0 B9R1.7 CCCC1CNC(=O)C1 4H48-1-0AU [1,0,0,0,0,0|2,0,0]=3 1 B9R1.7 COCC1COC(=O)O1 2H28-1-14 [1,0,0,0,0,0|2,0,0]=3 2 B9R1.7 COC[C@@H]1COC(=O)O1 2H28-1-R0 [1,0,0,0,0,0|2,0,0]=3 3 B9R1.7 COC[C@H]1COC(=O)O1 2H28-1-S0 [1,0,0,0,0,0|2,0,0]=3 4 B9R1.12 BrCCCC1OCCO1 2H10-9-0P [1,0,0,0,0,0|2,0,1]=4 5 B9R1.12 CCCCC1CCCN1 3H31-1-FC [1,0,0,0,0,0|1,0,1]=3 6 B9R1.12 CCCCN1CCCC1 3H32-1-44 [1,0,0,0,0,0|2,0,1]=4 7 B9R1.12 COCCC1CCCN1 4H07-1-78 [1,0,0,0,0,0|2,0,1]=4 8 B9R1.12 ClCCCC1OCCO1 2H08-5-03 [1,0,0,0,0,0|2,0,1]=4 9 B9R1.12 OCCCC1CCCC1 2201-1-X0 [1,0,0,0,0,0|2,0,1]=4 10 B11R1.15 CCOC(=O)[C@@H]1CCC(=O)N1 4H58-1-216 [0,1,0,0,0,0|2,0,1]=4 11 B11R1.15 CCOC(=O)[C@H]1CCC(=O)N1 4H58-1-R11 [0,1,0,0,0,0|2,0,1]=4 12 B11R1.27 C=CCOCC1COC(=O)O1 2H28-1-26 [0,1,0,0,0,0|1,0,2]=4 13 B11R1.27 CCCOCC1COC(=O)O1 2H28-1-15 [0,1,0,0,0,0|1,0,0]=2 14 B11R1.230 CCCCC1CC(=O)OC1=O 2H26-1-0J [0,1,0,0,0,0|2,0,1]=4 15 B11R1.230 CCCCC1OC(=O)CC1C 2H25-1-3D [0,1,0,0,0,0|0,0,0]=1 16 B9R0.2 C=C(Br)CCCCCCC 1300-9-07 [0,0,1,0,0,0|2,0,0]=3 17 B9R0.2 C=C(Br)CCCCCCCl 1300-D-02 [0,0,1,0,0,0|3,0,0]=4 18 B9R0.2 C=C(C)CCCCCCC 1300-1-34 [0,0,1,0,0,0|2,0,0]=3 19 B9R0.2 C=C(C)CCCCCCCl 1300-5-31 [0,0,1,0,0,0|3,0,0]=4 20 B9R0.2 C=C(Cl)CCCCCCC 1300-5-25 [0,0,1,0,0,0|2,0,0]=3 21 B9R0.2 C=C(Cl)CCCCCCCl 1300-5-34 [0,0,1,0,0,0|3,0,0]=4 22 B9R0.2 C=CCCCCCC(=O)O 2321-1-25 [0,0,1,0,0,0|0,0,2]=3 23 B9R0.2 CC(=O)CCOCCCCl 2117-5-0C [0,0,1,0,0,0|3,0,0]=4 24 B9R0.2 CC(=O)CCOCCCF 2117-3-0N [0,0,1,0,0,0|3,0,0]=4 25 B9R0.2 CC(=O)OCCCCCCl 2123-5-11 [0,0,1,0,0,0|3,0,0]=4 26 B9R0.2 CCCCCC#CC(=O)O 2521-1-00 [0,0,1,0,0,0|0,0,2]=3 27 B9R0.2 CCCCCCCC(=O)Cl 2116-5-15 [0,0,1,0,0,0|1,0,0]=2 28 B9R0.2 CCCCCCCC(C)O 2102-1-09 [0,0,1,0,0,0|1,0,1]=3 29 B9R0.2 CCCCCCC[C@@H](C)O 2102-1-R2 [0,0,1,0,0,0|1,0,1]=3 30 B9R0.2 CCCCCCC[C@H](C)O 2102-1-S2 [0,0,1,0,0,0|1,0,1]=3 31 B9R0.2 CCCCC\C=C\C(=O)O 