0NV [1,0,0,1,0,0|2,0,0]=4 276 B8R1.1 O=C1N[C@@H](CO)CO1 4H56-1-S59 [1,0,0,1,0,0|2,0,0]=4 277 B8R1.1 O=C1N[C@H](CO)CO1 4H56-1-R59 [1,0,0,1,0,0|2,0,0]=4 278 B8R1.1 O=C1OCC(CBr)O1 2H28-9-00 [1,0,0,1,0,0|2,0,0]=4 279 B8R1.1 O=C1OCC(CF)O1 2H28-3-05 [1,0,0,1,0,0|2,0,0]=4 280 B8R1.4 CC1CC(=O)CCN1 4H56-5-0M [1,0,0,1,0,0|2,0,0]=4 281 B8R1.4 CC1CCCC(=O)C1 2217-1-0Z [1,0,0,1,0,0|1,0,0]=3 282 B8R1.4 CC1CCCC(=O)N1 4H48-1-CH [1,0,0,1,0,0|2,0,0]=4 283 B8R1.4 CC1CCNC(C)C1 3H31-1-GJ [1,0,0,1,0,0|1,0,1]=4 284 B8R1.4 CN1CCCC(=O)C1 4H17-1-2E [1,0,0,1,0,0|2,0,0]=4 285 B8R1.4 CN1CCCC(=O)C1 4H17-5-1E [1,0,0,1,0,0|2,0,0]=4 286 B8R1.4 C[C@@H]1CC(=O)CCN1 4H56-5-1P [1,0,0,1,0,0|2,0,0]=4 287 B8R1.4 C[C@H]1CC(=O)CCN1 4H29-3-S1 [1,0,0,1,0,0|2,0,0]=4 288 B8R1.4 NC1CCNC(=O)C1 4H22-1-10 [1,0,0,1,0,0|2,0,0]=4 289 B8R1.7 CC(=O)C1=CCCC1 2417-1-0J [1,0,0,1,0,0|1,0,1]=4 290 B8R1.7 CC(=O)C1CCCC1 2217-1-0X [1,0,0,1,0,0|1,0,0]=3 291 B8R1.7 CC(=O)C1CCNC1 4H17-5-3H [1,0,0,1,0,0|2,0,0]=4 292 B8R1.7 CC(C)C1CCCC1 1200-1-13 [1,0,0,1,0,0|1,0,1]=4 293 B8R1.7 O=C(O)C1CCCC1 2221-1-Y5 [1,0,0,1,0,0|2,0,0]=4 294 B8R1.19 CC1(C)CCCC1=O 2217-1-1K [1,0,0,1,0,0|1,0,0]=3 295 B8R1.19 CC1(C)CCOC1=O 2H25-1-2X [1,0,0,1,0,0|0,0,0]=2 296 B8R1.22 BrC1=CCCCCC1 1400-9-06 [1,0,0,1,0,0|2,0,0]=4 297 B8R1.22 O=C1C=CCCCC1 2417-1-0D [1,0,0,1,0,0|1,0,1]=4 298 B8R1.22 O=C1CCCCSC1 6H66-1-10 [1,0,0,1,0,0|2,0,0]=4 299 B8R1.22 O=C1CNCCCN1 4H48-1-4S [1,0,0,1,0,0|2,0,0]=4 300 B8R1.34 CC(=O)CC1COC1 2H17-1-01 [1,0,0,1,0,0|2,0,0]=4 301 B8R1.34 O=C(O)CC1CCC1 2221-1-52 [1,0,0,1,0,0|2,0,0]=4 302 B8R1.35 CC(=O)NCC1CC1 4248-1-00 [1,0,0,1,0,0|1,0,0]=3 303 B8R1.35 O=C(O)CCC1CC1 2221-1-24 [1,0,0,1,0,0|2,0,0]=4 304 B8R1.72 CC1(C)CCCNC1 3H31-5-8E [1,0,0,1,0,0|2,0,0]=4 305 B8R1.72 CC1(C)CCNCC1 3H31-5-33 [1,0,0,1,0,0|1,0,1]=4 306 B8R1.72 CC1(C)CCOCO1 2H08-1-0F [1,0,0,1,0,0|0,0,2]=4 307 B8R1.72 CC1(N)CCOCC1 4H30-5-13 [1,0,0,1,0,0|1,0,1]=4 308 B8R1.72 O=S1(=O)CCCCO1 6H70-1-04 [1,0,0,1,0,0|2,0,0]=4 309 B8R1.3 C=C1CCC(C)CC1 1300-1-47 [0,0,0,1,1,0|1,0,0]=3 310 B8R1.3 CC1CCC(=O)CC1 2217-1-X3 [0,0,0,1,1,0|0,0,0]=2 311 B8R1.3 CC1CCC(Br)CC1 1200-9-24 [0,0,0,1,1,0|1,0,1]=4 312 B8R1.3 CC1CCC(N)CC1 3233-5-06 [0,0,0,1,1,0|1,0,1]=4 313 B8R1.3 CC1CCC(O)CC1 2202-1-02 [0,0,0,1,1,0|0,0,2]=4 314 B8R1.3 C[C@H]1CC[C@@H](N)CC1 3233-5-01 [0,0,0,1,1,0|1,0,1]=4 315 B8R1.3 C[C@H]1CC[C@H](O)CC1 2202-1-17 [0,0,0,1,1,0|0,0,2]=4 316 B8R1.3 NC1CCC(=O)CC1 4256-1-01 [0,0,0,1,1,0|1,0,0]=3 317 B8R1.3 NC1CCC(=O)CC1 4256-5-56 [0,0,0,1,1,0|1,0,0]=3 318 B8R1.3 NC1CCC(=O)NC1 4H48-5-66 [0,0,0,1,1,0|2,0,0]=4 319 B8R1.3 O=C1CCC(=O)CC1 2218-1-X2 [0,0,0,1,1,0|1,0,1]=4 320 B8R1.3 O=C1CCC(O)CC1 2220-1-X3 [0,0,0,1,1,0|1,0,0]=3 321 B8R1.3 O=C1CCC(O)CN1 4H20-1-29 [0,0,0,1,1,0|2,0,0]=4 322 B8R1.23 CC(=O)N1CC(O)C1 4H48-1-LQ [0,0,0,1,1,0|2,0,0]=4 323 B8R1.23 CC1CC(C(=O)O)C1 2221-1-0B [0,0,0,1,1,0|1,0,0]=3 324 B8R1.23 C[C@H]1C[C@@H](C(=O)O)C1 2221-1-29 [0,0,0,1,1,0|1,0,0]=3 325 B8R1.23 NC1CC(C(=O)O)C1 4257-1-29 [0,0,0,1,1,0|2,0,0]=4 326 B8R1.23 NC1CC(C(=O)O)C1 4257-5-14 [0,0,0,1,1,0|2,0,0]=4 327 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 4257-5-01 [0,0,0,1,1,0|2,0,0]=4 328 B8R1.23 N[C@H]1C[C@H](C(=O)O)C1 4257-5-07 [0,0,0,1,1,0|2,0,0]=4 329 B8R1.23 O=C(O)C1CC(F)C1 2221-3-09 [0,0,0,1,1,0|2,0,0]=4 330 B8R1.23 O=C(O)C1CC(O)C1 2229-1-89 [0,0,0,1,1,0|2,0,0]=4 331 B8R1.51 CC1(C)CCC(=O)N1 4H48-1-052 [0,0,0,1,1,0|1,0,0]=3 332 B8R1.51 CC1(C)CCC(=O)O1 2H25-1-54 [0,0,0,1,1,0|1,0,0]=3 333 B8R1.51 CC1(C)CNC(=O)C1 4H48-1-DU [0,0,0,1,1,0|1,0,0]=3 334 B8R1.51 CC1(C)COC(=O)N1 4H56-1-NJ [0,0,0,1,1,0|1,0,0]=3 335 B8R1.51 CC1(C)COC(=O)O1 2H28-1-16 [0,0,0,1,1,0|1,0,0]=3 336 B8R1.51 CC1(O)CNC(=O)C1 4H48-1-72 [0,0,0,1,1,0|2,0,0]=4 337 B8R1.51 CC1=NC(C)(C)CO1 4H44-1-0A [0,0,0,1,1,0|1,0,0]=3 338 B8R1.51 CC1CCS(=O)(=O)C1 6H63-1-0A [0,0,0,1,1,0|2,0,0]=4 339 B8R1.77 CC1(C)CC1C(=O)O 2221-1-0X [0,0,0,1,1,0|1,0,0]=3 340 B8R1.77 CC1(C)CC1C(N)=O 4248-1-07 [0,0,0,1,1,0|1,0,0]=3 341 B8R1.77 CC1(C)C[C@@H]1C(=O)O 2221-1-S0 [0,0,0,1,1,0|1,0,0]=3 342 B10R1.54 CC(=O)O[C@H]1C=C[C@@H](O)C1 2323-1-37 [0,0,0,1,0,1|1,0,1]=4 343 B10R1.54 CC(C)C[C@H]1COC(=O)N1 