0 B8R1.4 CC1=CC(=O)CCC1 2417-1-0F [0,0,0,0,0,0|0,0,2]=2 1 B8R1.4 CC1CC(=O)CCN1 4H56-5-0M [0,0,0,0,0,0|1,0,0]=1 2 B8R1.4 CC1CC(O)CCN1 4H56-1-012 [0,0,0,0,0,0|1,0,2]=3 3 B8R1.4 CC1CCCC(=O)C1 2217-1-0Z [0,0,0,0,0,0|0,0,0]=0 4 B8R1.4 CC1CCCC(=O)N1 4H48-1-CH [0,0,0,0,0,0|1,0,0]=1 5 B8R1.4 CC1CCCC(N)C1 3230-1-0H [0,0,0,0,0,0|1,0,1]=2 6 B8R1.4 CC1CCCC(O)C1 2202-1-1F [0,0,0,0,0,0|0,0,2]=2 7 B8R1.4 CC1CCNC(C)C1 3H31-1-GJ [0,0,0,0,0,0|2,0,1]=3 8 B8R1.4 CC1CNCC(C)C1 3H31-1-0N [0,0,0,0,0,0|2,0,1]=3 9 B8R1.4 CC1COCC(C)N1 4H56-1-872 [0,0,0,0,0,0|3,0,1]=4 10 B8R1.4 CN1CCC=C(Br)C1 3H32-D-02 [0,0,0,0,0,0|2,0,1]=3 11 B8R1.4 CN1CCCC(=O)C1 4H17-1-2E [0,0,0,0,0,0|1,0,0]=1 12 B8R1.4 CN1CCCC(=O)C1 4H17-5-1E [0,0,0,0,0,0|1,0,0]=1 13 B8R1.4 CN1CCC[C@@H](N)C1 3H30-5-R0 [0,0,0,0,0,0|2,0,1]=3 14 B8R1.4 CN1CCC[C@@H](N)C1 3H32-1-R0 [0,0,0,0,0,0|2,0,1]=3 15 B8R1.4 CN1CCC[C@@H](O)C1 4H56-1-R01 [0,0,0,0,0,0|1,0,2]=3 16 B8R1.4 CN1CCC[C@H](N)C1 3H30-5-S0 [0,0,0,0,0,0|2,0,1]=3 17 B8R1.4 CN1CCC[C@H](O)C1 4H56-1-S10 [0,0,0,0,0,0|1,0,2]=3 18 B8R1.4 C[C@@H]1CC(=O)CCN1 4H56-5-1P [0,0,0,0,0,0|1,0,0]=1 19 B8R1.4 C[C@@H]1CNC[C@@H](C)N1 4H22-1-68 [0,0,0,0,0,0|3,0,1]=4 20 B8R1.4 C[C@@H]1CNC[C@@H](C)O1 4H56-1-0GA [0,0,0,0,0,0|3,0,1]=4 21 B8R1.4 C[C@H]1CC(=O)CCN1 4H29-3-S1 [0,0,0,0,0,0|1,0,0]=1 22 B8R1.4 C[C@H]1CCC[C@@H](C)N1 3H31-1-DB [0,0,0,0,0,0|2,0,1]=3 23 B8R1.4 C[C@H]1CN(C)CCN1 3H32-5-S1 [0,0,0,0,0,0|3,0,0]=3 24 B8R1.4 C[C@H]1CNC[C@H](C)O1 4H56-1-649 [0,0,0,0,0,0|3,0,1]=4 25 B8R1.4 NC1CCNC(=O)C1 4H22-1-10 [0,0,0,0,0,0|2,0,0]=2 26 B8R1.4 O=C1CCCC(=O)O1 2H26-1-0G [0,0,0,0,0,0|2,0,1]=3 27 B8R1.4 O=C1COCC(=O)C1 2H18-1-08 [0,0,0,0,0,0|2,0,1]=3 28 B8R1.4 O=C1COCC(=O)N1 4H48-1-FD [0,0,0,0,0,0|3,0,1]=4 29 B8R1.4 O=C1COCC(=O)O1 2H26-1-X1 [0,0,0,0,0,0|3,0,1]=4 30 B8R1.4 O[C@H]1CCC[C@@H](O)C1 2208-1-04 [0,0,0,0,0,0|1,0,2]=3 31 B7R1.3 BrC1=CCOCC1 2H10-9-0J [1,0,0,0,0,0|2,0,1]=4 32 B7R1.3 BrC1C=CCCC1 1400-9-01 [1,0,0,0,0,0|1,0,1]=3 33 B7R1.3 BrC1CCCCC1 1200-9-20 [1,0,0,0,0,0|1,0,1]=3 34 B7R1.3 BrC1CCCNC1 3H31-D-06 [1,0,0,0,0,0|2,0,0]=3 35 B7R1.3 BrC1CCCOC1 2H10-9-0M [1,0,0,0,0,0|2,0,0]=3 36 B7R1.3 BrC1CCNCC1 3H31-9-0H [1,0,0,0,0,0|2,0,1]=4 37 B7R1.3 CC1=CCNCC1 3H31-5-34 [1,0,0,0,0,0|2,0,1]=4 38 B7R1.3 CC1CCC=CO1 2H10-1-1J [1,0,0,0,0,0|1,0,1]=3 39 B7R1.3 CC1CCCNC1 3H31-1-74 [1,0,0,0,0,0|1,0,0]=2 40 B7R1.3 CC1CCOCO1 2H10-1-20 [1,0,0,0,0,0|2,0,1]=4 41 B7R1.3 CC1CNCCN1 3H31-1-65 [1,0,0,0,0,0|2,0,0]=3 42 B7R1.3 CC1SCCCS1 5H66-1-09 [1,0,0,0,0,0|2,0,1]=4 43 B7R1.3 CN1CCCCC1 3H32-1-6L [1,0,0,0,0,0|1,0,1]=3 44 B7R1.3 C[C@@H]1CCCCN1 3H31-1-R5 [1,0,0,0,0,0|1,0,1]=3 45 B7R1.3 C[C@@H]1CNCCO1 4H56-5-RF [1,0,0,0,0,0|2,0,0]=3 46 B7R1.3 C[C@H]1CCCCN1 3H31-5-SH [1,0,0,0,0,0|1,0,1]=3 47 B7R1.3 C[C@H]1CNCCO1 4H44-1-45 [1,0,0,0,0,0|2,0,0]=3 48 B7R1.3 C[C@H]1COCCN1 4H56-1-9W [1,0,0,0,0,0|2,0,0]=3 49 B7R1.3 C[C@H]1COCCN1 4H56-5-CW [1,0,0,0,0,0|2,0,0]=3 50 B7R1.3 ClC1=CCCCC1 1400-5-00 [1,0,0,0,0,0|1,0,1]=3 51 B7R1.3 ClC1CCNCC1 3H31-5-39 [1,0,0,0,0,0|2,0,1]=4 52 B7R1.3 ClC1CCOCC1 2H10-5-0B [1,0,0,0,0,0|2,0,1]=4 53 B7R1.3 FC1CCCNC1 3H31-7-07 [1,0,0,0,0,0|2,0,0]=3 54 B7R1.3 N=C1CCCCN1 3H35-5-05 [1,0,0,0,0,0|2,0,0]=3 55 B7R1.3 NC1CCCOC1 4H56-1-0KC [1,0,0,0,0,0|2,0,0]=3 56 B7R1.3 NC1CCCOC1 4H56-5-CT [1,0,0,0,0,0|2,0,0]=3 57 B7R1.3 NC1CCNCC1 3H30-1-H0 [1,0,0,0,0,0|2,0,1]=4 58 B7R1.3 NN1CCCCC1 3H39-1-26 [1,0,0,0,0,0|2,0,0]=3 59 B7R1.3 NN1CCNCC1 3H30-1-G9 [1,0,0,0,0,0|3,0,0]=4 60 B7R1.3 N[C@@H]1CCCOC1 4H30-5-09 [1,0,0,0,0,0|2,0,0]=3 61 B7R1.3 N[C@H]1CCCOC1 4H30-5-12 [1,0,0,0,0,0|2,0,0]=3 62 B7R1.3 O=C1C=CCCN1 4H48-1-1N [1,0,0,0,0,0|1,0,2]=4 63 B7R1.3 OC1C=CCCC1 2402-1-01 [1,0,0,0,0,0|1,0,1]=3 64 B7R1.3 OC1CCSCC1 6H02-1-00 [1,0,0,0,0,0|1,0,2]=4 65 B7R1.3 ON1CCCCC1 4H47-1-0H [1,0,0,0,0,0|1,0,1]=3 66 B7R1.3 S=C1NCCCN1 7H67-1-X0 [1,0,0,0,0,0|2,1,0]=4 67 B7R1.3 SC1CCNCC1 7H61-5-02 [1,0,0,0,0,0|1,1,1]=4 68 B9R1.2 CC1CCCC(CO)N1 4H56-1-JN [0,1,0,0,0,0|1,0,2]=4 69 B9R1.2 CCC1CCCC(=O)N1 4H48-1-CF [0,1,0,0,0,0|1,0,0]=2 70 B9R1.2 CCN1CCCC(N)C1 3H32-1-N1 [0,1,0,0,0,0|2,0,1]=4 71 B9R1.2 CCN1CCCC(O)C1 4H01-1-BE [0,1,0,0,0,0|1,0,2]=4 72 B9R1.2 CN1CCCC(CCl)C1 3H32-5-6E [0,1,0,0,0,0|2,0,0]=3 73 B9R1.2 CN1CCC[C@@H](CBr)C1 3H32-9-R0 [0,1,0,0,0,0|2,0,0]=3 74 B9R1.2 CN1CCC[C@@H](CN)C1 3H30-5-39 [0,1,0,0,0,0|2,0,0]=3 75 B9R1.2 CN1CCC[C@@H](CO)C1 4H56-1-R2 [0,1,0,0,0,0|2,0,0]=3 76 B9R1.2 CN1CCC[C@H](CBr)C1 3H32-9-S0 [0,1,0,0,0,0|2,0,0]=3 77 B9R1.2 CN1CCC[C@H](CN)C1 3H30-5-R2 [0,1,0,0,0,0|2,0,0]=3 78 B9R1.2 CN1CCC[C@H](CO)C1 4H56-1-S5 [0,1,0,0,0,0|2,0,0]=3 79 B9R1.2 CN1CCOC(CN)C1 4H56-1-0MP [0,1,0,0,0,0|3,0,0]=4 80 B9R1.2 CN1CCO[C@H](CO)C1 4H01-1-S0 [0,1,0,0,0,0|3,0,0]=4 81 B9R1.2 CNC1CCCC(O)C1 4256-1-0X [0,1,0,0,0,0|0,0,2]=3 82 B9R1.2 NCC1CCNC(=O)C1 4H48-1-BL [0,1,0,0,0,0|1,0,0]=2 83 B9R1.2 O=C1CCCC(CO)N1 4H48-1-CE [0,1,0,0,0,0|1,0,0]=2 84 B9R1.2 O=C1CCC[C@@H](CO)N1 4H31-1-S0 [0,1,0,0,0,0|1,0,0]=2 85 B9R1.2 O=C1CCC[C@H](CO)N1 4H31-1-R0 [0,1,0,0,0,0|1,0,0]=2 86 B9R1.3 CC1C(=O)CCCC1=O 2218-1-02 [0,1,0,0,0,0|1,0,1]=3 87 B9R1.3 CC1CCCC(C)C1O 2202-1-0X [0,1,0,0,0,0|1,0,1]=3 88 B9R1.3 CC1CCCC(O)C1C 2202-1-0U [0,1,0,0,0,0|0,0,2]=3 89 B9R1.3 CN1C(=O)CCCC1=O 4H48-1-0Z [0,1,0,0,0,0|2,0,1]=4 90 B9R1.3 O=C1CCCC(O)=C1Cl 2420-5-01 [0,1,0,0,0,0|1,0,2]=4 91 B9R1.34 CC1CC(=O)CC(C)C1 2217-1-1B [0,1,0,0,0,0|0,0,0]=1 92 B9R1.34 CC1CC(=O)CC(C)O1 P612-A-15 [0,1,0,0,0,0|1,0,0]=2 93 B9R1.34 CC1CC(C)CC(O)C1 2202-1-0K [0,1,0,0,0,0|0,0,2]=3 94 B9R1.34 C[C@@H]1CC(=O)C[C@@H](C)O1 2H17-1-86 [0,1,0,0,0,0|1,0,0]=2 95 B9R1.66 CC1(C)CC(=O)CCO1 2H17-1-0A [0,1,0,0,0,0|1,0,0]=2 96 B9R1.66 CC1(C)CC(O)CCO1 2H02-1-05 [0,1,0,0,0,0|1,0,2]=4 97 B9R1.66 CC1(C)CCCC(=O)C1 2217-1-32 [0,1,0,0,0,0|0,0,0]=1 98 B9R1.66 CC1(C)CS(=O)CCN1 8H65-1-02 [0,1,0,0,0,0|2,0,0]=3 99 B9R1.66 CC1(C)CS(=O)CCN1 8H65-5-01 [0,1,0,0,0,0|2,0,0]=3 100 B9R1.66 O=C1CCCS(=O)(=O)N1 8H69-1-Y2 [0,1,0,0,0,0|3,0,0]=4 101 B9R1.69 CC1CCC(=O)CC1C 2217-1-1C [0,1,0,0,0,0|0,0,0]=1 102 B9R1.69 CC1CCC(=O)N(C)C1 4H48-1-0A3 [0,1,0,0,0,0|2,0,1]=4 103 B9R1.69 CC1CCC(C)C(O)C1 2202-1-0P [0,1,0,0,0,0|0,0,2]=3 104 B9R1.69 CC1CCC(O)CC1C 2202-1-0R [0,1,0,0,0,0|0,0,2]=3 105 B9R1.69 CC1CN(C)CCC1=O 4H17-1-18 [0,1,0,0,0,0|2,0,1]=4 106 B9R1.69 CN1CCC(N)CC1=O 4H56-5-44 [0,1,0,0,0,0|2,0,0]=3 107 B9R1.69 C[C@H]1CN(C)[C@H](C)CN1 4H22-1-32 [0,1,0,0,0,0|3,0,0]=4 108 B9R1.69 C[C@H]1CN[C@H](C)CN1C 4H22-1-33 [0,1,0,0,0,0|3,0,0]=4 109 B7R0.2 C=CC(=O)NC(C)C 4348-1-0G [0,0,1,0,0,0|1,0,2]=4 110 B7R0.2 C=CC(C)OC(C)=O 