2321-1-0M [0,0,1,0,0,0|0,0,2]=3 32 B9R0.2 CCCCC\C=C\C(C)=O 2317-1-0A [0,0,1,0,0,0|1,0,2]=4 33 B9R0.2 CCCCSCCC(=O)O 6166-1-08 [0,0,1,0,0,0|1,0,0]=2 34 B9R0.2 NOCCCCCC(=O)O 4121-9-02 [0,0,1,0,0,0|2,0,0]=3 35 B9R0.4 CCCCC(C)CC(C)C 1100-1-29 [0,0,1,0,0,0|2,0,1]=4 36 B9R0.18 CCCCC(O)CCCC 2102-1-06 [0,0,1,0,0,0|1,0,1]=3 37 B9R0.40 CCCCC(CC)C[Mg]Br 9112-9-0E [0,0,1,0,0,0|3,0,0]=4 38 B9R0.46 C=CC(=O)OCCOCC 2324-1-13 [0,0,1,0,0,0|1,0,2]=4 39 B9R0.46 CCCCCCC(=O)CC 2117-1-08 [0,0,1,0,0,0|1,0,0]=2 40 B9R0.46 CCCCCCC(O)CC 2102-1-10 [0,0,1,0,0,0|1,0,2]=4 41 B11R2.1 O=C1OC[C@H]2CNCCN12 4H25-5-R1 [0,0,0,1,0,0|3,0,0]=4 42 B11R2.10 O=C1OC2CCCCC2O1 2H28-1-08 [0,0,0,1,0,0|1,0,0]=2 43 B11R2.10 O=C1OC2OCCOC2O1 2H28-1-23 [0,0,0,1,0,0|3,0,0]=4 44 B11R2.116 N[C@@H]1CC[C@@H]2C[C@H]1C(=O)N2 4H48-1-QS [0,0,0,1,0,0|2,0,0]=3 45 B11R2.116 N[C@H]1CC[C@@H]2C[C@H]1C(=O)N2 4H48-1-QT [0,0,0,1,0,0|2,0,0]=3 46 B11R2.748 O=C1CC2(CCCC2)CN1 4H48-1-02M [0,0,0,1,0,0|2,0,0]=3 47 B11R2.748 O=C1CC2(CCNC2)CN1 4H48-5-BE [0,0,0,1,0,0|3,0,0]=4 48 B11R2.748 O=C1CCC2(CCNC2)N1 4H22-3-13 [0,0,0,1,0,0|2,0,0]=3 49 B11R2.748 O=C1CSC2(CCCC2)N1 8H70-1-8R [0,0,0,1,0,0|2,0,0]=3 50 B11R1.1 CCCCC1CCC(O)CC1 2202-1-1D [0,0,0,0,0,1|1,0,2]=4 51 B11R1.1 CCCCN1CCC(=O)CC1 4H17-1-63 [0,0,0,0,0,1|2,0,0]=3 52 B8R0.4 C=CCCCCCCC 1300-1-28 [1,0,1,0,0,0|1,0,0]=3 53 B8R0.4 C=CCCCCCCCl 1300-5-X2 [1,0,1,0,0,0|2,0,0]=4 54 B8R0.4 CCCCCCCCC 1100-1-37 [1,0,1,0,0,0|1,0,1]=4 55 B8R0.4 CCCCCCCCCl 1100-5-28 [1,0,1,0,0,0|1,0,1]=4 56 B8R0.4 CCCCCCCCI 1100-H-X2 [1,0,1,0,0,0|1,0,1]=4 57 B8R0.4 CCCCCCN=C=O 4149-1-16 [1,0,1,0,0,0|1,0,1]=4 58 B8R0.4 CCCCCCOCC 2107-1-14 [1,0,1,0,0,0|2,0,0]=4 59 B8R0.7 C#CCCCCC(=O)O 2521-1-04 [1,0,1,0,0,0|0,0,2]=4 60 B8R0.7 C=C(Br)CCCCCC 1300-9-08 [1,0,1,0,0,0|2,0,0]=4 61 B8R0.7 C=C(Cl)CCCCCC 1300-5-26 [1,0,1,0,0,0|2,0,0]=4 62 B8R0.7 C=CCCCCC(=O)O 2321-1-0N [1,0,1,0,0,0|0,0,2]=4 63 B8R0.7 CC(=O)OCCCCBr 2123-9-19 [1,0,1,0,0,0|1,0,0]=3 64 B8R0.7 CC(=O)OCCCCCl 2123-5-0W [1,0,1,0,0,0|1,0,0]=3 65 B8R0.7 CC(=O)OCCCCI 2123-H-02 [1,0,1,0,0,0|1,0,0]=3 66 B8R0.7 CCCCC#CC(=O)O 2521-1-0A [1,0,1,0,0,0|0,0,2]=4 67 B8R0.7 CCCCCCB(O)O 6160-1-00 [1,0,1,0,0,0|1,0,1]=4 68 B8R0.7 CCCCCCC(C)=O 2117-1-X1 [1,0,1,0,0,0|1,0,0]=3 69 B8R0.7 CCCCCC[C@@H](C)O 2102-1-R1 [1,0,1,0,0,0|1,0,1]=4 70 B8R0.7 CCCCCO[N+](=O)[O-] 4154-1-0B [1,0,1,0,0,0|2,0,0]=4 71 B8R0.7 CCCCOCC(=O)O 2121-1-52 [1,0,1,0,0,0|1,0,0]=3 72 B8R0.7 COCCOCC(=O)O 2121-1-33A [1,0,1,0,0,0|2,0,0]=4 73 B8R0.7 COCCOCC(=O)O 2121-1-33B [1,0,1,0,0,0|2,0,0]=4 74 B8R0.7 COCCOCC(=O)O 2121-1-33C [1,0,1,0,0,0|2,0,0]=4 75 B8R0.7 CSCCCOC(C)=O 6166-1-0K [1,0,1,0,0,0|1,0,0]=3 76 B8R0.7 NC(=O)CCCCCBr 4148-9-07 [1,0,1,0,0,0|2,0,0]=4 77 B8R0.7 NCCCCCC(=O)O 4157-1-0B [1,0,1,0,0,0|1,0,0]=3 78 B8R0.7 O=C(O)CCCCCCl 2121-5-06 [1,0,1,0,0,0|1,0,0]=3 79 B8R0.7 O=C(O)CCCCCO 2129-1-0D [1,0,1,0,0,0|1,0,0]=3 80 B8R0.1 CCCCC(O)CCC 2102-1-0D [1,0,1,0,0,0|0,0,1]=3 81 B8R0.11 CCCCC(CC)CN 3130-1-0E [1,0,1,0,0,0|1,0,1]=4 82 B8R0.6 CCC(=O)OCCCCl 2123-5-0T [1,0,1,0,0,0|1,0,0]=3 83 B8R0.6 CCC(=O)OCCCF 2123-3-5Q [1,0,1,0,0,0|1,0,0]=3 84 B8R0.6 CCCCCC(=O)OC 2123-1-90 [1,0,1,0,0,0|1,0,0]=3 85 B8R0.6 CCCCNC(=O)CC 4148-1-0Y [1,0,1,0,0,0|1,0,0]=3 86 B8R0.6 CCCCNC(=O)CCl 4148-5-0F [1,0,1,0,0,0|2,0,0]=4 87 B8R0.6 CCCCOC(=O)CF 2123-3-X1 [1,0,1,0,0,0|1,0,0]=3 88 B8R0.6 CCNCCC(=O)OC 4158-1-0D [1,0,1,0,0,0|2,0,0]=4 89 B8R0.6 COC(=O)CCCCBr 2123-9-14 [1,0,1,0,0,0|2,0,0]=4 90 B8R0.6 COC(=O)CCCCCl 2123-5-1C [1,0,1,0,0,0|2,0,0]=4 91 B8R0.6 COC(=O)CCCCN 4158-5-0A [1,0,1,0,0,0|2,0,0]=4 92 B8R0.6 COC(=O)OCCCCl 2128-5-0P [1,0,1,0,0,0|2,0,0]=4 93 B8R0.6 COCCCC(=O)OC G311-A-58 [1,0,1,0,0,0|2,0,0]=4 94 B8R0.6 COCCOC(=O)CCl 2123-5-1J [1,0,1,0,0,0|2,0,0]=4 95 B8R0.6 O=C(CO)OCCCCl 