0 B7R0.1 BrCCCCCCBr 1100-9-X7 [0,0,0,0,0,0|2,0,2]=4 1 B7R0.1 C#CCCCCCC 1500-1-X3 [0,0,0,0,0,0|1,0,3]=4 2 B7R0.1 C=CCCCCCC 1300-1-08 [0,0,0,0,0,0|1,0,3]=4 3 B7R0.1 CCCCCCCF 1100-3-71 [0,0,0,0,0,0|1,0,2]=3 4 B7R0.1 CCCNCCC#N 3137-1-11 [0,0,0,0,0,0|2,0,2]=4 5 B7R0.1 COCCOCCO 2108-1-13 [0,0,0,0,0,0|2,0,2]=4 6 B7R0.1 ClCCCCCCI 1100-M-04 [0,0,0,0,0,0|2,0,2]=4 7 B7R0.1 ICCCCCCI 1100-H-X3 [0,0,0,0,0,0|2,0,2]=4 8 B7R0.1 NCCCCCCO 4156-1-08 [0,0,0,0,0,0|1,0,2]=3 9 B7R0.1 OCCCCCCBr 2101-9-X0 [0,0,0,0,0,0|1,0,2]=3 10 B7R0.1 OCCCCCCCl 2101-5-16 [0,0,0,0,0,0|1,0,2]=3 11 B7R0.1 OCCCCCCO 2104-1-35 [0,0,0,0,0,0|1,0,2]=3 12 B7R0.1 SCCCCCCS 5161-1-06 [0,0,0,0,0,0|1,1,2]=4 13 B6R0.6 C=CCCCCBr 1300-9-X5 [1,0,0,0,0,0|1,0,2]=4 14 B6R0.6 C=CCCCCO 2301-1-06 [1,0,0,0,0,0|0,0,2]=3 15 B6R0.6 CCCCCC=O 2115-1-X2 [1,0,0,0,0,0|0,0,3]=4 16 B6R0.6 CCCCCCCl 1100-5-29 [1,0,0,0,0,0|1,0,1]=3 17 B6R0.6 CCCCCCF 1100-3-61 [1,0,0,0,0,0|1,0,1]=3 18 B6R0.6 ClCCCCCBr 1100-D-X1 [1,0,0,0,0,0|2,0,1]=4 19 B6R0.6 ClCCCCCI 1100-M-X0 [1,0,0,0,0,0|2,0,1]=4 20 B6R0.6 ICCCCCI 1100-H-00 [1,0,0,0,0,0|2,0,1]=4 21 B6R0.6 NCCCCCN 3130-1-20 [1,0,0,0,0,0|2,0,1]=4 22 B6R0.6 NCCCCCO 4156-1-0AT [1,0,0,0,0,0|1,0,1]=3 23 B6R0.6 NCCCCCO 4156-1-Z9 [1,0,0,0,0,0|1,0,1]=3 24 B6R0.6 OCCCCCBr 2101-9-0A [1,0,0,0,0,0|1,0,1]=3 25 B6R0.6 OCCCCCCl 2101-5-04 [1,0,0,0,0,0|1,0,1]=3 26 B6R0.6 OCCNCCO 4156-1-62 [1,0,0,0,0,0|2,0,1]=4 27 B8R0.1 CCOC(=O)CCCBr 2123-9-X0 [0,1,0,0,0,0|2,0,0]=3 28 B8R0.4 BrCCCCCCCBr 1100-9-11 [0,1,0,0,0,0|1,0,2]=4 29 B8R0.4 C=CCCCCCCO 2301-1-13 [0,1,0,0,0,0|0,0,3]=4 30 B8R0.4 CCCCCCCCBr 1100-9-08 [0,1,0,0,0,0|1,0,2]=4 31 B8R0.4 CCCCCCCCF 1100-3-81 [0,1,0,0,0,0|1,0,2]=4 32 B8R0.4 CCCCCCCCN 3130-1-08 [0,1,0,0,0,0|1,0,2]=4 33 B8R0.4 CCCC[NH2+]CCCC 7160-3-X0 [0,1,0,0,0,0|1,0,2]=4 34 B8R0.4 NCCCCCCCN 3130-1-03 [0,1,0,0,0,0|1,0,2]=4 35 B8R0.4 OCCCCCCCO 2104-1-36 [0,1,0,0,0,0|0,0,2]=3 36 B8R0.6 CCCCCC(=O)CC 2117-1-X4 [0,1,0,0,0,0|1,0,1]=3 37 B8R0.6 CCCCCC(O)CC 2102-1-11 [0,1,0,0,0,0|1,0,2]=4 38 