2323-1-1F [0,0,1,0,0,0|1,0,2]=4 111 B7R0.2 CC(=O)NC(C)CN 4148-1-0B [0,0,1,0,0,0|2,0,0]=3 112 B7R0.2 CC(=O)NC(C)CN 4148-5-0L [0,0,1,0,0,0|2,0,0]=3 113 B7R0.2 CC(=O)OC(Br)CBr 2123-9-21 [0,0,1,0,0,0|3,0,0]=4 114 B7R0.2 CC(C)C[C@H](N)CO 4156-1-S6 [0,0,1,0,0,0|2,0,1]=4 115 B7R0.2 CC(C)NC(=O)CCl 4148-5-X2 [0,0,1,0,0,0|2,0,0]=3 116 B7R0.2 CC(C)NC(=O)CN 4548-5-X0 [0,0,1,0,0,0|2,0,0]=3 117 B7R0.2 CC(C)OC(=O)CBr 2123-9-39 [0,0,1,0,0,0|2,0,0]=3 118 B7R0.2 CC(C)OC(=O)CCl 2123-5-1F [0,0,1,0,0,0|2,0,0]=3 119 B7R0.2 CC(C)OC(=O)CN 4158-5-0F [0,0,1,0,0,0|2,0,0]=3 120 B7R0.2 CC(C)OC(=O)CO 2129-1-0W [0,0,1,0,0,0|2,0,0]=3 121 B7R0.2 CC(CN)CC(=O)O 4157-5-12 [0,0,1,0,0,0|2,0,0]=3 122 B7R0.2 CCC(=O)CC(=O)O 2129-1-1N [0,0,1,0,0,0|2,0,1]=4 123 B7R0.2 CCC(=O)CC(C)=O 2118-1-09 [0,0,1,0,0,0|1,0,1]=3 124 B7R0.2 CCC(=O)CC(C)C 2117-1-0D [0,0,1,0,0,0|0,0,0]=1 125 B7R0.2 CCC(C)CC(=O)O 2121-1-00 [0,0,1,0,0,0|1,0,0]=2 126 B7R0.2 CCC(C)CC(C)C 1100-1-24 [0,0,1,0,0,0|1,0,1]=3 127 B7R0.2 CCC(C)OC(=O)Cl 2116-5-08 [0,0,1,0,0,0|2,0,0]=3 128 B7R0.2 CCC(N)CC(=O)O 4157-1-20 [0,0,1,0,0,0|2,0,0]=3 129 B7R0.2 CC[C@@H](N)CC(=O)O 4156-5-R2 [0,0,1,0,0,0|2,0,0]=3 130 B7R0.2 CC[C@H](C)CC(=O)O 2121-1-S4 [0,0,1,0,0,0|1,0,0]=2 131 B7R0.2 CN(C)CC(=O)NN 4139-5-01 [0,0,1,0,0,0|3,0,0]=4 132 B7R0.2 COC(=O)C=C(C)C 2324-1-25 [0,0,1,0,0,0|1,0,2]=4 133 B7R0.2 COC(=O)CN(C)C 4158-5-0L [0,0,1,0,0,0|2,0,0]=3 134 B7R0.2 COC(=O)C[C@@H](C)N 4158-5-R2 [0,0,1,0,0,0|2,0,0]=3 135 B7R0.2 COC(=O)C[C@H](C)N 4158-5-S2 [0,0,1,0,0,0|2,0,0]=3 136 B7R0.2 COC(=O)C[C@H](C)O 2129-1-62 [0,0,1,0,0,0|2,0,0]=3 137 B7R0.2 NCC(O)CC(=O)O 4157-1-14 [0,0,1,0,0,0|3,0,0]=4 138 B7R0.4 C=C(Br)CCCCC 1300-9-09 [0,0,1,0,0,0|1,0,1]=3 139 B7R0.4 C=C(C)CCCC#N 3337-1-X0 [0,0,1,0,0,0|2,0,1]=4 140 B7R0.4 C=C(C)CCCCC 1300-1-36 [0,0,1,0,0,0|1,0,0]=2 141 B7R0.4 C=C(Cl)CCCCC 1300-5-27 [0,0,1,0,0,0|1,0,1]=3 142 B7R0.4 C=CCCCC(=O)O 2321-1-0P [0,0,1,0,0,0|1,0,2]=4 143 B7R0.4 C=CCCOC(C)=O 2323-1-1E [0,0,1,0,0,0|1,0,2]=4 144 B7R0.4 C=CCOCC(C)F 2307-3-00 [0,0,1,0,0,0|3,0,0]=4 145 B7R0.4 CC(=O)CCCC#N 4137-1-0V [0,0,1,0,0,0|1,0,1]=3 146 B7R0.4 CC(=O)CCCCCl 2117-5-05 [0,0,1,0,0,0|1,0,0]=2 147 B7R0.4 CC(=O)COCCBr 2117-9-07 [0,0,1,0,0,0|2,0,0]=3 148 B7R0.4 CC(=O)COCCCl 2117-5-0B [0,0,1,0,0,0|2,0,0]=3 149 B7R0.4 CC(=O)NCCCN 4148-5-0D [0,0,1,0,0,0|2,0,0]=3 150 B7R0.4 CC(=O)NCCCO 4156-1-Y9 [0,0,1,0,0,0|2,0,0]=3 151 B7R0.4 CC(=O)OCCCCl 2123-5-0U [0,0,1,0,0,0|2,0,0]=3 152 B7R0.4 CC(=O)OCCCF 2123-3-1D [0,0,1,0,0,0|2,0,0]=3 153 B7R0.4 CC(C)=CCOC=O 2323-1-28 [0,0,1,0,0,0|1,0,2]=4 154 B7R0.4 CC(C)NCCCO 4156-1-3T [0,0,1,0,0,0|1,0,2]=4 155 B7R0.4 CC(C)OCCCCl 2107-5-0Y [0,0,1,0,0,0|2,0,1]=4 156 B7R0.4 CC(C)OCCCF 2107-3-6X [0,0,1,0,0,0|2,0,1]=4 157 B7R0.4 CCCCC=C(F)F 1300-3-97 [0,0,1,0,0,0|2,0,1]=4 158 B7R0.4 CCCCCC(C)=O 2117-1-14 [0,0,1,0,0,0|0,0,0]=1 159 B7R0.4 CCCCCC(C)N 3130-1-X7 [0,0,1,0,0,0|1,0,1]=3 160 B7R0.4 CCCCCC(C)O 2102-1-05 [0,0,1,0,0,0|0,0,2]=3 161 B7R0.4 CCCCCC(N)=O 4148-1-1F [0,0,1,0,0,0|1,0,0]=2 162 B7R0.4 CCCCOC(=O)Cl 2116-5-31 [0,0,1,0,0,0|2,0,0]=3 163 B7R0.4 CCCCOC(N)=O 4156-1-2H [0,0,1,0,0,0|2,0,0]=3 164 B7R0.4 CCCCO[N+](=O)[O-] 4154-1-0C [0,0,1,0,0,0|3,0,0]=4 165 B7R0.4 CCCCSC(C)=O 6166-1-0F [0,0,1,0,0,0|1,0,0]=2 166 B7R0.4 CCCOCC(=O)O 2121-1-0F [0,0,1,0,0,0|2,0,0]=3 167 B7R0.4 CCCOCC(C)F 2107-3-7Q [0,0,1,0,0,0|2,0,1]=4 168 B7R0.4 CCC\C=C\C(C)=O 2317-1-0B [0,0,1,0,0,0|0,0,2]=3 169 B7R0.4 CCOCCC(=O)O 2121-1-0E [0,0,1,0,0,0|2,0,0]=3 170 B7R0.4 CN(C)CCCC#N 3137-1-0C [0,0,1,0,0,0|2,0,1]=4 171 B7R0.4 CN(C)CCCCN 3132-1-00 [0,0,1,0,0,0|2,0,1]=4 172 B7R0.4 CN(C)CCCCO 4132-1-04 [0,0,1,0,0,0|1,0,2]=4 173 B7R0.4 CNCCNC(C)C 3131-1-20 [0,0,1,0,0,0|3,0,0]=4 174 B7R0.4 COCCCC(=O)O 2121-1-51 [0,0,1,0,0,0|2,0,0]=3 175 B7R0.4 COCCCN(C)C 4156-1-53 [0,0,1,0,0,0|3,0,0]=4 176 B7R0.4 COCCNC(C)C 4156-1-3P [0,0,1,0,0,0|3,0,0]=4 177 B7R0.4 C\C=C\CCC(=O)O 2321-1-X1 [0,0,1,0,0,0|1,0,2]=4 178 B7R0.4 N#CCCCC(=O)O 4137-1-0M [0,0,1,0,0,0|2,0,1]=4 179 B7R0.4 NCCCCC(=O)O 4157-1-22 [0,0,1,0,0,0|2,0,0]=3 180 B7R0.4 NOCCCC(=O)O 4147-9-01 [0,0,1,0,0,0|3,0,0]=4 181 B7R0.4 O=C(Cl)CCCCBr 2116-D-X0 [0,0,1,0,0,0|2,0,0]=3 182 B7R0.4 O=C(Cl)OCCCCl 2123-5-0S [0,0,1,0,0,0|3,0,0]=4 183 B7R0.4 O=C(O)CCCCCl 2121-5-05 [0,0,1,0,0,0|2,0,0]=3 184 B7R0.4 O=C(O)COCCCl 2121-5-01 [0,0,1,0,0,0|3,0,0]=4 185 B7R0.4 O=C([O-])CCCCO 2129-1-1E [0,0,1,0,0,0|2,0,0]=3 186 B7R0.4 [C-]#[N+]CCCN(C)C 3137-1-0F [0,0,1,0,0,0|3,0,0]=4 187 B7R0.7 C=CCC(=O)OCC 2323-1-0W [0,0,1,0,0,0|1,0,2]=4 188 B7R0.7 CC(CCBr)CCBr 1100-9-30 [0,0,1,0,0,0|2,0,1]=4 189 B7R0.7 CC(CCO)CCO 2104-1-0E [0,0,1,0,0,0|1,0,2]=4 190 B7R0.7 CCCC(=O)OCCl 2123-5-X1 [0,0,1,0,0,0|2,0,0]=3 191 B7R0.7 CCCC(C)CCO 2101-1-0B [0,0,1,0,0,0|0,0,2]=3 192 B7R0.7 CCCC(C)SC#N 7168-1-W1 [0,0,1,0,0,0|2,0,1]=4 193 B7R0.7 CCCC(N)CCC 3130-1-00 [0,0,1,0,0,0|1,0,1]=3 194 B7R0.7 CCCC(O)CCC 2102-1-12 [0,0,1,0,0,0|0,0,2]=3 195 B7R0.7 CCNC(=O)CNC 4158-1-X0 [0,0,1,0,0,0|2,0,0]=3 196 B7R0.7 CCNC(=O)NCC 4153-1-09 [0,0,1,0,0,0|2,0,0]=3 197 B7R0.7 CCNC(=S)NCC 7167-1-0A [0,0,1,0,0,0|2,1,0]=4 198 B7R0.7 CCOC(=O)CCBr 2123-9-0K [0,0,1,0,0,0|2,0,0]=3 199 B7R0.7 CCOC(=O)CCCl 2126-5-X3 [0,0,1,0,0,0|2,0,0]=3 200 B7R0.7 CCOC(=O)CNC 4158-5-0H [0,0,1,0,0,0|2,0,0]=3 201 B7R0.7 CCOC(=O)COC 2123-1-55 [0,0,1,0,0,0|2,0,0]=3 202 B7R0.7 CCOC(=O)CSC 6166-1-0E [0,0,1,0,0,0|2,0,0]=3 203 B7R0.7 CCOC(=O)OCCl 2128-5-0S [0,0,1,0,0,0|3,0,0]=4 204 B7R0.7 CCSC(=O)SCC 6166-1-0G [0,0,1,0,0,0|2,0,0]=3 205 B7R0.7 [C-]#[N+]CC(=O)OCC 4137-1-Z0 [0,0,1,0,0,0|2,0,1]=4 206 B9R2.39 CN1C[C@H]2C[C@@H]1CN2 3H32-9-R1 [0,0,0,1,0,0|3,0,0]=4 207 B9R2.39 N[C@@H]1C[C@H]2CC[C@H]1C2 3230-1-0C [0,0,0,1,0,0|1,0,1]=3 208 B9R2.39 O=C1CC2CCC1C2 2217-1-39 [0,0,0,1,0,0|0,0,0]=1 209 B9R2.39 O=C1NC2CCC1C2 4H48-1-CD [0,0,0,1,0,0|1,0,0]=2 210 B9R2.39 O=C1OC2CCC1C2 2H25-1-2A [0,0,0,1,0,0|1,0,0]=2 211 B9R2.39 OC1CC2CCC1C2 2202-1-07 [0,0,0,1,0,0|0,0,2]=3 212 B9R2.39 OC1CC2CCC1O2 2H10-1-24 [0,0,0,1,0,0|1,0,2]=4 213 B9R2.39 [C@@H]12CC[C@@H](C[C@@H]1Br)C2 1200-9-0B [0,0,0,1,0,0|1,0,1]=3 214 B9R2.39 [C@H]12CC[C@@H](C1)[C@H](O)C2 2202-1-1B [0,0,0,1,0,0|0,0,2]=3 215 B9R2.68 C1CC2CCC(C1)N2 3H31-1-2B [0,0,0,1,0,0|2,0,1]=4 216 B9R2.68 C1CC2CCC(C1)N2 3H31-5-30 [0,0,0,1,0,0|2,0,1]=4 217 B9R2.68 C1CN2CCC(C2)N1 3H31-5-2J [0,0,0,1,0,0|3,0,0]=4 218 B9R2.109 O=C1CCCC2CC12 2217-1-1P [0,0,0,1,0,0|0,0,0]=1 219 B9R2.109 O=C1CCCC2OC12 2217-1-0U [0,0,0,1,0,0|1,0,0]=2 220 B7R1.2 CC1=CC(=O)CO1 2H17-1-80 [0,0,0,0,1,0|1,0,2]=4 