2129-5-0C [1,0,1,0,0,0|2,0,0]=4 96 B8R0.6 O=C(CO)OCCCF 2129-3-0N [1,0,1,0,0,0|2,0,0]=4 97 B8R1.1 CCC1CCC(=O)O1 2H25-1-20 [2,0,0,0,0,0|0,0,0]=2 98 B8R1.1 NCC1CCC(=O)N1 4H48-1-QQ [2,0,0,0,0,0|2,0,0]=4 99 B8R1.1 O=C1CC[C@@H](CBr)N1 4H48-9-S0 [2,0,0,0,0,0|2,0,0]=4 100 B8R1.1 O=C1CC[C@@H](CO)N1 4H48-1-KC [2,0,0,0,0,0|2,0,0]=4 101 B8R1.1 O=C1CC[C@@H](CO)O1 2H20-1-01 [2,0,0,0,0,0|1,0,0]=3 102 B8R1.1 O=C1CC[C@H](CBr)N1 4H48-9-R0 [2,0,0,0,0,0|2,0,0]=4 103 B8R1.1 O=C1NC[C@H](CO)O1 4H56-1-RP [2,0,0,0,0,0|2,0,0]=4 104 B8R1.1 O=C1OCC(CBr)O1 2H28-9-00 [2,0,0,0,0,0|2,0,0]=4 105 B8R1.1 O=C1OCC(CF)O1 2H28-3-05 [2,0,0,0,0,0|2,0,0]=4 106 B10R0.3 CCCC(S)CCOC(C)=O 6160-1-X2 [0,1,1,0,0,0|2,0,0]=4 107 B10R0.3 CCOC(=O)CCCC(=O)O 2123-1-76 [0,1,1,0,0,0|1,0,1]=4 108 B10R0.4 C=C(Br)CCCCCCCC 1300-9-06 [0,1,1,0,0,0|2,0,0]=4 109 B10R0.4 C=C(Br)CCCCCCCCl 1300-D-01 [0,1,1,0,0,0|2,0,0]=4 110 B10R0.4 C=C(C)CCCCCCCC 1300-1-33 [0,1,1,0,0,0|2,0,0]=4 111 B10R0.4 C=C(C)CCCCCCCCl 1300-5-29 [0,1,1,0,0,0|2,0,0]=4 112 B10R0.4 C=C(Cl)CCCCCCCC 1300-5-24 [0,1,1,0,0,0|2,0,0]=4 113 B10R0.4 C=C(Cl)CCCCCCCCl 1300-5-33 [0,1,1,0,0,0|2,0,0]=4 114 B10R0.4 CCCCCCC#CC(=O)O 2521-1-10 [0,1,1,0,0,0|0,0,1]=3 115 B10R0.4 CCCCCCCCB(O)O 6160-1-12 [0,1,1,0,0,0|1,0,1]=4 116 B10R0.4 CCCCCCCC[C@@H](C)O 2101-1-X1 [0,1,1,0,0,0|1,0,1]=4 117 B10R0.4 O=C(O)CCCCCCCO 2129-1-51 [0,1,1,0,0,0|0,0,0]=2 118 B10R0.74 CCCCCCCC(=O)CC 2117-1-07 [0,1,1,0,0,0|1,0,0]=3 119 B10R0.74 CCCCCCCC(=O)OC 2123-1-50 [0,1,1,0,0,0|0,0,0]=2 120 B10R0.74 CCCCC\C=C\C(=O)OC 2323-1-25 [0,1,1,0,0,0|0,0,2]=4 121 B10R0.74 COC(=O)CCCCCC=O 2123-1-62 [0,1,1,0,0,0|1,0,1]=4 122 B10R0.74 COC(=O)CCCCCCBr 2123-9-0P [0,1,1,0,0,0|1,0,0]=3 123 B10R0.74 COC(=O)CCCCCCN 4158-5-0C [0,1,1,0,0,0|1,0,0]=3 124 B10R0.75 CCCCCCC(Br)C(=O)Br 2116-9-10 [0,1,1,0,0,0|1,0,0]=3 125 B10R0.75 CCCCCCC(Br)C(=O)O 2121-9-17 [0,1,1,0,0,0|0,0,0]=2 