B8R0.6 CCCCOC(=O)CCl 2123-5-X2 [0,1,0,0,0,0|3,0,0]=4 39 B8R0.6 CCCOCC(O)CO 2104-1-31 [0,1,0,0,0,0|1,0,1]=3 40 B8R0.7 CCCCCCC(=O)O 2121-1-14 [0,1,0,0,0,0|0,0,3]=4 41 B8R0.7 CCCCCC[C@H](C)O 2102-1-S1 [0,1,0,0,0,0|0,0,2]=3 42 B8R0.7 CCCC\C=C\B(O)O 6360-1-X1 [0,1,0,0,0,0|3,0,0]=4 43 B8R1.2 BrCC1CCOCC1 P311-A-04 [0,0,0,1,0,0|2,0,1]=4 44 B8R1.2 C#CC1=CCCCC1 1500-1-15 [0,0,0,1,0,0|1,0,2]=4 45 B8R1.2 CCC1CCNCC1 3H31-5-14 [0,0,0,1,0,0|2,0,1]=4 46 B8R1.2 CSC1=NCCCN1 7H66-H-X0 [0,0,0,1,0,0|3,0,0]=4 47 B8R1.2 ClCC1CCCCO1 2H10-5-00 [0,0,0,1,0,0|1,0,2]=4 48 B8R1.2 FCC1CCCNC1 3H31-7-1L [0,0,0,1,0,0|2,0,1]=4 49 B8R1.2 ICC1CCOCC1 2H10-H-03 [0,0,0,1,0,0|2,0,1]=4 50 B8R1.2 NCC1CCCCO1 4H56-1-5C [0,0,0,1,0,0|1,0,2]=4 51 B8R1.2 NCC1CCCCO1 4H56-5-G2 [0,0,0,1,0,0|1,0,2]=4 52 B8R1.2 NCC1CCCNC1 3H30-1-LF [0,0,0,1,0,0|2,0,1]=4 53 B8R1.2 NCC1CCOCC1 4H30-5-19 [0,0,0,1,0,0|2,0,1]=4 54 B8R1.2 NCC1CCOCC1 P612-A-48 [0,0,0,1,0,0|2,0,1]=4 55 B8R1.2 O=CC1CCC=CO1 2H15-1-1G [0,0,0,1,0,0|1,0,2]=4 56 B8R1.2 OCC1CCCCO1 2H01-1-07 [0,0,0,1,0,0|1,0,2]=4 57 B8R1.2 OCC1CCNCC1 4H56-1-04 [0,0,0,1,0,0|1,0,1]=3 58 B8R1.2 OCC1CCOCC1 2H01-1-X5 [0,0,0,1,0,0|1,0,1]=3 59 B8R1.2 OC[C@H]1CNCCN1 4H33-5-R0 [0,0,0,1,0,0|2,0,1]=4 60 B8R1.2 OC[C@H]1COCCN1 4H56-5-SE [0,0,0,1,0,0|2,0,1]=4 61 B8R1.5 CC1CCCCC1O 2102-1-X1 [0,0,0,1,0,0|0,0,2]=3 62 B8R1.5 CC1CNCCC1O 4H56-5-B5 [0,0,0,1,0,0|1,0,1]=3 63 B8R1.5 NC1CCCCC1O 4256-1-X3 [0,0,0,1,0,0|1,0,2]=4 64 B8R1.5 N[C@@H]1CCCC[C@H]1O 4256-1-48 [0,0,0,1,0,0|1,0,2]=4 65 B8R1.5 N[C@@H]1CCCC[C@H]1O 4256-5-36 [0,0,0,1,0,0|1,0,2]=4 66 B8R1.5 N[C@H]1CCCC[C@H]1O 4256-5-49 [0,0,0,1,0,0|1,0,2]=4 67 B8R1.8 OCCC1=CC=CS1 6H01-1-01 [0,0,0,1,0,0|1,0,2]=4 68 B8R1.8 OCCC1=CSC=C1 6H01-1-12 [0,0,0,1,0,0|1,0,2]=4 69 B8R1.8 OCCN1C=CC=C1 4H01-1-66 [0,0,0,1,0,0|1,0,2]=4 70 B8R1.8 OCCN1C=CC=N1 4H01-1-U5 [0,0,0,1,0,0|2,0,1]=4 71 B8R1.8 OCCN1CCCC1 4H01-1-C9 [0,0,0,1,0,0|1,0,2]=4 72 B8R1.11 CN1C=CN=C1CO 4H01-1-V5 [0,0,0,1,0,0|2,0,1]=4 73 B8R1.11 CN1CCC[C@@H]1CO 4H56-1-RG [0,0,0,1,0,0|1,0,2]=4 