221 B7R1.2 CC1CC(=O)CN1 4H17-5-3T [0,0,0,0,1,0|1,0,0]=2 222 B7R1.2 CC1CCC(C)N1 3H31-1-33 [0,0,0,0,1,0|2,0,1]=4 223 B7R1.2 CC1CCC(C)O1 2H10-1-1C [0,0,0,0,1,0|2,0,1]=4 224 B7R1.2 CC1CNC(=O)C1 4H48-1-HT [0,0,0,0,1,0|1,0,0]=2 225 B7R1.2 CC1COC(=O)O1 2H28-1-01 [0,0,0,0,1,0|2,0,0]=3 226 B7R1.2 CC1COS(=O)O1 6H67-1-00 [0,0,0,0,1,0|3,0,0]=4 227 B7R1.2 CN1CCC(N)C1 3H30-1-DV [0,0,0,0,1,0|2,0,1]=4 228 B7R1.2 C[C@@H]1CC[C@@H](C)N1 3H31-1-R6 [0,0,0,0,1,0|2,0,1]=4 229 B7R1.2 C[C@@H]1COC(=O)N1 4H48-1-RL [0,0,0,0,1,0|2,0,0]=3 230 B7R1.2 C[C@@H]1COC(=O)O1 2H26-1-R1 [0,0,0,0,1,0|2,0,0]=3 231 B7R1.2 C[C@H]1COC(=O)N1 4H48-1-SL [0,0,0,0,1,0|2,0,0]=3 232 B7R1.2 C[C@H]1COC(=O)O1 2H28-1-S1 [0,0,0,0,1,0|2,0,0]=3 233 B7R1.2 NC1CCC(O)C1 4256-5-48 [0,0,0,0,1,0|1,0,2]=4 234 B7R1.2 NC1CNC(=O)C1 4H48-5-BD [0,0,0,0,1,0|2,0,0]=3 235 B7R1.2 N[C@H]1CC[C@@H](O)C1 4256-5-02 [0,0,0,0,1,0|1,0,2]=4 236 B7R1.2 O=C1C=CC(O)C1 2420-1-07 [0,0,0,0,1,0|1,0,2]=4 237 B7R1.2 O=C1C[C@@H](O)CN1 4H48-1-59 [0,0,0,0,1,0|2,0,0]=3 238 B7R1.2 O=C1C[C@@H](O)CO1 2H25-1-R1 [0,0,0,0,1,0|2,0,0]=3 239 B7R1.2 O=C1OCC(Br)O1 2H28-9-02 [0,0,0,0,1,0|3,0,0]=4 240 B7R1.2 O=C1OCC(Cl)O1 2H28-1-00 [0,0,0,0,1,0|3,0,0]=4 241 B7R1.4 BrC1=C(Br)CCC1 1400-9-X1 [0,0,0,0,1,0|2,0,1]=4 242 B7R1.4 C=C1CCOC1=O 2H25-1-2M [0,0,0,0,1,0|1,0,2]=4 243 B7R1.4 CC1CCOC1=O 2H25-1-2B [0,0,0,0,1,0|1,0,0]=2 244 B7R1.4 CC1OCCC1=O 2H17-1-Y3 [0,0,0,0,1,0|1,0,0]=2 245 B7R1.4 CC1SCCC1=O 6H66-1-68 [0,0,0,0,1,0|1,0,0]=2 246 B7R1.4 CN1CC=CC1=O 4H48-1-CT [0,0,0,0,1,0|1,0,2]=4 247 B7R1.4 CN1CCCC1=S 7H67-1-0J [0,0,0,0,1,0|1,1,0]=3 248 B7R1.4 CN1CCNC1=O 4H48-1-00C [0,0,0,0,1,0|2,0,0]=3 249 B7R1.4 CN1CCNC1=S 7H67-1-57 [0,0,0,0,1,0|2,1,0]=4 250 B7R1.4 CN1CCOC1=O 4H48-1-05F [0,0,0,0,1,0|2,0,0]=3 251 B7R1.4 NC1CCCC1Cl 3230-5-06 [0,0,0,0,1,0|2,0,1]=4 252 B7R1.4 NC1CCNC1=O 4H48-1-7A [0,0,0,0,1,0|2,0,0]=3 253 B7R1.4 NC1CCOC1=O 4H30-9-02 [0,0,0,0,1,0|2,0,0]=3 254 B7R1.4 NN1CCOC1=O 4H30-5-32 [0,0,0,0,1,0|3,0,0]=4 255 B7R1.4 N[C@@H]1CCC[C@@H]1O 4256-1-46 [0,0,0,0,1,0|1,0,2]=4 256 B7R1.4 N[C@@H]1CCC[C@@H]1O 4256-5-24 [0,0,0,0,1,0|1,0,2]=4 257 B7R1.4 N[C@@H]1CCC[C@H]1O 4256-5-41 [0,0,0,0,1,0|1,0,2]=4 258 B7R1.4 N[C@@H]1CCNC1=O 4H48-5-61 [0,0,0,0,1,0|2,0,0]=3 259 B7R1.4 N[C@@H]1CCOC1=O 4H58-5-4W [0,0,0,0,1,0|2,0,0]=3 260 B7R1.4 N[C@H]1CCC[C@@H]1O 4H56-5-E1 [0,0,0,0,1,0|1,0,2]=4 261 B7R1.4 N[C@H]1CCC[C@@H]1O 4H56-5-S6 [0,0,0,0,1,0|1,0,2]=4 262 B7R1.4 N[C@H]1CCC[C@H]1O 4256-5-23 [0,0,0,0,1,0|1,0,2]=4 263 B7R1.4 N[C@H]1CCNC1=O 4H30-1-S1 [0,0,0,0,1,0|2,0,0]=3 264 B7R1.4 N[C@H]1CCOC1=O 4H58-5-SB [0,0,0,0,1,0|2,0,0]=3 265 B7R1.4 O=C1CCC=C1Br 2417-9-01 [0,0,0,0,1,0|1,0,2]=4 266 B7R1.4 O=C1NCCC1Br 4H48-9-0N [0,0,0,0,1,0|2,0,0]=3 267 B7R1.4 O=C1NCC[C@@H]1O 4H20-1-03 [0,0,0,0,1,0|2,0,0]=3 268 B7R1.4 O=C1NCC[C@H]1O 4H48-1-R2 [0,0,0,0,1,0|2,0,0]=3 269 B7R1.4 O=C1OCC[C@H]1O 2H29-1-R0 [0,0,0,0,1,0|2,0,0]=3 270 B7R1.4 OC1CCCC1O 2204-1-12 [0,0,0,0,1,0|1,0,2]=4 271 B7R1.4 O[C@H]1CCC[C@@H]1O 2204-1-0K [0,0,0,0,1,0|1,0,2]=4 272 B9R1.48 CC1CC(=O)NCCN1 4H48-1-BD [0,0,0,0,0,1|1,0,0]=2 273 B9R1.48 O=C1CCCCC(=O)C1 2218-1-0J [0,0,0,0,0,1|1,0,1]=3 274 B9R1.48 O=C1CCCCC(=O)N1 4H48-1-KX [0,0,0,0,0,1|2,0,1]=4 275 B9R1.48 O=C1CCCCC(=O)O1 2H26-1-11 [0,0,0,0,0,1|2,0,1]=4 276 B9R1.49 CN1CCCC(=O)CC1 4H56-5-AU [0,0,0,0,0,1|1,0,0]=2 277 B9R1.49 CN1CCCC(O)CC1 4H01-5-2K [0,0,0,0,0,1|1,0,2]=4 278 B9R1.49 CN1CCNC(=O)CC1 4H48-1-1Z [0,0,0,0,0,1|2,0,0]=3 279 B9R1.49 O=C1CCC(O)CCN1 4H48-1-1G [0,0,0,0,0,1|2,0,0]=3 280 B6R0.1 CCC(=O)CC#N 4137-1-Y8 [1,0,1,0,0,0|1,0,1]=4 281 B6R0.1 CCCC(Br)CC 1100-9-36 [1,0,1,0,0,0|1,0,1]=4 282 B6R0.1 CCCC(C)C=O 2115-1-12 [1,0,1,0,0,0|0,0,0]=2 283 B6R0.1 CCCC(C)NC 3131-5-06 [1,0,1,0,0,0|1,0,1]=4 284 B6R0.1 CCCC(O)CC 2102-1-08 [1,0,1,0,0,0|0,0,2]=4 285 B6R0.1 CCCC(O)CN 4156-1-94 [1,0,1,0,0,0|2,0,0]=4 286 B6R0.1 CCC[C@@H](N)CO 4156-1-72 [1,0,1,0,0,0|1,0,1]=4 287 B6R0.1 CCC[C@H](N)CO 4156-1-70 [1,0,1,0,0,0|1,0,1]=4 288 B6R0.1 CCNC(=O)CC 4148-1-0X [1,0,1,0,0,0|1,0,0]=3 289 B6R0.1 CCNC(=O)CCl 4148-5-0H [1,0,1,0,0,0|2,0,0]=4 290 B6R0.1 CCOC(=O)NC 4156-1-3N [1,0,1,0,0,0|2,0,0]=4 291 B6R0.1 CCOC(=O)OC 2128-1-05 [1,0,1,0,0,0|2,0,0]=4 292 B6R0.1 CCOC(C)CC 2107-1-0C [1,0,1,0,0,0|1,0,1]=4 293 B6R0.1 CCSC(=O)CC 6166-1-0B [1,0,1,0,0,0|1,0,0]=3 294 B6R0.1 CC[C@H](C)CCO 2101-1-S3 [1,0,1,0,0,0|0,0,2]=4 295 B6R0.1 CN(C=O)CCO 4156-1-0X [1,0,1,0,0,0|2,0,0]=4 296 B6R0.1 CNC(=O)CCN 4148-5-01 [1,0,1,0,0,0|2,0,0]=4 297 B6R0.1 COC(=O)CCBr 2123-9-0J [1,0,1,0,0,0|2,0,0]=4 298 B6R0.1 COC(=O)CCS 6161-1-04 [1,0,1,0,0,0|2,0,0]=4 299 B6R0.1 COCC(C)OC 2108-1-0D [1,0,1,0,0,0|2,0,0]=4 300 B6R0.1 C[C@H](CO)CCO 2104-1-S4 [1,0,1,0,0,0|1,0,1]=4 301 B6R0.2 C=C(Br)CC(C)C 1300-9-16 [1,0,1,0,0,0|1,0,1]=4 302 B6R0.2 CC(=O)OC(C)Br 2123-9-25 [1,0,1,0,0,0|2,0,0]=4 303 B6R0.2 CC(C)CC(=O)O 2121-1-18 [1,0,1,0,0,0|1,0,0]=3 304 B6R0.2 CC(C)CC(C)Cl 1100-5-09 [1,0,1,0,0,0|1,0,1]=4 305 B6R0.2 CC(C)NC(N)=O 4153-1-10 [1,0,1,0,0,0|2,0,0]=4 306 B6R0.2 CC(C)OC(N)=O 4156-1-2S [1,0,1,0,0,0|2,0,0]=4 307 B6R0.2 CC(C)SC(=O)Cl 6166-5-00 [1,0,1,0,0,0|2,0,0]=4 308 B6R0.2 CC(Cl)CC(=O)O 2121-5-09 [1,0,1,0,0,0|2,0,0]=4 309 B6R0.2 CN(C)CC(=O)O 4158-1-41 [1,0,1,0,0,0|2,0,0]=4 310 B6R0.2 C[C@@H](N)CC(=O)O 4157-1-12 [1,0,1,0,0,0|2,0,0]=4 311 B6R0.2 C[C@H](N)CC(=O)O 4157-5-06 [1,0,1,0,0,0|2,0,0]=4 312 B6R0.4 C=C(Br)CCCC 1300-9-19 [1,0,1,0,0,0|1,0,1]=4 313 B6R0.4 C=CCC[C@H](C)O 2302-1-S1 [1,0,1,0,0,0|1,0,1]=4 314 B6R0.4 CC(=O)CCCBr 2117-9-0A [1,0,1,0,0,0|1,0,0]=3 315 B6R0.4 CC(=O)OCCBr 2123-9-24 [1,0,1,0,0,0|2,0,0]=4 316 B6R0.4 CC(=O)OCCCl 2123-5-0M [1,0,1,0,0,0|2,0,0]=4 317 B6R0.4 CC(C)CCCCl 1100-5-44 [1,0,1,0,0,0|1,0,0]=3 318 B6R0.4 CC(C)CON=O 4145-1-01 [1,0,1,0,0,0|2,0,0]=4 319 B6R0.4 CC(C)NCCCl 3131-5-07 [1,0,1,0,0,0|2,0,0]=4 320 B6R0.4 CC(C)OCCBr 2107-9-09 [1,0,1,0,0,0|2,0,0]=4 321 B6R0.4 CC(C)OCCCl 2107-5-0P [1,0,1,0,0,0|2,0,0]=4 322 B6R0.4 CC(F)COC=O 2123-3-0J [1,0,1,0,0,0|2,0,0]=4 323 B6R0.4 CCCCC(=N)N 3141-1-03 [1,0,1,0,0,0|2,0,0]=4 324 B6R0.4 CCCCC(=O)Br 2116-9-0A [1,0,1,0,0,0|1,0,0]=3 325 B6R0.4 CCCCC(C)=O 2117-1-11 [1,0,1,0,0,0|0,0,0]=2 326 B6R0.4 CCCCC(C)O 2102-1-07 [1,0,1,0,0,0|0,0,2]=4 327 B6R0.4 CCCCC(N)=O 4148-1-0P [1,0,1,0,0,0|1,0,0]=3 328 B6R0.4 CCCC[C@@H](C)N 3130-1-R0 [1,0,1,0,0,0|1,0,1]=4 329 B6R0.4 CCCC[C@H](C)N 3130-1-S0 [1,0,1,0,0,0|1,0,1]=4 330 B6R0.4 CCCC[C@H](C)O 2102-1-S0 [1,0,1,0,0,0|0,0,2]=4 331 B6R0.4 CCCNC(C)C 3131-1-0E [1,0,1,0,0,0|1,0,1]=4 332 B6R0.4 CCCNC(N)=O 