4H56-1-S63 [0,0,0,1,0,1|1,0,0]=3 344 B10R1.113 CC(=O)C1CCCN(C)C1 4H17-1-2S [0,0,0,1,0,1|2,0,0]=4 345 B10R1.113 CC(=O)C1CCCN(C)C1 4H17-5-0Z [0,0,0,1,0,1|2,0,0]=4 346 B10R1.113 CC(C)N1CCCC(=O)C1 4H17-1-9V [0,0,0,1,0,1|1,0,0]=3 347 B10R1.13 CC(C)C1CCC(=O)CC1 2217-1-13 [0,1,0,1,0,0|1,0,0]=3 348 B10R1.13 CC(C)N1CCC(=O)CC1 4H17-1-24 [0,1,0,1,0,0|2,0,0]=4 349 B10R1.13 CC1CCC(C(N)=O)CN1 4H48-1-A6 [0,1,0,1,0,0|2,0,0]=4 350 B10R1.13 CN(C)C1CCC(=O)CC1 4256-1-84 [0,1,0,1,0,0|2,0,0]=4 351 B10R1.14 COC(=O)[C@H]1CC[C@@H](O)C1 2229-1-92 [0,1,0,1,0,0|2,0,0]=4 352 B10R1.153 COC(=O)CCNC1CC1 4231-1-02 [0,1,0,1,0,0|2,0,0]=4 353 B10R1.194 CC(C)[C@H]1COC(=O)N1N 4H56-1-S0A [0,1,0,1,0,0|1,0,0]=3 354 B10R1.83 CC1(C)C(N)CC1C(=O)O 4257-1-00 [0,1,0,1,0,0|2,0,0]=4 355 B10R1.359 CC1(C)CCC(C(=O)O)C1 2221-1-45 [0,1,0,1,0,0|2,0,0]=4 356 B10R1.59 CC(C)C1NC(=O)OC1=O 4H48-1-03W [0,1,0,1,0,0|1,0,1]=4 357 B10R1.329 CC1(C)CC(=O)C=C(Cl)C1 2417-5-04 [0,1,0,1,0,0|1,0,1]=4 358 B10R1.329 CC1(C)CC(=O)C=C(N)C1 4256-1-81 [0,1,0,1,0,0|1,0,1]=4 359 B10R1.329 CC1CC(=O)CC(C)(C)C1 2217-1-0S [0,1,0,1,0,0|1,0,0]=3 360 B10R1.112 CC(C)(C)OC1CC(=O)C1 2217-1-08 [0,1,0,1,0,0|2,0,0]=4 361 B10R2.14 O=C1CC(C2CC2)CN1 4H48-1-04N [0,0,0,2,0,0|1,0,0]=3 362 B10R2.179 CC12CCCC(=O)C1C2 2217-1-1S [0,0,0,2,0,0|1,0,0]=3 363 B10R2.179 CC12CCCC(=O)C1O2 2217-1-0R [0,0,0,2,0,0|2,0,0]=4 364 B10R2.365 O=C(O)CC12CC(C1)C2 2221-1-48 [0,0,0,2,0,0|2,0,0]=4 365 B6R0.2 C=C(Br)CC(C)C 1300-9-16 [0,0,0,0,2,0|1,0,1]=4 366 B6R0.2 CC(=O)OC(C)Br 2123-9-25 [0,0,0,0,2,0|1,0,0]=3 367 B6R0.2 CC(C)CC(=O)O 2121-1-18 [0,0,0,0,2,0|1,0,0]=3 368 B6R0.2 CC(C)CC(C)Cl 1100-5-09 [0,0,0,0,2,0|1,0,1]=4 369 B6R0.2 CC(C)NC(N)=O 4153-1-10 [0,0,0,0,2,0|2,0,0]=4 370 B6R0.2 CC(C)OC(N)=O 4156-1-2S [0,0,0,0,2,0|1,0,0]=3 371 B6R0.2 CC(C)SC(=O)Cl 6166-5-00 [0,0,0,0,2,0|1,1,0]=4 372 B6R0.2 CC(Cl)CC(=O)O 2121-5-09 [0,0,0,0,2,0|2,0,0]=4 373 B6R0.2 CN(C)CC(=O)O 4158-1-41 [0,0,0,0,2,0|2,0,0]=4 374 B6R0.2 C[C@@H](N)CC(=O)O 4157-1-12 [0,0,0,0,2,0|2,0,0]=4 375 B6R0.2 C[C@H](N)CC(=O)O 4157-5-06 [0,0,0,0,2,0|2,0,0]=4