74 B8R1.22 OC1CCCCCC1 2202-1-X0 [0,0,0,1,0,0|0,0,2]=3 75 B8R1.49 C1=CCCC=CCC1 1400-1-14 [0,0,0,1,0,0|1,0,1]=3 76 B8R1.49 C1=CCCC=CCC1 9445-5-00 [0,0,0,1,0,0|1,0,1]=3 77 B5R0.2 BrCCCCBr 1100-9-14 [2,0,0,0,0,0|2,0,0]=4 78 B5R0.2 BrC\C=C\CBr 1300-9-X6 [2,0,0,0,0,0|2,0,0]=4 79 B5R0.2 C#CCCCC 1500-1-X2 [2,0,0,0,0,0|1,0,1]=4 80 B5R0.2 C#CCCCO 2501-1-01 [2,0,0,0,0,0|0,0,2]=4 81 B5R0.2 C=CCCCBr 1300-9-13 [2,0,0,0,0,0|1,0,0]=3 82 B5R0.2 C=CCCCC 1300-1-48 [2,0,0,0,0,0|1,0,0]=3 83 B5R0.2 CCC#CCC 1500-1-09 [2,0,0,0,0,0|0,0,2]=4 84 B5R0.2 CCC#CCO 2501-1-13 [2,0,0,0,0,0|0,0,2]=4 85 B5R0.2 CCCCC=O 2115-1-00 [2,0,0,0,0,0|0,0,2]=4 86 B5R0.2 CCCCCC 1100-1-18 [2,0,0,0,0,0|0,0,1]=3 87 B5R0.2 CCCCCF 1100-3-65 [2,0,0,0,0,0|1,0,0]=3 88 B5R0.2 CCCCCN 3130-1-X6 [2,0,0,0,0,0|1,0,0]=3 89 B5R0.2 CCNCCN 3130-1-X2 [2,0,0,0,0,0|2,0,0]=4 90 B5R0.2 CCSCCCl 5166-5-01 [2,0,0,0,0,0|2,0,0]=4 91 B5R0.2 COCCCBr 2107-9-02 [2,0,0,0,0,0|2,0,0]=4 92 B5R0.2 CSCCCN 8166-1-X3 [2,0,0,0,0,0|2,0,0]=4 93 B5R0.2 ClCCCCI 1100-M-14 [2,0,0,0,0,0|2,0,0]=4 94 B5R0.2 FCCCCBr 1100-B-22 [2,0,0,0,0,0|2,0,0]=4 95 B5R0.2 ICCCCI 1100-H-14 [2,0,0,0,0,0|2,0,0]=4 96 B5R0.2 OCCCCF 2101-3-1V [2,0,0,0,0,0|1,0,0]=3 97 B5R0.2 SCCCCS 5161-1-05 [2,0,0,0,0,0|1,1,0]=4 98 B7R0.3 C=CC(=O)OCCO 2324-1-12 [1,1,0,0,0,0|1,0,1]=4 99 B7R0.3 CC\C=C\C(=O)OC 2323-1-17 [1,1,0,0,0,0|1,0,1]=4 100 B7R0.3 CC\C=C\C(=O)OC 2323-1-E2 [1,1,0,0,0,0|1,0,1]=4 101 B7R0.3 COC(=O)CCCBr 2123-9-0H [1,1,0,0,0,0|2,0,0]=4 102 B7R0.3 COC(=O)CCCN 4158-5-18 [1,1,0,0,0,0|2,0,0]=4 103 B7R0.4 CCCCCB(O)O 6160-1-07 [1,1,0,0,0,0|1,0,1]=4 104 B7R0.4 CCC\C=C\B(O)O 6360-1-E4 [1,1,0,0,0,0|2,0,0]=4 105 B7R0.4 CCC\C=C\C(=O)O 2321-1-08 [1,1,0,0,0,0|1,0,1]=4 106 B7R0.7 CCCC(=O)CCC 2117-1-15 [1,1,0,0,0,0|0,0,1]=3 107 B7R0.7 CCCC(Br)CCC 1100-9-23 [1,1,0,0,0,0|0,0,2]=4 108 B7R0.7 CCCC(Br)CCC 1100-9-23T [1,1,0,0,0,0|0,0,2]=4 109 B7R0.7 CCOC(=O)CCN 4158-5-01 [1,1,0,0,0,0|2,0,0]=4 110 B7R0.7 CCOC(=O)OCC 2123-1-11 [1,1,0,0,0,0|2,0,0]=4 111 B9R0.34 