4153-1-00 [1,0,1,0,0,0|2,0,0]=4 333 B6R0.4 CCCOC(=O)Cl 2116-5-30 [1,0,1,0,0,0|2,0,0]=4 334 B6R0.4 CCCOC(N)=O 4156-1-2G [1,0,1,0,0,0|2,0,0]=4 335 B6R0.4 CCCSC(C)=O 6166-1-0A [1,0,1,0,0,0|1,0,0]=3 336 B6R0.4 CCNCC(=O)O 4158-1-76 [1,0,1,0,0,0|2,0,0]=4 337 B6R0.4 CCOCC(=O)O 2121-1-20 [1,0,1,0,0,0|2,0,0]=4 338 B6R0.4 CCOCC(C)F 2107-3-8K [1,0,1,0,0,0|2,0,0]=4 339 B6R0.4 CN(C)CCCN 3130-1-27 [1,0,1,0,0,0|2,0,0]=4 340 B6R0.4 CNCCC(=O)O 4157-1-11 [1,0,1,0,0,0|2,0,0]=4 341 B6R0.4 COCCC(=O)Cl 2116-5-0C [1,0,1,0,0,0|2,0,0]=4 342 B6R0.4 COCCC(=O)O 2123-1-63 [1,0,1,0,0,0|2,0,0]=4 343 B6R0.4 CSCCC(=O)Cl 6166-5-01 [1,0,1,0,0,0|2,0,0]=4 344 B6R0.4 CSCCC(C)=O 6166-1-0J [1,0,1,0,0,0|1,0,0]=3 345 B6R0.4 O=C(Cl)CCCBr 2116-D-01 [1,0,1,0,0,0|2,0,0]=4 346 B6R0.4 O=C(O)CCCBr 2121-9-05 [1,0,1,0,0,0|2,0,0]=4 347 B6R0.6 C#CCCCCC 1500-1-X0 [1,0,1,0,0,0|0,0,2]=4 348 B6R0.6 C=CCCCCC 1300-1-X2 [1,0,1,0,0,0|0,0,1]=3 349 B6R0.6 C=CCCCCCl 1300-5-14 [1,0,1,0,0,0|1,0,1]=4 350 B6R0.6 CC#CCCCC 1500-1-10 [1,0,1,0,0,0|0,0,2]=4 351 B6R0.6 CCCCCCI 1100-H-17 [1,0,1,0,0,0|1,0,1]=4 352 B6R0.6 CCCCCCN 3130-1-07 [1,0,1,0,0,0|1,0,1]=4 353 B6R0.6 CCCCCCS 5161-1-02 [1,0,1,0,0,0|0,1,1]=4 354 B6R0.6 CCCCCNC 3131-1-15 [1,0,1,0,0,0|1,0,0]=3 355 B6R0.6 CCCCC[Mg]Br 9612-9-02 [1,0,1,0,0,0|2,0,0]=4 356 B6R0.6 CCCCC[Mg]Br 9612-9-03 [1,0,1,0,0,0|2,0,0]=4 357 B6R0.6 CCCCC[Mg]Cl 9112-5-0J [1,0,1,0,0,0|2,0,0]=4 358 B6R0.6 CCCCC[Mg]Cl 9112-5-0K [1,0,1,0,0,0|2,0,0]=4 359 B6R0.6 CCCNCCC 3131-1-18 [1,0,1,0,0,0|1,0,0]=3 360 B6R0.6 CCCNCCO 4131-1-02 [1,0,1,0,0,0|2,0,0]=4 361 B6R0.6 CCCNNCC 3131-5-03 [1,0,1,0,0,0|2,0,0]=4 362 B6R0.6 CCCOCCBr 2107-9-0A [1,0,1,0,0,0|2,0,0]=4 363 B6R0.6 CCCOCCCl 2107-5-0N [1,0,1,0,0,0|2,0,0]=4 364 B6R0.6 CCCOCCN 4156-1-0G [1,0,1,0,0,0|2,0,0]=4 365 B6R0.6 CCCSCCC 5166-1-01 [1,0,1,0,0,0|1,0,0]=3 366 B6R0.6 CCC\C=C\C=O 2315-1-08 [1,0,1,0,0,0|0,0,2]=4 367 B6R0.6 COCCCCBr 2107-9-04 [1,0,1,0,0,0|2,0,0]=4 368 B6R0.6 COCCCCCl 2107-5-14 [1,0,1,0,0,0|2,0,0]=4 369 B6R0.6 O=CCCCC=O 2115-1-07 [1,0,1,0,0,0|1,0,1]=4 370 B6R0.6 O=CCCCCCl 2115-5-00 [1,0,1,0,0,0|1,0,0]=3 371 B6R0.6 O=CCCCCO 2120-1-05 [1,0,1,0,0,0|1,0,0]=3 372 B6R0.6 O=COCCCCl 2123-5-0V [1,0,1,0,0,0|2,0,0]=4 373 B6R0.6 O=COCCCF 2123-3-1F [1,0,1,0,0,0|2,0,0]=4 374 B6R1.1 C1=CCNCC1 3431-5-01 [2,0,0,0,0,0|1,0,1]=4 375 B6R1.1 C1=CCNCC1 3H31-1-41 [2,0,0,0,0,0|1,0,1]=4 376 B6R1.1 C1CCCCC1 1200-1-06EG [2,0,0,0,0,0|0,0,1]=3 377 B6R1.1 C1CCNCC1 3H31-5-74 [2,0,0,0,0,0|1,0,0]=3 378 B6R1.1 C1COCCN1 8H60-1-3H [2,0,0,0,0,0|2,0,0]=4 379 B8R0.2 CCC(C)C(=O)C(=O)O 2129-1-1A [0,1,1,0,0,0|1,0,1]=4 380 B8R0.2 CCC(O)C(Cl)C(=O)O 2129-5-03 [0,1,1,0,0,0|2,0,0]=4 381 B8R0.2 CC[C@H](C)[C@H](Cl)C(=O)O 2121-5-0B [0,1,1,0,0,0|1,0,0]=3 382 B8R0.2 COC(=O)C(=O)C(C)C 2129-1-0P [0,1,1,0,0,0|1,0,1]=4 383 B8R0.2 COC(=O)C(Br)C(C)C 2123-9-0M [0,1,1,0,0,0|1,0,0]=3 384 B8R0.2 COC(=O)[C@@H](N)C(C)C 4158-5-S4 [0,1,1,0,0,0|1,0,0]=3 385 B8R0.2 COC(=O)[C@@H](O)C(C)C 2129-1-S2 [0,1,1,0,0,0|1,0,0]=3 386 B8R0.2 COC(=O)[C@H](N)C(C)C 4158-5-R4 [0,1,1,0,0,0|1,0,0]=3 387 B8R0.2 COC(=O)[C@H](O)C(C)C 2129-1-R2 [0,1,1,0,0,0|1,0,0]=3 388 B8R0.5 CC(C)NC(=O)CC#N 4148-1-X4 [0,1,1,0,0,0|1,0,1]=4 389 B8R0.5 CC(C)OC(=O)CC#N 4137-1-Y0 [0,1,1,0,0,0|1,0,1]=4 390 B8R0.5 CC(C)OC(=O)OCCl 2128-5-0Q [0,1,1,0,0,0|2,0,0]=4 391 B8R0.5 CCCC(=O)NC(C)C 4148-1-0K [0,1,1,0,0,0|1,0,0]=3 392 B8R0.5 CCOC(=O)CC(C)Br 2123-9-0G [0,1,1,0,0,0|1,0,0]=3 393 B8R0.5 CCOC(=O)CC(C)N 4130-1-01 [0,1,1,0,0,0|1,0,0]=3 394 B8R0.5 CCOC(=O)CC(C)O 2129-1-24 [0,1,1,0,0,0|1,0,0]=3 395 B8R0.5 CCOC(=O)C[C@@H](C)O 2129-1-R9 [0,1,1,0,0,0|1,0,0]=3 396 B8R0.5 CCOC(=O)C[C@H](C)N 4158-5-39 [0,1,1,0,0,0|1,0,0]=3 397 B8R0.5 CCOC(=O)OC(C)Cl 2128-5-0R [0,1,1,0,0,0|2,0,0]=4 398 B8R0.5 C\C=C\C(=O)OC(C)C 2323-1-0Z [0,1,1,0,0,0|1,0,1]=4 399 B8R0.16 C=CC(CC)OC(C)=O 2324-1-0G [0,1,1,0,0,0|1,0,1]=4 400 B8R0.19 CC[C@H](O)CC(=O)OC 2129-1-SE [0,1,1,0,0,0|1,0,0]=3 401 B8R0.19 COC(=O)C[C@H](O)CCl 2129-5-S0 [0,1,1,0,0,0|2,0,0]=4 402 B8R0.23 C=C(C)C(=O)OC(C)C 2323-1-0S [0,1,1,0,0,0|1,0,1]=4 403 B8R0.23 CC(=O)CC(C)C(=O)O 2129-1-0G [0,1,1,0,0,0|1,0,1]=4 404 B8R0.23 CC(C)C(N)CC(=O)O 4157-1-40 [0,1,1,0,0,0|2,0,0]=4 405 B8R0.23 CC(C)NC(=O)C(C)C 4148-1-20 [0,1,1,0,0,0|1,0,0]=3 406 B8R0.23 CC(C)[C@H](N)CC(=O)O 4157-1-R40 [0,1,1,0,0,0|2,0,0]=4 407 B8R0.23 CC(C)[C@H](N)CC(=O)O 4157-5-10 [0,1,1,0,0,0|2,0,0]=4 408 B8R0.24 CC(C)(C)OC(=O)CO 2129-1-0B [0,1,1,0,0,0|2,0,0]=4 409 B8R0.24 CCC(C)OS(C)(=O)=O 6164-1-01 [0,1,1,0,0,0|2,0,0]=4 410 B8R0.24 CNC(=O)CC(C)(C)C 4148-1-25 [0,1,1,0,0,0|1,0,0]=3 411 B8R0.24 COC(=O)C[Si](C)(C)C 6180-1-06 [0,1,1,0,0,0|1,1,0]=4 412 B8R0.34 CC(C)(CN)CC(=O)O 4157-1-51 [0,1,1,0,0,0|2,0,0]=4 413 B8R0.34 CC(O)(CN)CC(=O)O 4157-1-58 [0,1,1,0,0,0|2,0,0]=4 414 B8R0.34 CCC(C)(O)CC(=O)O 2129-1-0V [0,1,1,0,0,0|1,0,0]=3 415 B8R0.34 CCC(C)(O)CC(C)C 2103-1-04 [0,1,1,0,0,0|0,0,2]=4 416 B8R0.6 C=CCCCC(=O)OC 2324-1-0B [0,1,1,0,0,0|0,0,2]=4 417 B8R0.6 CCC(=O)OCCCCl 2123-5-0T [0,1,1,0,0,0|2,0,0]=4 418 B8R0.6 CCC(=O)OCCCF 2123-3-5Q [0,1,1,0,0,0|2,0,0]=4 419 B8R0.6 CCCCCC(=O)OC 2123-1-90 [0,1,1,0,0,0|0,0,0]=2 420 B8R0.6 CCCCCC(O)CN 4156-1-96 [0,1,1,0,0,0|0,0,2]=4 421 B8R0.6 CCCCCC(O)CO 2104-1-0K [0,1,1,0,0,0|0,0,2]=4 422 B8R0.6 CCCCCN(C)N=O 4152-1-05 [0,1,1,0,0,0|1,0,0]=3 423 B8R0.6 CCCCC[C@H](O)CCl 2102-5-S1 [0,1,1,0,0,0|0,0,2]=4 424 B8R0.6 CCCCNC(=O)CC 4148-1-0Y [0,1,1,0,0,0|1,0,0]=3 425 B8R0.6 CCCCNC(=O)CCl 4148-5-0F [0,1,1,0,0,0|1,0,0]=3 426 B8R0.6 CCCCOC(=O)CF 2123-3-X1 [0,1,1,0,0,0|1,0,0]=3 427 B8R0.6 CCC\C=C\C(=O)OC 2323-1-0D [0,1,1,0,0,0|0,0,2]=4 428 B8R0.6 CCNCCC(=O)OC 4158-1-0D [0,1,1,0,0,0|1,0,0]=3 429 B8R0.6 COC(=O)CCCC#N 4137-1-0F [0,1,1,0,0,0|1,0,1]=4 430 B8R0.6 COC(=O)CCCCBr 2123-9-14 [0,1,1,0,0,0|1,0,0]=3 431 B8R0.6 COC(=O)CCCCCl 2123-5-1C [0,1,1,0,0,0|1,0,0]=3 432 B8R0.6 COC(=O)CCCCN 4158-5-0A [0,1,1,0,0,0|1,0,0]=3 433 B8R0.6 COC(=O)COCCBr 2123-9-0B [0,1,1,0,0,0|2,0,0]=4 434 B8R0.6 COC(=O)COCCCl 2123-5-0H [0,1,1,0,0,0|2,0,0]=4 435 B8R0.6 COC(=O)OCCCCl 2128-5-0P [0,1,1,0,0,0|2,0,0]=4 436 B8R0.6 COCCCC(=O)OC G311-A-58 [0,1,1,0,0,0|1,0,0]=3 437 B8R0.6 COCCOC(=O)CCl 2123-5-1J [0,1,1,0,0,0|2,0,0]=4 438 B8R0.6 O=C(CO)OCCCCl 2129-5-0C [0,1,1,0,0,0|2,0,0]=4 439 B8R0.6 O=C(CO)OCCCF 2129-3-0N [0,1,1,0,0,0|2,0,0]=4 440 B8R0.7 C#CCCCCC(=O)O 2521-1-04 [0,1,1,0,0,0|1,0,1]=4 441 B8R0.7 C=C(Br)CCCCCC 1300-9-08 [0,1,1,0,0,0|1,0,1]=4 442 B8R0.7 C=C(Br)CCCCCCl 1300-D-03 [0,1,1,0,0,0|1,0,1]=4 443 B8R0.7 C=C(C)CCCCC#N 