126 B10R0.75 CCCCSC[C@H](N)C(=O)O 8166-1-R2 [0,1,1,0,0,0|1,0,0]=3 127 B10R0.75 O=C(O)C(=O)CCCCCBr 2129-9-02 [0,1,1,0,0,0|1,0,1]=4 128 B10R0.96 CC(=O)OCC(C)OC(C)=O 2123-1-83 [0,1,1,0,0,0|1,0,1]=4 129 B10R1.54 CC(C)C[C@H]1COC(=O)N1 4H56-1-S63 [1,1,0,0,0,0|2,0,0]=4 130 B10R1.54 O=C(O)CC1CCC(=O)O1 2H21-1-09 [1,1,0,0,0,0|1,0,1]=4 131 B10R1.21 BrCCCCC1OCCO1 2H10-9-58 [1,1,0,0,0,0|1,0,1]=4 132 B10R1.21 ClCCCCC1OCCO1 2H08-5-00 [1,1,0,0,0,0|1,0,1]=4 133 B12R1.7 CCCCCCC1CCC(=O)O1 2H25-1-17 [0,2,0,0,0,0|0,0,0]=2 134 B12R1.7 O=C1OCC(COCCCF)O1 2H28-3-12 [0,2,0,0,0,0|1,0,0]=3 135 B12R1.105 O=C1OCC(COCC(F)F)O1 2H28-3-11 [0,2,0,0,0,0|2,0,0]=4 136 B10R1.10 CCCC1CCCC(=O)C1 2217-1-34 [0,0,1,1,0,0|1,0,0]=3 137 B10R1.18 NC(=O)CC1CCOCC1 4H48-1-3S [0,0,1,1,0,0|2,0,0]=4 138 B10R1.18 NC(=O)NC1CCCCC1 4253-1-02 [0,0,1,1,0,0|2,0,0]=4 139 B10R1.18 O=C(O)CC1CCCCN1 4H58-5-9H [0,0,1,1,0,0|1,0,0]=3 140 B10R1.18 O=C(O)CC1CCCNC1 4H58-1-G2 [0,0,1,1,0,0|1,0,0]=3 141 B10R1.18 O=C(O)CC1CNCCO1 4H21-5-2M [0,0,1,1,0,0|2,0,0]=4 142 B10R1.18 O=C(O)CC1COCCO1 2H21-1-49 [0,0,1,1,0,0|2,0,0]=4 143 B10R1.18 O=C(O)CN1CCOCC1 4H58-1-088 [0,0,1,1,0,0|2,0,0]=4 144 B10R1.18 O=C(O)C[C@@H]1CCCCN1 4H56-1-GP [0,0,1,1,0,0|1,0,0]=3 145 B10R1.18 OB(O)CC1CCCCC1 6260-1-05 [0,0,1,1,0,0|1,0,1]=4 146 B10R1.39 CCN1CCCC1C(=O)O 4H58-1-00U [0,0,1,1,0,0|1,0,0]=3 147 B10R1.39 CCN1CCC[C@@H]1C(=O)O 4H57-1-1N [0,0,1,1,0,0|1,0,0]=3 148 B10R1.39 CCN1CCC[C@H]1C(N)=O 4H48-1-SM [0,0,1,1,0,0|2,0,0]=4 149 B10R1.61 CC1CCCC=C1C(=O)O 2421-1-12 [0,0,1,1,0,0|0,0,2]=4 150 B10R1.61 CC1CCCCC1C(=O)O 2221-1-1J [0,0,1,1,0,0|0,0,0]=2 151 B10R1.61 CC1CNCCC1C(=O)O 4H58-5-6B [0,0,1,1,0,0|1,0,0]=3 152 B10R1.61 CN1CCCC[C@@H]1C(=O)O 4H56-1-JS [0,0,1,1,0,0|1,0,0]=3 153 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O 4257-1-19 [0,0,1,1,0,0|1,0,0]=3 154 B10R1.61 O=C(O)C1CCCCC1O 2229-1-1P [0,0,1,1,0,0|1,0,0]=3 155 B10R1.61 O=C(O)C1CCNCC1F 4H58-7-51 [0,0,1,1,0,0|2,0,0]=4 156 B10R1.77 O=C1CCCCCC(=O)O1 2H26-1-10 [0,0,1,1,0,0|1,0,1]=4 157 B10R1.348 N=C(N)C1CCCCCC1 3241-5-04 [0,0,1,1,0,0|2,0,0]=4 158 B10R1.348 NC(=O)C1CCCCCC1 4248-1-0D [0,0,1,1,0,0|1,0,0]=3 159 B10R1.348 O=C(O)C1CCCNCC1 4H58-1-H9 [0,0,1,1,0,0|1,0,0]=3 160 B10R1.1 CN1CCC(CC=O)CC1 4H15-1-38 [0,0,1,1,0,0|2,0,0]=4 161 B10R1.15 CCC(=O)N1CCNCC1 4H48-5-C5 [0,0,1,1,0,0|2,0,0]=4 162 B10R1.15 COC(=O)C1CCCCC1 2223-1-56 [0,0,1,1,0,0|2,0,0]=4 163 B10R1.15 COC(=O)N1CCCCC1 4H56-1-08A [0,0,1,1,0,0|2,0,0]=4 164 B10R2.2 O=C1CC2CNCC2C1 4H56-5-D3 [1,0,0,1,0,0|2,0,0]=4 165 B10R2.2 O=C1CC2CSCC2C1 6H66-1-62 [1,0,0,1,0,0|2,0,0]=4 166 B10R2.14 O=C1CC(C2CC2)CN1 4H48-1-04N [1,0,0,1,0,0|2,0,0]=4 167 B10R2.32 O=C1CCC2CNCC12 4H56-5-CD [1,0,0,1,0,0|2,0,0]=4 168 B10R2.7 C1CCC2CNCC2C1 3H31-1-5S [1,0,0,1,0,0|2,0,0]=4 169 B10R2.7 [C@H]12CCCC[C@H]1CNC2 3H31-5-6H [1,0,0,1,0,0|2,0,0]=4 170 B10R2.483 C1CCC2(C1)CCNC2 4H22-1-73 [1,0,0,1,0,0|2,0,0]=4 171 B10R2.316 O=C1CC2(CCCC2)N1 4H48-1-09Z [0,0,0,1,1,0|1,0,0]=3 172 B12R2.24 O=C1CCC2CCCCC2C1 2217-1-27 [0,0,0,1,0,1|1,0,0]=3 173 B12R2.1081 O=C1COC[C@H]2CNCCN12 4H17-5-1N [0,0,0,1,0,1|2,0,0]=4 174 B12R2.2918 O=C1CC2(CCCCC2)CN1 4H48-1-JW [0,1,0,1,0,0|2,0,0]=4 175 B12R2.2918 O=C1CC2(CCCNC2)CN1 4H48-1-0AB [0,1,0,1,0,0|2,0,0]=4 176 B12R2.2918 O=C1CC2(CCNCC2)CN1 4H48-1-68 [0,1,0,1,0,0|2,0,0]=4 177 B12R2.2918 O=C1CC2(CCOCC2)CN1 4H48-1-AR [0,1,0,1,0,0|2,0,0]=4 178 B12R2.2918 O=C1CCC2(CCCNC2)O1 4H58-5-C3 [0,1,0,1,0,0|0,0,0]=2 179 B12R2.2918 O=C1COC2(CCCCC2)O1 2H25-1-3G [0,1,0,1,0,0|1,0,0]=3 180 B12R2.2918 O=C1CSC2(CCCCC2)N1 8H70-1-8Q [0,1,0,1,0,0|2,0,0]=4 181 B8R0.8 CC(=O)N(C)CCCN 4148-5-0E [0,0,1,0,1,0|2,0,0]=4 182 B8R0.8 CCCCC(Br)C(=O)O 2121-9-16 [0,0,1,0,1,0|2,0,0]=4 183 B8R0.8 CCCCC(C)C(=O)O 2121-1-0S [0,0,1,0,1,0|1,0,0]=3