CCOC(=O)C[C@@H](O)CCl 2129-5-R1 [0,2,0,0,0,0|2,0,0]=4 112 B9R0.35 CCCC(Br)C(=O)OCC 2123-9-05 [0,2,0,0,0,0|2,0,0]=4 113 B9R0.35 CCCC(O)C(=O)OCC 2129-1-52 [0,2,0,0,0,0|2,0,0]=4 114 B9R0.2 CC(C)NCCCCCO 4156-1-4C [0,2,0,0,0,0|0,0,2]=4 115 B9R0.2 CCCCCCCC(=O)O 2121-1-X9 [0,2,0,0,0,0|0,0,2]=4 116 B9R0.45 CCCCCCCCCO 2101-1-13 [0,2,0,0,0,0|0,0,2]=4 117 B9R0.45 NCCOCCOCCO 4156-1-1D [0,2,0,0,0,0|1,0,1]=4 118 B9R0.45 OCCNCCNCCO 4156-1-69 [0,2,0,0,0,0|1,0,1]=4 119 B9R0.38 CCCC\C=C\C(F)(F)Br 1300-B-23 [0,2,0,0,0,0|2,0,0]=4 120 B7R1.1 BrCC1CCCC1 1200-9-X1 [1,0,0,1,0,0|1,0,1]=4 121 B7R1.1 CCC1=CC=CO1 2H10-1-17 [1,0,0,1,0,0|0,0,2]=4 122 B7R1.1 ICC1CCCC1 1200-H-X0 [1,0,0,1,0,0|1,0,1]=4 123 B7R1.1 NCC1CCOC1 4H56-1-Q2 [1,0,0,1,0,0|2,0,0]=4 124 B7R1.1 NCC1CCOC1 4H56-5-60 [1,0,0,1,0,0|2,0,0]=4 125 B7R1.1 OCC1CC=CC1 2401-1-06 [1,0,0,1,0,0|0,0,0]=2 126 B7R1.1 OCC1CCCC1 2301-1-X3 [1,0,0,1,0,0|0,0,1]=3 127 B7R1.1 OCC1CCCN1 4H01-1-95 [1,0,0,1,0,0|1,0,1]=4 128 B7R1.1 OCC1CCNC1 4H56-5-0C [1,0,0,1,0,0|1,0,0]=3 129 B7R1.1 OCC1CCOC1 2H10-1-34 [1,0,0,1,0,0|1,0,0]=3 130 B7R1.1 OC[C@@H]1CCCN1 4H01-1-M2 [1,0,0,1,0,0|1,0,1]=4 131 B7R1.1 OC[C@@H]1CCCO1 2H01-1-04 [1,0,0,1,0,0|1,0,1]=4 132 B7R1.1 OC[C@@H]1CCNC1 4H56-1-R0 [1,0,0,1,0,0|1,0,0]=3 133 B7R1.1 [C@H]1(CO)CCCN1 4H56-1-L1 [1,0,0,1,0,0|1,0,1]=4 134 B7R1.3 BrC1CCOCC1 2H10-9-19 [1,0,0,1,0,0|2,0,0]=4 135 B7R1.3 CC1=CCC=CC1 1200-1-0A [1,0,0,1,0,0|0,0,2]=4 136 B7R1.3 CC1=CCCCC1 1400-1-04 [1,0,0,1,0,0|1,0,0]=3 137 B7R1.3 CC1=CCCNC1 3H31-5-0N [1,0,0,1,0,0|2,0,0]=4 138 B7R1.3 CC1CCCCC1 1200-1-19 [1,0,0,1,0,0|0,0,2]=4 139 B7R1.3 CC1CCCCN1 3H31-1-00 [1,0,0,1,0,0|1,0,1]=4 140 B7R1.3 CC1CCNCC1 3H31-1-Q3 [1,0,0,1,0,0|1,0,1]=4 141 B7R1.3 CC1CNCCO1 4H56-1-9N [1,0,0,1,0,0|1,0,1]=4 142 B7R1.3 C[C@H]1CCCCN1 3H31-1-S5 [1,0,0,1,0,0|1,0,1]=4 143 B7R1.3 FC1CCCCC1 1200-3-02 [1,0,0,1,0,0|1,0,1]=4 144 B7R1.3 FC1CCNCC1 3H31-7-X9 [1,0,0,1,0,0|2,0,0]=4 145 B7R1.3 IC1CCOCC1 2H10-H-X0 [1,0,0,1,0,0|2,0,0]=4 146 B7R1.3 NC1CCOCC1 G311-A-59 [1,0,0,1,0,0|2,0,0]=4 