3337-1-X1 [0,1,1,0,0,0|1,0,1]=4 444 B8R0.7 C=C(C)CCCCCCl 1300-5-32 [0,1,1,0,0,0|1,0,0]=3 445 B8R0.7 C=C(Cl)CCCCCC 1300-5-26 [0,1,1,0,0,0|1,0,1]=4 446 B8R0.7 C=C(Cl)CCCCCCl 1300-5-35 [0,1,1,0,0,0|1,0,1]=4 447 B8R0.7 C=CCCCCC(=O)O 2321-1-0N [0,1,1,0,0,0|1,0,1]=4 448 B8R0.7 CC(=O)CCOCCBr 2117-9-00 [0,1,1,0,0,0|1,0,0]=3 449 B8R0.7 CC(=O)CCOCCCl 2117-5-0A [0,1,1,0,0,0|1,0,0]=3 450 B8R0.7 CC(=O)COCCCCl 2117-5-0D [0,1,1,0,0,0|1,0,0]=3 451 B8R0.7 CC(=O)COCCCF 2117-3-1G [0,1,1,0,0,0|1,0,0]=3 452 B8R0.7 CC(=O)OCCCCBr 2123-9-19 [0,1,1,0,0,0|1,0,0]=3 453 B8R0.7 CC(=O)OCCCCCl 2123-5-0W [0,1,1,0,0,0|1,0,0]=3 454 B8R0.7 CC(=O)OCCCCI 2123-H-02 [0,1,1,0,0,0|1,0,0]=3 455 B8R0.7 CC(C)CNCCCO 4256-1-0Y [0,1,1,0,0,0|0,0,2]=4 456 B8R0.7 CC(C)COCCC#N 4137-1-0W [0,1,1,0,0,0|1,0,1]=4 457 B8R0.7 CC(C)COCCCN 4156-1-3S [0,1,1,0,0,0|1,0,1]=4 458 B8R0.7 CC(C)NCCCCO 4131-1-01 [0,1,1,0,0,0|0,0,2]=4 459 B8R0.7 CCCCC#CC(=O)O 2521-1-0A [0,1,1,0,0,0|1,0,1]=4 460 B8R0.7 CCCCCC=C(F)F 1300-3-98 [0,1,1,0,0,0|2,0,0]=4 461 B8R0.7 CCCCCCC(C)=O 2117-1-X1 [0,1,1,0,0,0|0,0,0]=2 462 B8R0.7 CCCCCCC(C)I 1100-H-15 [0,1,1,0,0,0|1,0,1]=4 463 B8R0.7 CCCCCC[C@@H](C)N 3130-1-R2 [0,1,1,0,0,0|1,0,1]=4 464 B8R0.7 CCCCCC[C@@H](C)O 2102-1-R1 [0,1,1,0,0,0|0,0,2]=4 465 B8R0.7 CCCCCC[C@H](C)N 3130-1-S2 [0,1,1,0,0,0|1,0,1]=4 466 B8R0.7 CCCCCO[N+](=O)[O-] 4154-1-0B [0,1,1,0,0,0|2,0,0]=4 467 B8R0.7 CCCCOCC(=O)O 2121-1-52 [0,1,1,0,0,0|1,0,0]=3 468 B8R0.7 CCCCOCC(C)F 2107-3-6C [0,1,1,0,0,0|1,0,1]=4 469 B8R0.7 CCNCCCN(C)C 3132-1-0H [0,1,1,0,0,0|2,0,0]=4 470 B8R0.7 CN(C)CCCCCN 3130-1-0B [0,1,1,0,0,0|2,0,0]=4 471 B8R0.7 COCCOCC(=O)Cl 2116-5-12 [0,1,1,0,0,0|2,0,0]=4 472 B8R0.7 COCCOCC(=O)O 2121-1-33A [0,1,1,0,0,0|2,0,0]=4 473 B8R0.7 COCCOCC(=O)O 2121-1-33B [0,1,1,0,0,0|2,0,0]=4 474 B8R0.7 COCCOCC(=O)O 2121-1-33C [0,1,1,0,0,0|2,0,0]=4 475 B8R0.7 CSCCCOC(C)=O 6166-1-0K [0,1,1,0,0,0|1,0,0]=3 476 B8R0.7 NC(=O)CCCCCBr 4148-9-07 [0,1,1,0,0,0|1,0,0]=3 477 B8R0.7 NCCCCCC(=O)O 4157-1-0B [0,1,1,0,0,0|1,0,0]=3 478 B8R0.7 O=C(O)CCCCCCl 2121-5-06 [0,1,1,0,0,0|1,0,0]=3 479 B8R0.7 O=C(O)CCCCCO 2129-1-0D [0,1,1,0,0,0|1,0,0]=3 480 B8R0.8 CC(=O)N(C)CCCN 4148-5-0E [0,1,1,0,0,0|2,0,0]=4 481 B8R0.8 CCCCC(Br)C(=O)O 2121-9-16 [0,1,1,0,0,0|1,0,0]=3 482 B8R0.8 CCCCC(C)C(=O)O 2121-1-0S [0,1,1,0,0,0|1,0,0]=3 483 B8R0.8 COCC[C@H](N)C(=O)O 4157-5-S8 [0,1,1,0,0,0|2,0,0]=4 484 B8R0.8 CSCCC(N)C(=O)O 8166-1-00 [0,1,1,0,0,0|2,0,0]=4 485 B8R0.8 [C@H](N)(CCSC)C(=O)O 8166-1-S5 [0,1,1,0,0,0|2,0,0]=4 486 B8R0.9 CC(=O)OCC(C)CBr 2123-9-0N [0,1,1,0,0,0|2,0,0]=4 487 B8R0.9 CCC(C)CCC(C)C 1100-1-26 [0,1,1,0,0,0|1,0,1]=4 488 B8R0.9 CCC(C)COC(=O)Cl 2116-5-28 [0,1,1,0,0,0|2,0,0]=4 489 B8R0.9 CCC(Cl)CCC(=O)Cl 2116-5-23 [0,1,1,0,0,0|1,0,0]=3 490 B8R0.9 CCC(O)CCC(C)C 2102-1-0B [0,1,1,0,0,0|1,0,1]=4 491 B8R0.21 CCCCOS(C)(=O)=O 6164-1-23 [0,1,1,0,0,0|2,0,0]=4 492 B8R0.28 C=C(C)CCCC(=O)O 2321-1-18 [0,1,1,0,0,0|0,0,2]=4 493 B8R0.28 CC(=O)CCCC(=O)O 2129-1-0X [0,1,1,0,0,0|1,0,1]=4 494 B8R0.28 CC(=O)CCCC(C)C 2117-1-0E [0,1,1,0,0,0|0,0,0]=2 495 B8R0.28 CC(=O)CCCN(C)C 4156-1-51 [0,1,1,0,0,0|1,0,0]=3 496 B8R0.28 CC(=O)CCOC(C)C 2117-1-0F [0,1,1,0,0,0|1,0,0]=3 497 B8R0.28 CC(=O)COCC(C)F 2117-3-1F [0,1,1,0,0,0|1,0,0]=3 498 B8R0.28 CC(=O)COCC(F)F 2117-3-1L [0,1,1,0,0,0|2,0,0]=4 499 B8R0.28 CC(=O)OCCN(C)C 4132-1-05 [0,1,1,0,0,0|2,0,0]=4 500 B8R0.28 CC(C)CCCC(=O)O 2121-1-15 [0,1,1,0,0,0|0,0,0]=2 501 B8R0.28 CC(C)CCOC(=O)Cl 2116-5-27 [0,1,1,0,0,0|1,0,0]=3 502 B8R0.28 CC(C)CCO[N+](=O)[O-] 4254-1-03 [0,1,1,0,0,0|2,0,0]=4 503 B8R0.1 C=CCCC(=O)OCC 2323-1-0V [0,1,1,0,0,0|1,0,1]=4 504 B8R0.1 CCCC(=O)OCCBr 2123-9-0C [0,1,1,0,0,0|1,0,0]=3 505 B8R0.1 CCCC(=O)OCCCl 2123-5-0J [0,1,1,0,0,0|1,0,0]=3 506 B8R0.1 CCCCC(O)CCC 2102-1-0D [0,1,1,0,0,0|0,0,2]=4 507 B8R0.1 CCCOC(=O)CC#N 4137-1-0P [0,1,1,0,0,0|1,0,1]=4 508 B8R0.1 CCC\N=C(\S)NCC 7161-1-01 [0,1,1,0,0,0|1,1,0]=4 509 B8R0.1 CCNCC(=O)OCC 4158-1-60 [0,1,1,0,0,0|1,0,0]=3 510 B8R0.1 CCOC(=O)CCC=O 2123-1-64 [0,1,1,0,0,0|1,0,1]=4 511 B8R0.1 CCOC(=O)CCCN 4158-5-49 [0,1,1,0,0,0|1,0,0]=3 512 B8R0.1 CCOC(=O)CCNC 4131-1-03 [0,1,1,0,0,0|1,0,0]=3 513 B8R0.1 CCOC(=O)CCOC 2123-1-1D [0,1,1,0,0,0|1,0,0]=3 514 B8R0.1 CCOC(=O)NCCCl 4156-5-0N [0,1,1,0,0,0|2,0,0]=4 515 B8R0.1 CCOC(=O)OCCBr 2128-9-06 [0,1,1,0,0,0|2,0,0]=4 516 B8R0.1 CCOC(=O)OCCCl 2128-5-0E [0,1,1,0,0,0|2,0,0]=4 517 B8R0.1 CC\C=C\C(=O)OCC 2323-1-E1 [0,1,1,0,0,0|1,0,1]=4 518 B8R0.1 C\C=C\C(=O)CCCC 2317-1-0C [0,1,1,0,0,0|0,0,2]=4 519 B8R0.3 CCCC(=O)C(C)CC 2117-1-0B [0,1,1,0,0,0|0,0,0]=2 520 B8R0.3 CCCC(=O)N(C)OC 4148-1-0U [0,1,1,0,0,0|2,0,0]=4 521 B8R0.3 CCOC(=O)C(=O)CC 2129-1-1C [0,1,1,0,0,0|1,0,1]=4 522 B8R0.3 CCOC(=O)C(Br)CBr 2123-9-31 [0,1,1,0,0,0|2,0,0]=4 523 B8R0.3 CCOC(=O)C(Br)CC 2123-9-04 [0,1,1,0,0,0|1,0,0]=3 524 B8R0.3 CCOC(=O)C(C)CC 2123-1-0K [0,1,1,0,0,0|1,0,0]=3 525 B8R0.3 CCOC(=O)C(N)CC 4157-5-0B [0,1,1,0,0,0|1,0,0]=3 526 B8R0.3 CCOC(=O)[C@@H](N)CS 8161-5-01 [0,1,1,0,0,0|2,0,0]=4 527 B8R0.3 CCOC(=O)[C@H](N)CC 4158-5-RR [0,1,1,0,0,0|1,0,0]=3 528 B8R0.22 CCCN(C=O)CCC 4148-1-0N [0,1,1,0,0,0|1,0,0]=3 529 B8R0.22 CCCN(CC)CCC 3132-1-0F [0,1,1,0,0,0|2,0,0]=4 530 B8R0.30 CCCC(C)(O)CCC 2103-1-05 [0,1,1,0,0,0|0,0,2]=4 531 B8R0.30 CCCS(=O)(=O)CCC 6163-1-09 [0,1,1,0,0,0|1,0,0]=3 532 B8R1.2 BrCC1CCCCC1 1200-9-04 [1,1,0,0,0,0|0,0,1]=3 533 B8R1.2 BrCC1CCCOC1 2H10-9-32 [1,1,0,0,0,0|1,0,0]=3 534 B8R1.2 BrCC1CCNCC1 3H31-9-13 [1,1,0,0,0,0|1,0,1]=4 535 B8R1.2 C=CC1CCCCC1 1300-1-38 [1,1,0,0,0,0|0,0,2]=4 536 B8R1.2 CCC1CCCCN1 3H31-1-CW [1,1,0,0,0,0|1,0,1]=4 537 B8R1.2 CCC1CCCNC1 3H31-5-6G [1,1,0,0,0,0|1,0,0]=3 538 B8R1.2 CCC1CNCCN1 3H32-1-7C [1,1,0,0,0,0|2,0,0]=4 539 B8R1.2 CCC1CNCCO1 4H44-1-01 [1,1,0,0,0,0|2,0,0]=4 540 B8R1.2 CCC1COCCN1 4H56-1-0NF [1,1,0,0,0,0|2,0,0]=4 541 B8R1.2 CCN1CCCCC1 3H32-1-GD [1,1,0,0,0,0|1,0,1]=4 542 B8R1.2 CC[C@@H]1CNCCN1 3H31-1-RH [1,1,0,0,0,0|2,0,0]=4 543 B8R1.2 CC[C@@H]1COCCN1 4H56-1-R53 [1,1,0,0,0,0|2,0,0]=4 544 B8R1.2 CC[C@H]1CCCCN1 3H31-5-SC [1,1,0,0,0,0|1,0,1]=4 545 B8R1.2 CC[C@H]1CNCCN1 3H31-1-SH [1,1,0,0,0,0|2,0,0]=4 546 B8R1.2 CC[C@H]1COCCN1 4H44-1-39 [1,1,0,0,0,0|2,0,0]=4 547 B8R1.2 CNC1CCCNC1 3H33-5-0S [1,1,0,0,0,0|1,0,0]=3 548 B8R1.2 CNC1CCNCC1 3H31-5-6M [1,1,0,0,0,0|1,0,1]=4 549 B8R1.2 CNC1CCSCC1 7H33-5-04 [1,1,0,0,0,0|1,0,1]=4 550 B8R1.2 COC1CCCNC1 4H56-5-2V [1,1,0,0,0,0|1,0,0]=3 551 B8R1.2 COC1CCNCC1 4H07-5-82 [1,1,0,0,0,0|1,0,1]=4 552 B8R1.2 CO[C@@H]1CCCNC1 4H56-5-RB [1,1,0,0,0,0|1,0,0]=3 553 B8R1.2 CO[C@H]1CCCNC1 4H56-1-794 [1,1,0,0,0,0|1,0,0]=3 554 B8R1.2 ClCC1CCCCN1 3H33-5-0G [1,1,0,0,0,0|1,0,1]=4 555 B8R1.2 Cl[Mg]C1CCCCC1 9212-5-00ST [1,1,0,0,0,0|1,0,1]=4 556 B8R1.2 Cl[Mg]C1CCCCC1 9212-5-00ST1 [1,1,0,0,0,0|1,0,1]=4 557 B8R1.2 N#CC1CC=CCC1 3437-1-00 [1,1,0,0,0,0|0,0,2]=4 558 B8R1.2 N#CC1CCCNC1 3H37-5-18 [1,1,0,0,0,0|1,0,1]=4 559 B8R1.2 N#CN1CCCCC1 3H37-1-BM [1,1,0,0,0,0|2,0,0]=4 560 B8R1.2 N#C[C@H]1CCCNC1 3H37-5-S0 [1,1,0,0,0,0|1,0,1]=4 561 B8R1.2 NCC1CCCCC1 3230-1-02 [1,1,0,0,0,0|0,0,1]=3 562 B8R1.2 NCC1CCCNC1 3H30-5-8F [1,1,0,0,0,0|1,0,0]=3 563 B8R1.2 NCC1CCCOC1 4H56-1-0KK [1,1,0,0,0,0|1,0,0]=3 564 B8R1.2 NCC1CCNCC1 3H31-1-12 [1,1,0,0,0,0|1,0,1]=4 565 B8R1.2 NCC1CCSCC1 7H30-5-18 [1,1,0,0,0,0|1,0,1]=4 566 B8R1.2 NCC1CCSCC1 7H66-1-78 [1,1,0,0,0,0|1,0,1]=4 567 B8R1.2 NC[C@@H]1COCCO1 4H56-5-R2 [1,1,0,0,0,0|2,0,0]=4 568 B8R1.2 NC[C@H]1COCCO1 4H56-5-S2 [1,1,0,0,0,0|2,0,0]=4 569 B8R1.2 O=CC1=CCCCC1 2415-1-02 [1,1,0,0,0,0|0,0,1]=3 570 B8R1.2 O=CC1=CCCSC1 6H15-1-0B [1,1,0,0,0,0|1,0,1]=4 571 B8R1.2 O=CC1CC=CCC1 2415-1-01 [1,1,0,0,0,0|0,0,2]=4 572 B8R1.2 O=CC1CCCCC1 2215-1-X0 [1,1,0,0,0,0|0,0,1]=3 573 B8R1.2 O=CC1CCNCC1 4H15-1-N2 [1,1,0,0,0,0|1,0,1]=4 574 B8R1.2 O=CC1CCSCC1 6H66-1-X0 [1,1,0,0,0,0|1,0,1]=4 575 B8R1.2 O=CN1CCNCC1 4H48-1-C1 [1,1,0,0,0,0|2,0,0]=4 576 B8R1.2 OCC1CC=CCC1 2401-1-09 [1,1,0,0,0,0|0,0,1]=3 577 B8R1.2 OCC1CCC=CO1 2H01-1-08 [1,1,0,0,0,0|1,0,1]=4 578 B8R1.2 OCC1CCCCC1 2201-1-0A [1,1,0,0,0,0|0,0,1]=3 579 B8R1.2 OCC1CCCCN1 4H01-1-25 [1,1,0,0,0,0|1,0,1]=4 580 B8R1.2 OCC1CCCNC1 4H01-5-60 [1,1,0,0,0,0|1,0,0]=3 581 B8R1.2 OCC1CCCOC1 2H01-1-22 [1,1,0,0,0,0|1,0,0]=3 582 B8R1.2 OCC1CCSCC1 6H01-1-X2 [1,1,0,0,0,0|1,0,1]=4 583 B8R1.2 OCC1CNCCO1 4H56-1-321 [1,1,0,0,0,0|2,0,0]=4 584 B8R1.2 OCC1COCCN1 4H01-1-3Z [1,1,0,0,0,0|2,0,0]=4 585 B8R1.2 OC[C@@H]1CCCCN1 4H01-1-S3 [1,1,0,0,0,0|1,0,1]=4 586 B8R1.2 OC[C@@H]1CCCNC1 4H01-1-42 [1,1,0,0,0,0|1,0,0]=3 587 B8R1.2 OC[C@@H]1CCCNC1 4H33-5-R2 [1,1,0,0,0,0|1,0,0]=3 588 B8R1.2 OC[C@@H]1CNCCO1 4H56-5-S9 [1,1,0,0,0,0|2,0,0]=4 589 B8R1.2 OC[C@@H]1COCCN1 4H56-5-RE [1,1,0,0,0,0|2,0,0]=4 590 B8R1.2 OC[C@@H]1COCCO1 2H01-1-R2 [1,1,0,0,0,0|2,0,0]=4 591 B8R1.2 OC[C@H]1CCCNC1 4H01-1-43 [1,1,0,0,0,0|1,0,0]=3 592 B8R1.2 OC[C@H]1CCCNC1 4H01-5-S2 [1,1,0,0,0,0|1,0,0]=3 593 B8R1.2 OC[C@H]1CNCCO1 4H56-5-R9 [1,1,0,0,0,0|2,0,0]=4 594 B8R1.2 ON=C1CCCCC1 4247-1-12 [1,1,0,0,0,0|0,0,1]=3 595 B8R1.2 ON=C1CCSCC1 8H47-1-09 [1,1,0,0,0,0|1,0,1]=4 596 B8R1.2 ONC1CCCCC1 4247-1-0B [1,1,0,0,0,0|0,0,2]=4 597 B8R1.2 O\N=C1\CCCSC1 8H47-1-08 [1,1,0,0,0,0|1,0,1]=4 598 B8R1.3 C=C1CCC(C)CC1 1300-1-47 [1,1,0,0,0,0|1,0,0]=3 599 B8R1.3 CC1CCC(=O)CC1 2217-1-X3 [1,1,0,0,0,0|0,0,0]=2 600 B8R1.3 CC1CCC(Br)CC1 1200-9-24 [1,1,0,0,0,0|0,0,1]=3 601 B8R1.3 CC1CCC(N)CC1 3233-5-06 [1,1,0,0,0,0|0,0,1]=3 602 B8R1.3 CC1CCC(O)CC1 2202-1-02 [1,1,0,0,0,0|0,0,1]=3 603 B8R1.3 CC1COC(C)CN1 4H56-1-0PU [1,1,0,0,0,0|2,0,0]=4 604 B8R1.3 CN1CCC(Br)CC1 2H32-9-00 [1,1,0,0,0,0|1,0,1]=4 605 B8R1.3 CN1CCC(Cl)CC1 3H32-5-4B [1,1,0,0,0,0|1,0,1]=4 606 B8R1.3 C[C@H]1CC[C@@H](N)CC1 3233-5-01 [1,1,0,0,0,0|0,0,1]=3 607 B8R1.3 C[C@H]1CC[C@H](O)CC1 2202-1-17 [1,1,0,0,0,0|0,0,1]=3 608 B8R1.3 NC1CCC(=O)CC1 4256-1-01 [1,1,0,0,0,0|0,0,0]=2 609 B8R1.3 NC1CCC(=O)CC1 4256-5-56 [1,1,0,0,0,0|0,0,0]=2 610 B8R1.3 NC1CCC(=O)NC1 4H48-5-66 [1,1,0,0,0,0|1,0,0]=3 611 B8R1.3 NN1CCC(O)CC1 4H56-1-JR [1,1,0,0,0,0|2,0,0]=4 612 B8R1.3 N[C@H]1CC[C@@H](O)CC1 4256-1-76 [1,1,0,0,0,0|0,0,2]=4 613 B8R1.3 N[C@H]1CC[C@H](N)CC1 3230-1-X1 [1,1,0,0,0,0|1,0,1]=4 614 B8R1.3 O=C1CCC(=O)CC1 2218-1-X2 [1,1,0,0,0,0|0,0,1]=3 615 B8R1.3 O=C1CCC(=O)NC1 4H48-1-1E [1,1,0,0,0,0|1,0,1]=4 616 B8R1.3 O=C1CCC(O)CC1 2220-1-X3 [1,1,0,0,0,0|0,0,0]=2 617 B8R1.3 O=C1CCC(O)CN1 4H20-1-29 [1,1,0,0,0,0|1,0,0]=3 618 B8R1.3 O=C1NCC(O)CN1 4H48-1-KS [1,1,0,0,0,0|2,0,0]=4 619 B8R1.3 O[C@H]1CC[C@H](O)CC1 2204-1-0F [1,1,0,0,0,0|0,0,2]=4 620 B8R1.5 CC1CCCCC1N 3230-1-13 [1,1,0,0,0,0|0,0,1]=3 621 B8R1.5 CC1CCCNC1=O 4H48-1-MX [1,1,0,0,0,0|1,0,0]=3 622 B8R1.5 CC1CCNCC1O 4H01-5-17 [1,1,0,0,0,0|1,0,1]=4 623 B8R1.5 CC1CCNCC1O 4H56-1-011 [1,1,0,0,0,0|1,0,1]=4 624 B8R1.5 CC1CNCCC1=O 4H17-1-8V [1,1,0,0,0,0|1,0,0]=3 625 B8R1.5 C[C@@H]1CCCC[C@@H]1N 3230-5-25 [1,1,0,0,0,0|0,0,1]=3 626 B8R1.5 C[C@@H]1COCC[C@H]1N 4H56-5-A3 [1,1,0,0,0,0|1,0,0]=3 627 B8R1.5 C[C@H]1CCCC[C@H]1N 3230-5-26 [1,1,0,0,0,0|0,0,1]=3 628 B8R1.5 C[C@H]1CCCC[C@H]1O 2202-1-01 [1,1,0,0,0,0|0,0,1]=3 629 B8R1.5 C[C@H]1COCC[C@H]1N 4H30-1-R1 [1,1,0,0,0,0|1,0,0]=3 630 B8R1.5 NC1CCNCC1O 4H56-1-02S [1,1,0,0,0,0|2,0,0]=4 631 B8R1.5 N[C@@H]1CCCC[C@@H]1O 4256-5-0B [1,1,0,0,0,0|0,0,2]=4 632 B8R1.5 N[C@@H]1CCCC[C@@H]1O 4256-5-29 [1,1,0,0,0,0|0,0,2]=4 633 B8R1.5 N[C@@H]1CCCC[C@H]1O 4256-5-0C [1,1,0,0,0,0|0,0,2]=4 634 B8R1.5 N[C@@H]1CCOC[C@@H]1O 4H56-1-145 [1,1,0,0,0,0|2,0,0]=4 635 B8R1.5 N[C@@H]1CCOC[C@@H]1O 4H56-5-C2 [1,1,0,0,0,0|2,0,0]=4 636 B8R1.5 N[C@@H]1COCC[C@H]1O 4H56-1-806 [1,1,0,0,0,0|2,0,0]=4 637 B8R1.5 N[C@@H]1COCC[C@H]1O 4H56-5-C3 [1,1,0,0,0,0|2,0,0]=4 638 B8R1.5 N[C@H]1CCCC[C@@H]1O 4256-1-S1 [1,1,0,0,0,0|0,0,2]=4 639 B8R1.5 N[C@H]1CCOC[C@@H]1F 4H56-7-2F [1,1,0,0,0,0|2,0,0]=4 640 B8R1.5 N[C@H]1COCC[C@@H]1O 4H56-1-808 [1,1,0,0,0,0|2,0,0]=4 641 B8R1.5 O=C1CCCC=C1Br 2417-9-02 [1,1,0,0,0,0|0,0,2]=4 642 B8R1.5 O=C1CCCCC1Br 2217-9-0C [1,1,0,0,0,0|0,0,0]=2 643 B8R1.5 O=C1CCCCC1Cl 2217-5-09 [1,1,0,0,0,0|0,0,0]=2 644 B8R1.5 O=C1CCCCC1F 2217-3-09 [1,1,0,0,0,0|0,0,0]=2 645 B8R1.5 O=C1CCOCC1Br 2H17-9-03 [1,1,0,0,0,0|1,0,0]=3 646 B8R1.5 O=C1CCOCC1F 2H17-3-03 [1,1,0,0,0,0|1,0,0]=3 647 B8R1.5 OC1CCCCC1Cl 2201-5-02 [1,1,0,0,0,0|0,0,2]=4 648 B8R1.5 OC1CCCCC1F 2202-3-05 [1,1,0,0,0,0|0,0,2]=4 649 B8R1.5 O[C@@H]1CCNC[C@H]1O 4H56-1-183 [1,1,0,0,0,0|2,0,0]=4 650 B8R1.5 O[C@H]1CCCC[C@@H]1O 2204-1-X2 [1,1,0,0,0,0|0,0,2]=4 651 B8R1.5 O[C@H]1CCCC[C@H]1O 2204-1-11 [1,1,0,0,0,0|0,0,2]=4 652 B8R1.5 O[C@H]1CCNC[C@H]1F 4H56-7-65 [1,1,0,0,0,0|2,0,0]=4 653 B8R1.5 O[C@H]1CCNC[C@H]1O 4H56-5-41 [1,1,0,0,0,0|2,0,0]=4 654 B8R1.72 CC1(C)CCCNC1 3H31-5-8E [1,1,0,0,0,0|1,0,0]=3 655 B8R1.72 CC1(C)CCNCC1 3H31-5-33 [1,1,0,0,0,0|1,0,1]=4 656 B8R1.72 CC1(C)CNCCN1 3H31-1-6Z [1,1,0,0,0,0|2,0,0]=4 657 B8R1.72 CC1(C)CNCCN1 3H33-5-1W [1,1,0,0,0,0|2,0,0]=4 658 B8R1.72 CC1(C)CNCCO1 4H44-1-11 [1,1,0,0,0,0|2,0,0]=4 659 B8R1.72 CC1(C)COCCN1 4H56-5-24 [1,1,0,0,0,0|2,0,0]=4 660 B8R1.72 CC1(Cl)CCCCC1 1200-5-14 [1,1,0,0,0,0|0,0,1]=3 661 B8R1.72 CC1(N)CCCCC1 3230-5-17 [1,1,0,0,0,0|0,0,1]=3 662 B8R1.72 