147 B7R1.3 NC1CCOCC1 P911-A-50 [1,0,0,1,0,0|2,0,0]=4 148 B7R1.3 NC1CCSCC1 7H66-1-Y1 [1,0,0,1,0,0|2,0,0]=4 149 B7R1.3 O=C1C=CCCC1 2417-1-X1 [1,0,0,1,0,0|1,0,1]=4 150 B7R1.3 O=C1C=CCCO1 2H25-1-78 [1,0,0,1,0,0|1,0,1]=4 151 B7R1.3 O=C1CCCCO1 2H25-1-X4 [1,0,0,1,0,0|1,0,1]=4 152 B7R1.3 O=C1OCCCO1 2H28-1-13 [1,0,0,1,0,0|2,0,0]=4 153 B7R1.3 OC1CCCNC1 4H56-5-90 [1,0,0,1,0,0|1,0,1]=4 154 B7R1.3 OC1CCCOC1 2H10-1-41 [1,0,0,1,0,0|1,0,1]=4 155 B7R1.3 OC1CCNCC1 4H56-1-UJ [1,0,0,1,0,0|1,0,0]=3 156 B7R1.3 OC1CCOCC1 2H10-1-Y4 [1,0,0,1,0,0|1,0,0]=3 157 B7R1.3 O[C@@H]1CCCNC1 4H56-5-R4 [1,0,0,1,0,0|1,0,1]=4 158 B7R1.3 O[C@H]1CCCNC1 4H56-1-SD [1,0,0,1,0,0|1,0,1]=4 159 B7R1.3 SC1CCCCC1 5261-1-04 [1,0,0,1,0,0|0,1,1]=4 160 B7R1.3 [C@H]1(O)CCCNC1 4H56-5-L3 [1,0,0,1,0,0|1,0,1]=4 161 B7R1.3 [NH3+]C1CCOCC1 4H30-1-Y9 [1,0,0,1,0,0|2,0,0]=4 162 B7R1.4 O=C1NCCC1O 4H20-1-X1 [1,0,0,1,0,0|2,0,0]=4 163 B7R1.24 C1CCCNCC1 3H31-1-1H [1,0,0,1,0,0|1,0,1]=4 164 B7R1.24 C1CCCOCC1 2H10-1-0X [1,0,0,1,0,0|0,0,1]=3 165 B7R1.24 C1CNCCNC1 3H31-1-T8 [1,0,0,1,0,0|2,0,0]=4 166 B7R1.24 C1CNCCOC1 4H56-1-EA [1,0,0,1,0,0|1,0,0]=3 167 B9R1.2 CN1CCCC(CO)C1 4H56-1-XN [0,1,0,1,0,0|1,0,1]=4 168 B9R1.8 N#CCC1=CCCCC1 3437-1-X1 [0,1,0,1,0,0|1,0,1]=4 169 B9R1.8 OCCC1CCCNC1 4H01-5-0J [0,1,0,1,0,0|0,0,2]=4 170 B9R1.8 OCCC1CCNCC1 4H56-1-UP [0,1,0,1,0,0|0,0,2]=4 171 B9R1.8 OCCN1CCNCC1 4H56-1-7G [0,1,0,1,0,0|1,0,1]=4 172 B9R1.12 OCCCN1C=CN=C1 4H01-1-46 [0,1,0,1,0,0|1,0,1]=4 173 B9R1.50 O=C1CCCCCCC1 2217-1-X1 [0,1,0,1,0,0|1,0,1]=4 174 B9R1.1 CCC1CCC(=O)CC1 2217-1-12 [0,1,0,1,0,0|1,0,1]=4 175 B9R1.1 CN1CCC(CO)CC1 4H56-1-KU [0,1,0,1,0,0|1,0,1]=4 176 B9R1.11 COC(=O)C1=CCCC1 2423-1-04 [0,1,0,1,0,0|2,0,0]=4 177 B9R1.118 NC1(CO)CCCCC1 4256-1-X0 [0,1,0,1,0,0|0,0,2]=4 178 B9R1.6 CC(O)C1CCCCC1 2202-1-1H [0,1,0,1,0,0|0,0,2]=4 179 B9R1.6 O=C(O)C1CC=CCC1 2421-1-00 [0,1,0,1,0,0|0,0,1]=3 180 B9R1.6 O=C(O)[C@@H]1CC=CCC1 2421-1-S0 [0,1,0,1,0,0|0,0,1]=3 181 B9R1.6 O=C(O)[C@H]1CC=CCC1 2421-1-R0 [0,1,0,1,0,0|0,0,1]=3