CC1(N)CCOCC1 4H30-5-13 [1,1,0,0,0,0|1,0,1]=4 663 B8R1.72 CC1(O)CCCCC1 2603-1-02 [1,1,0,0,0,0|0,0,1]=3 664 B8R1.72 CC1(O)CCCNC1 4H56-1-NY [1,1,0,0,0,0|1,0,0]=3 665 B8R1.72 CC1(O)CCNCC1 4H56-1-MK [1,1,0,0,0,0|1,0,1]=4 666 B8R1.72 FC1(F)CCCCC1 1200-3-X0 [1,1,0,0,0,0|1,0,1]=4 667 B8R1.72 FC1(F)CCCNC1 3H31-7-02 [1,1,0,0,0,0|2,0,0]=4 668 B8R1.72 N=S1(=O)CCOCC1 8H70-1-2D [1,1,0,0,0,0|2,0,0]=4 669 B8R1.72 O=S1(=O)CCCCO1 6H70-1-04 [1,1,0,0,0,0|2,0,0]=4 670 B8R1.72 O=S1(=O)CCOCC1 6H63-1-03 [1,1,0,0,0,0|2,0,0]=4 671 B8R1.1 C=C[C@H]1COC(=O)C1 2H25-1-60 [0,1,0,0,1,0|1,0,1]=4 672 B8R1.1 CCC1CCC(=O)O1 2H25-1-20 [0,1,0,0,1,0|1,0,0]=3 673 B8R1.1 COC1=CC(=O)CC1 2417-1-0G [0,1,0,0,1,0|0,0,2]=4 674 B8R1.1 N#CC1CCC(=O)C1 4237-1-0P [0,1,0,0,1,0|0,0,1]=3 675 B8R1.1 NCC1CCC(=O)N1 4H48-1-QQ [0,1,0,0,1,0|1,0,0]=3 676 B8R1.1 NC[C@H]1CNC(=O)C1 4H48-1-SC [0,1,0,0,1,0|1,0,0]=3 677 B8R1.1 NC[C@H]1CNC(=O)C1 4H48-5-S7 [0,1,0,0,1,0|1,0,0]=3 678 B8R1.1 O=C1CC(CO)CN1 4H48-1-93 [0,1,0,0,1,0|1,0,0]=3 679 B8R1.1 O=C1CC[C@@H](CBr)N1 4H48-9-S0 [0,1,0,0,1,0|1,0,0]=3 680 B8R1.1 O=C1CC[C@@H](CO)N1 4H48-1-KC [0,1,0,0,1,0|1,0,0]=3 681 B8R1.1 O=C1CC[C@@H](CO)O1 2H20-1-01 [0,1,0,0,1,0|1,0,0]=3 682 B8R1.1 O=C1CC[C@H](CBr)N1 4H48-9-R0 [0,1,0,0,1,0|1,0,0]=3 683 B8R1.1 O=C1NC(CO)CO1 4H56-1-0NV [0,1,0,0,1,0|2,0,0]=4 684 B8R1.1 O=C1NC[C@H](CO)O1 4H56-1-RP [0,1,0,0,1,0|2,0,0]=4 685 B8R1.1 O=C1N[C@@H](CO)CO1 4H56-1-S59 [0,1,0,0,1,0|2,0,0]=4 686 B8R1.1 O=C1N[C@H](CO)CO1 4H56-1-R59 [0,1,0,0,1,0|2,0,0]=4 687 B8R1.1 O=C1OCC(CBr)O1 2H28-9-00 [0,1,0,0,1,0|2,0,0]=4 688 B8R1.1 O=C1OCC(CF)O1 2H28-3-05 [0,1,0,0,1,0|2,0,0]=4 689 B8R1.18 C=C1CC(C)OC1=O 2H25-1-3A [0,1,0,0,1,0|1,0,1]=4 690 B8R1.18 CC1CC(=O)N(C)C1 4H48-1-34 [0,1,0,0,1,0|1,0,0]=3 691 B8R1.18 CC1CC(=O)OC1=O 2H26-1-0B [0,1,0,0,1,0|1,0,1]=4 692 B8R1.18 C[C@@H]1OC(=O)O[C@@H]1C 2H28-1-Z0 [0,1,0,0,1,0|2,0,0]=4 693 B8R1.50 CC1CCC(=O)C1=O 2218-1-00 [0,1,0,0,1,0|0,0,1]=3 694 B8R1.50 O=C1OC[C@@H](O)[C@H]1O 2H29-1-65 [0,1,0,0,1,0|2,0,0]=4 695 B8R1.51 CC1(C)CCC(=O)N1 4H48-1-052 [0,1,0,0,1,0|1,0,0]=3 696 B8R1.51 CC1(C)CCC(=O)O1 2H25-1-54 [0,1,0,0,1,0|1,0,0]=3 697 B8R1.51 CC1(C)CNC(=O)C1 4H48-1-DU [0,1,0,0,1,0|1,0,0]=3 698 B8R1.51 CC1(C)COC(=O)N1 4H56-1-NJ [0,1,0,0,1,0|2,0,0]=4 699 B8R1.51 CC1(C)COC(=O)O1 2H28-1-16 [0,1,0,0,1,0|2,0,0]=4 700 B8R1.51 CC1(O)CNC(=O)C1 4H48-1-72 [0,1,0,0,1,0|1,0,0]=3 701 B8R1.51 CC1CCS(=O)(=O)C1 6H63-1-0A [0,1,0,0,1,0|1,0,0]=3 702 B8R1.51 O=S1(=O)CCC(O)C1 6H63-1-X0 [0,1,0,0,1,0|2,0,0]=4 703 B8R1.11 CC1OCC\C1=N\O 4H47-1-38 [0,1,0,0,1,0|1,0,1]=4 704 B8R1.11 CCN1CCCC1=O 4H48-1-037 [0,1,0,0,1,0|1,0,0]=3 705 B8R1.11 CN1CCC[C@@H]1CN 3H32-1-AF [0,1,0,0,1,0|2,0,0]=4 706 B8R1.11 CN1CCC[C@H]1CO 4H01-1-S1 [0,1,0,0,1,0|2,0,0]=4 707 B8R1.11 NN1CCC[C@H]1CO 4H56-1-JT [0,1,0,0,1,0|2,0,0]=4 708 B8R1.11 N[C@H]1CCC[C@H]1CO 4256-5-27 [0,1,0,0,1,0|1,0,1]=4 709 B8R1.11 O=C1NCCC1CO 4H48-1-CJ [0,1,0,0,1,0|1,0,0]=3 710 B8R1.19 CC1(C)CCCC1=O 2217-1-1K [0,1,0,0,1,0|0,0,0]=2 711 B8R1.19 CC1(C)CCOC1=O 2H25-1-2X [0,1,0,0,1,0|1,0,0]=3 712 B10R1.276 O=C1CCCCS(=O)(=O)C1 6H53-1-55 [0,1,0,0,0,1|2,0,0]=4 713 B10R1.8 CCC1CC(=O)CC(=O)C1 2218-1-10 [0,2,0,0,0,0|0,0,1]=3 714 B10R1.8 CCC1CC(=O)CC(=O)C1 2218-1-19 [0,2,0,0,0,0|0,0,1]=3 715 B10R1.10 CCCC1CCCC(=O)C1 2217-1-34 [0,2,0,0,0,0|0,0,0]=2 716 B10R1.10 CCOC1=CC(=O)CCC1 3417-1-X1 [0,2,0,0,0,0|0,0,2]=4 717 B10R1.10 CN1CCCC(CCN)C1 3H30-1-DY [0,2,0,0,0,0|2,0,0]=4 718 B10R1.10 CN1CCCC(CCO)C1 4H01-1-B1 [0,2,0,0,0,0|2,0,0]=4 719 B10R1.10 O=C1CN(CCO)CCN1 4H48-1-6S [0,2,0,0,0,0|2,0,0]=4 720 B10R1.113 CC(=O)C1CCCN(C)C1 4H17-1-2S [0,2,0,0,0,0|1,0,1]=4 721 B10R1.113 CC(=O)C1CCCN(C)C1 4H17-5-0Z [0,2,0,0,0,0|1,0,1]=4 722 B10R1.113 CC(C)N1CCCC(=O)C1 4H17-1-9V [0,2,0,0,0,0|1,0,0]=3 723 B10R1.113 CC1CCCC(C(=O)O)N1 4H21-5-44 [0,2,0,0,0,0|1,0,1]=4 724 B10R1.113 CN1CCCC(C(=O)O)C1 4H21-5-Z1 [0,2,0,0,0,0|1,0,1]=4 725 B10R1.113 CN1CCC[C@@H](C(=O)O)C1 4H21-1-R0 [0,2,0,0,0,0|1,0,1]=4 726 B10R1.113 CN1CCC[C@H](C(=O)O)C1 4H21-1-S0 [0,2,0,0,0,0|1,0,1]=4 727 B10R1.113 NC1CCCC(C(=O)O)C1 4257-1-X1 [0,2,0,0,0,0|1,0,1]=4 728 B10R1.113 N[C@H]1CCC[C@@H](C(=O)O)C1 4257-5-0A [0,2,0,0,0,0|1,0,1]=4 729 B10R1.113 O=C(O)C1CCCC(O)C1 2229-1-0Z [0,2,0,0,0,0|1,0,1]=4 730 B10R1.113 O=C1CC(C(=O)O)CCN1 4H58-1-C7 [0,2,0,0,0,0|1,0,1]=4 731 B10R1.172 CCN1CCCC(C=O)C1 4H33-5-0T [0,2,0,0,0,0|1,0,1]=4 732 B10R1.172 CCN1CCC\C(=N\O)C1 4H47-5-07 [0,2,0,0,0,0|1,0,1]=4 733 B10R1.176 CN1CCC(CN)CC1=O 4H48-1-BH [0,2,0,0,0,0|1,0,0]=3 734 B10R1.176 CN1CCC(CN)CC1=O 4H48-5-BB [0,2,0,0,0,0|1,0,0]=3 735 B10R1.22 CC1CC(=O)C(C)C(=O)C1 2218-1-07 [0,2,0,0,0,0|0,0,1]=3 736 B10R1.114 CC1(C)C(=O)CCCC1=O 2218-1-18 [0,2,0,0,0,0|1,0,1]=4 737 B10R1.114 O=C1CCCC(=O)C1(F)F 2218-3-03 [0,2,0,0,0,0|1,0,1]=4 738 B10R1.329 CC1(C)CC(=O)C=C(Cl)C1 2417-5-04 [0,2,0,0,0,0|0,0,2]=4 739 B10R1.329 CC1(C)CC(=O)C=C(N)C1 4256-1-81 [0,2,0,0,0,0|0,0,2]=4 740 B10R1.329 CC1(C)CC(=O)CC(=O)N1 4H48-1-JP [0,2,0,0,0,0|1,0,1]=4 741 B10R1.329 CC1CC(=O)CC(C)(C)C1 2217-1-0S [0,2,0,0,0,0|0,0,0]=2 742 B10R1.329 CC1CC(N)CC(C)(C)C1 3230-1-0J [0,2,0,0,0,0|1,0,1]=4 743 B10R1.329 CC1CC(O)CC(C)(C)C1 2202-1-0G [0,2,0,0,0,0|0,0,2]=4 744 B10R1.329 C[C@@H]1C[C@@H](O)CC(C)(C)C1 2202-1-1A [0,2,0,0,0,0|0,0,2]=4 745 B10R1.147 CC1C[N+](C)(C)CC[C@H]1O 4H56-H-15 [0,2,0,0,0,0|2,0,0]=4 746 B8R1.34 CC(=O)CC1COC1 2H17-1-01 [0,0,1,1,0,0|1,0,0]=3 747 B8R1.34 O=C(O)CC1CCC1 2221-1-52 [0,0,1,1,0,0|1,0,0]=3 748 B8R1.34 O=C(O)CC1COC1 2H21-1-45 [0,0,1,1,0,0|2,0,0]=4 749 B8R1.40 COC(=O)CC1CC1 2223-1-39 [0,0,1,1,0,0|1,0,0]=3 750 B8R1.40 O=C(CBr)NC1CC1 4248-9-01 [0,0,1,1,0,0|2,0,0]=4 751 B8R1.43 NCC1CC1C(=O)O 4257-5-05 [0,0,1,1,0,0|2,0,0]=4 752 B8R1.62 CC1(C#N)CC(=O)C1 4237-1-0B [0,0,1,1,0,0|1,0,1]=4 753 B8R1.62 CC1(CO)CC(=O)C1 2220-1-04 [0,0,1,1,0,0|1,0,0]=3 754 B8R1.83 CC1CC1C(=O)NN 4248-1-21 [0,0,1,1,0,0|2,0,0]=4 755 B8R1.7 CC(=O)C1=CCCC1 2417-1-0J [0,0,1,1,0,0|0,0,2]=4 756 B8R1.7 CC(=O)C1CCCC1 2217-1-0X [0,0,1,1,0,0|0,0,0]=2 757 B8R1.7 CC(=O)C1CCNC1 4H17-5-3H [0,0,1,1,0,0|1,0,0]=3 758 B8R1.7 CC(C)C1CCCC1 1200-1-13 [0,0,1,1,0,0|1,0,1]=4 759 B8R1.7 CC(C)C1CCCN1 3H31-5-Y8 [0,0,1,1,0,0|1,0,1]=4 760 B8R1.7 CC(C)[C@@H]1CCCN1 3H31-1-SJ [0,0,1,1,0,0|1,0,1]=4 761 B8R1.7 CC(C)[C@H]1CCCN1 3H31-1-RJ [0,0,1,1,0,0|1,0,1]=4 762 B8R1.7 N=C(N)C1CCCC1 3241-5-00 [0,0,1,1,0,0|2,0,0]=4 763 B8R1.7 NC(=O)C1CCNC1 4H48-5-72 [0,0,1,1,0,0|2,0,0]=4 764 B8R1.7 NC(=O)C1CCOC1 4H48-1-AP [0,0,1,1,0,0|2,0,0]=4 765 B8R1.7 NC(=O)[C@@H]1CCNC1 4H48-5-R1 [0,0,1,1,0,0|2,0,0]=4 766 B8R1.7 O=C(O)C1CCCC1 2221-1-Y5 [0,0,1,1,0,0|1,0,0]=3 767 B8R1.7 O=C(O)C1CCCN1 4H58-1-010 [0,0,1,1,0,0|2,0,0]=4 768 B8R1.7 O=C(O)C1CCCO1 2H21-1-26 [0,0,1,1,0,0|2,0,0]=4 769 B8R1.7 O=C(O)[C@@H]1CCNC1 4H21-1-R5 [0,0,1,1,0,0|2,0,0]=4 770 B8R1.7 O=C(O)[C@@H]1CCOC1 2H21-1-R2 [0,0,1,1,0,0|2,0,0]=4 771 B8R1.7 O=[N+]([O-])C1CCCC1 4254-1-02 [0,0,1,1,0,0|2,0,0]=4 772 B8R1.7 [C@@H]1(C(=O)O)CCCN1 4H21-1-0P [0,0,1,1,0,0|2,0,0]=4 773 B8R1.22 BrC1=CCCCCC1 1400-9-06 [0,0,1,1,0,0|1,0,1]=4 774 B8R1.22 NC1CCCCCC1 3230-1-05 [0,0,1,1,0,0|1,0,1]=4 775 B8R1.22 NN1CCCCCC1 3H30-1-PN [0,0,1,1,0,0|2,0,0]=4 776 B8R1.22 O=C1C=CCCCC1 2417-1-0D [0,0,1,1,0,0|0,0,2]=4 777 B8R1.22 O=C1CCCCSC1 6H66-1-10 [0,0,1,1,0,0|1,0,0]=3 778 B8R1.22 O=C1CNCCCN1 4H48-1-4S [0,0,1,1,0,0|2,0,0]=4 779 B8R1.35 CC(=O)NCC1CC1 4248-1-00 [0,0,1,1,0,0|1,0,0]=3 780 B8R1.35 O=C(O)CCC1CC1 2221-1-24 [0,0,1,1,0,0|1,0,0]=3 781 B8R1.36 CCCCCC1CO1 2109-1-0D [0,0,1,1,0,0|0,0,2]=4 782 B8R1.8 CCCC1=NCCO1 4H47-1-1E [0,0,1,1,0,0|1,0,1]=4 783 B8R1.8 CCOC1=NCCC1 4H07-1-6E [0,0,1,1,0,0|2,0,0]=4 784 B8R1.8 N#CCC1CCCC1 3237-1-0A [0,0,1,1,0,0|1,0,1]=4 785 B8R1.8 NCCC1CCCC1 3230-1-15 [0,0,1,1,0,0|1,0,1]=4 786 B8R1.37 CCOC(=O)C1CO1 2123-1-0X [0,0,1,1,0,0|2,0,0]=4 787 B8R2.25 C1CCC2OC2C1 2209-1-03 [1,0,0,1,0,0|0,0,2]=4 788 B8R2.25 C1COC2CC2N1 4H56-5-2X [1,0,0,1,0,0|2,0,0]=4 789 B8R2.34 C1CC2CC1CN2 3H31-1-1P [1,0,0,1,0,0|1,0,0]=3 790 B8R2.34 C1CC2CCC1N2 3H31-5-2E [1,0,0,1,0,0|1,0,1]=4 791 B8R2.34 C1N[C@H]2CN[C@@H]1C2 3H32-1-CF [1,0,0,1,0,0|2,0,0]=4 792 B8R2.34 C1OC2CNC1C2 4H22-1-26 [1,0,0,1,0,0|2,0,0]=4 793 B8R2.34 C1OC2CNC1C2 4H31-1-68 [1,0,0,1,0,0|2,0,0]=4 794 B8R2.34 C1O[C@@H]2CN[C@H]1C2 4H56-5-3A [1,0,0,1,0,0|2,0,0]=4 795 B8R2.34 C1O[C@H]2CN[C@@H]1C2 4H22-1-25 [1,0,0,1,0,0|2,0,0]=4 796 B8R2.34 C1O[C@H]2CN[C@@H]1C2 4H56-5-A7 [1,0,0,1,0,0|2,0,0]=4 797 B8R2.34 [C@@H]12CC[C@@H](CN1)C2 3H31-1-GY [1,0,0,1,0,0|1,0,0]=3 798 B10R2.71 O=C1CC2C=CC(C1)O2 4H17-1-2Z [0,0,0,1,0,1|1,0,1]=4 799 B10R2.71 O=C1CC2CCC(C1)C2 2217-1-30 [0,0,0,1,0,1|0,0,0]=2 800 B10R2.71 O=C1CC2CCC(C1)O2 4H17-1-1Z [0,0,0,1,0,1|1,0,0]=3 801 B10R2.179 CC12CCCC(=O)C1C2 2217-1-1S [0,0,0,1,0,1|0,0,0]=2 802 B10R2.179 CC12CCCC(=O)C1O2 2217-1-0R [0,0,0,1,0,1|0,0,0]=2 803 B10R2.236 OC12CCCC(CC1)C2 2203-1-08 [0,0,0,1,0,1|0,0,2]=4 804 B10R2.409 C1CC2CCC(C1)CC2 1200-1-11 [0,0,0,1,0,1|1,0,1]=4 805 B10R2.62 O=C1CN2CCC1CC2 4H17-5-X6 [0,1,0,1,0,0|1,0,0]=3 806 B10R2.62 O=C1CN2CCC1CC2 4H56-1-BB [0,1,0,1,0,0|1,0,0]=3 807 B10R2.62 O=C1NC2CCC1CC2 4H48-1-AQ [0,1,0,1,0,0|1,0,0]=3 808 B10R2.62 O=C1OC2CCC1CC2 2H25-1-3N [0,1,0,1,0,0|1,0,0]=3 809 B10R2.62 OC1CC2CCC1NC2 4H56-5-1L [0,1,0,1,0,0|0,0,2]=4 810 B10R2.99 N#CC1CC2CCC1C2 3237-1-01 [0,1,0,1,0,0|1,0,1]=4 811 B10R2.25 OC1C2CCC(C2)C1Cl 2202-5-02 [0,1,0,1,0,0|0,0,2]=4 812 B10R2.25 OC1C2CCC(C2)C1O 2204-1-00 [0,1,0,1,0,0|0,0,2]=4 813 B10R2.28 CC1(O)CC2CCC1C2 2203-1-07 [0,1,0,1,0,0|0,0,2]=4 814 B6R0.3 C=C(Br)C(C)CC 1300-9-17 [0,0,1,0,1,0|1,0,1]=4 815 B6R0.3 CC(C)C(=O)CBr 2117-9-02 [0,0,1,0,1,0|1,0,0]=3 816 B6R0.3 CC(CBr)C(=O)O 2121-9-0A [0,0,1,0,1,0|2,0,0]=4 817 B6R0.3 CC(CS)C(=O)O 6261-1-00 [0,0,1,0,1,0|2,0,0]=4 818 B6R0.3 CCC(=O)C(F)F 2117-3-27 [0,0,1,0,1,0|2,0,0]=4 819 B6R0.3 CCC(=O)N(C)C 4148-1-16 [0,0,1,0,1,0|1,0,0]=3 820 B6R0.3 CCC(Br)C(=O)Br 2116-9-09 [0,0,1,0,1,0|2,0,0]=4 821 B6R0.3 CCC(Br)C(=O)Cl 2116-D-02 [0,0,1,0,1,0|2,0,0]=4 822 B6R0.3 CCC(Br)C(=O)O 2121-9-15 [0,0,1,0,1,0|2,0,0]=4 823 B6R0.3 CCC(O)C(=O)O 2129-1-1J [0,0,1,0,1,0|2,0,0]=4 824 B6R0.3 CCC(S)C(C)=O 6161-1-00 [0,0,1,0,1,0|1,0,0]=3 825 B6R0.3 CC[C@@H](Cl)C(=O)O 2121-5-R0 [0,0,1,0,1,0|2,0,0]=4 826 B6R0.3 CC[C@@H](O)C(=O)O 2129-1-RF [0,0,1,0,1,0|2,0,0]=4 827 B6R0.3 CC[C@H](C)C(=O)O 2121-1-S0 [0,0,1,0,1,0|1,0,0]=3 828 B6R0.3 CC[C@H](Cl)C(=O)O 2121-5-S0 [0,0,1,0,1,0|2,0,0]=4 829 B6R0.3 CC[C@H](N)C(N)=O 4148-5-S0 [0,0,1,0,1,0|2,0,0]=4 830 B6R0.3 CN(C)C(=O)CCl 4148-5-0B [0,0,1,0,1,0|2,0,0]=4 831 B6R0.3 CN(C)C(=O)CN 4148-1-0C [0,0,1,0,1,0|2,0,0]=4 832 B6R0.3 CN(C)C(=O)CN 4148-5-X3 [0,0,1,0,1,0|2,0,0]=4 833 B6R0.3 CNC(C)C(=O)O 4157-1-0A [0,0,1,0,1,0|2,0,0]=4 834 B6R0.3 COC(=N)C(C)C 4156-5-0M [0,0,1,0,1,0|2,0,0]=4 835 B6R0.3 COC(=O)C(C)Br 2123-9-35 [0,0,1,0,1,0|2,0,0]=4 836 B6R0.3 COC(=O)C(C)C 2123-1-77 [0,0,1,0,1,0|1,0,0]=3 837 B6R0.3 COC(=O)C(C)N 4158-5-16 [0,0,1,0,1,0|2,0,0]=4 838 B6R0.3 COC(=O)[C@@H](C)Cl 2123-5-R1 [0,0,1,0,1,0|2,0,0]=4 839 B6R0.3 COC(=O)[C@@H](C)F 2123-3-R2 [0,0,1,0,1,0|2,0,0]=4 840 B6R0.3 COC(=O)[C@@H](C)N 4158-5-15 [0,0,1,0,1,0|2,0,0]=4 841 B6R0.3 COC(=O)[C@H](C)Cl 2123-5-S1 [0,0,1,0,1,0|2,0,0]=4 842 B6R0.3 COC(=O)[C@H](C)F 2123-3-S2 [0,0,1,0,1,0|2,0,0]=4 843 B6R0.3 CO[C@@H](C)C(=O)O 2121-1-S1 [0,0,1,0,1,0|2,0,0]=4 844 B6R0.3 CO[C@H](C)C(=O)O 2121-1-R1 [0,0,1,0,1,0|2,0,0]=4 845 B6R1.2 BrC1=CCCC1 1400-9-02 [1,0,0,0,1,0|1,0,1]=4 846 B6R1.2 BrC1CCNC1 3H31-9-22 [1,0,0,0,1,0|2,0,0]=4 847 B6R1.2 BrC1CCOC1 2H10-9-17 [1,0,0,0,1,0|2,0,0]=4 848 B6R1.2 C=C1CCNC1 3H31-5-0P [1,0,0,0,1,0|2,0,0]=4 849 B6R1.2 CC1=CCCC1 1400-1-16 [1,0,0,0,1,0|0,0,1]=3 850 B6R1.2 CC1=NCCC1 3H32-1-41 [1,0,0,0,1,0|1,0,1]=4 851 B6R1.2 CC1CCCN1 3H31-1-46 [1,0,0,0,1,0|1,0,0]=3 852 B6R1.2 CC1CCCN1 3H33-5-32 [1,0,0,0,1,0|1,0,0]=3 853 B6R1.2 CC1NCCS1 7H70-1-1N [1,0,0,0,1,0|2,0,0]=4 854 B6R1.2 C[C@@H]1CCCN1 3H31-1-X0 [1,0,0,0,1,0|1,0,0]=3 855 B6R1.2 C[C@@H]1CCNC1 3H31-5-R5 [1,0,0,0,1,0|1,0,0]=3 856 B6R1.2 FC1CCCC1 1200-3-10 [1,0,0,0,1,0|1,0,0]=3 857 B6R1.2 FC1CCNC1 3H31-7-13 [1,0,0,0,1,0|2,0,0]=4 858 B6R1.2 IC1CCCC1 1200-H-00 [1,0,0,0,1,0|1,0,0]=3 859 B6R1.2 IC1CCOC1 2H10-H-02 [1,0,0,0,1,0|2,0,0]=4 860 B6R1.2 I[C@@H]1CCOC1 2H10-H-19 [1,0,0,0,1,0|2,0,0]=4 861 B6R1.2 NC1=NCCC1 3H33-5-0L [1,0,0,0,1,0|2,0,0]=4 862 B6R1.2 NC1CC=CC1 3430-5-01 [1,0,0,0,1,0|1,0,1]=4 863 B6R1.2 NC1CCCC1 3230-1-04 [1,0,0,0,1,0|1,0,0]=3 864 B6R1.2 NC1CCNC1 3H30-5-1E [1,0,0,0,1,0|2,0,0]=4 865 B6R1.2 N[C@@H]1CCNC1 3H30-5-R3 [1,0,0,0,1,0|2,0,0]=4 866 B6R1.2 N[C@H]1CCNC1 3H30-5-S3 [1,0,0,0,1,0|2,0,0]=4 867 B6R1.2 N[C@H]1CCOC1 4H30-5-03 [1,0,0,0,1,0|2,0,0]=4 868 B6R1.2 O=C1CC=CC1 2417-1-00 [1,0,0,0,1,0|0,0,2]=4 869 B6R1.2 O=C1CCNC1 4H17-1-3A [1,0,0,0,1,0|1,0,0]=3 870 B6R1.2 O=C1NCCO1 4H56-1-03K [1,0,0,0,1,0|2,0,0]=4 871 B6R1.2 O=S1CCCC1 6267-1-00 [1,0,0,0,1,0|1,0,0]=3 872 B6R1.5 CC1CC(=O)C1 2217-1-09 [0,0,0,0,2,0|0,0,0]=2 873 B6R1.5 NC1CC(=O)C1 4256-5-09 [0,0,0,0,2,0|1,0,0]=3 874 B10R1.79 O=C1CCCC(=O)CCC1 2218-1-06 [0,0,0,0,0,2|1,0,1]=4