0 B9R0.2 C=C(Br)CCCCCCC 1300-9-07 [0,0,0,0,0,0|1,0,2]=3 1 B9R0.2 C=C(Br)CCCCCCCl 1300-D-02 [0,0,0,0,0,0|2,0,2]=4 2 B9R0.2 C=C(C)CCCCCC#N 3337-1-X2 [0,0,0,0,0,0|2,0,2]=4 3 B9R0.2 C=C(C)CCCCCCC 1300-1-34 [0,0,0,0,0,0|1,0,1]=2 4 B9R0.2 C=C(C)CCCCCCCl 1300-5-31 [0,0,0,0,0,0|2,0,1]=3 5 B9R0.2 C=C(Cl)CCCCCCC 1300-5-25 [0,0,0,0,0,0|1,0,2]=3 6 B9R0.2 C=C(Cl)CCCCCCCl 1300-5-34 [0,0,0,0,0,0|2,0,2]=4 7 B9R0.2 C=CCCCCCC(=O)O 2321-1-25 [0,0,0,0,0,0|1,0,3]=4 8 B9R0.2 CC(=O)CCOCCCCl 2117-5-0C [0,0,0,0,0,0|2,0,2]=4 9 B9R0.2 CC(=O)CCOCCCF 2117-3-0N [0,0,0,0,0,0|2,0,2]=4 10 B9R0.2 CC(=O)OCCCCCCl 2123-5-11 [0,0,0,0,0,0|2,0,2]=4 11 B9R0.2 CCCCCC#CC(=O)O 2521-1-00 [0,0,0,0,0,0|1,0,3]=4 12 B9R0.2 CCCCCCCC(=O)Cl 2116-5-15 [0,0,0,0,0,0|1,0,2]=3 13 B9R0.2 CCCCCCCC(C)O 2102-1-09 [0,0,0,0,0,0|0,0,0]=0 14 B9R0.2 CCCCCCC[C@@H](C)O 2102-1-R2 [0,0,0,0,0,0|0,0,0]=0 15 B9R0.2 CCCCCCC[C@H](C)O 2102-1-S2 [0,0,0,0,0,0|0,0,0]=0 16 B9R0.2 CCCCC\C=C\C(=O)O 2321-1-0M [0,0,0,0,0,0|1,0,3]=4 17 B9R0.2 CCCCC\C=C\C(C)=O 2317-1-0A [0,0,0,0,0,0|0,0,4]=4 18 B9R0.2 CCCCSCCC(=O)O 6166-1-08 [0,0,0,0,0,0|2,0,1]=3 19 B9R0.2 NOCCCCCC(=O)O 4121-9-02 [0,0,0,0,0,0|3,0,1]=4 20 B8R0.4 C#CCCCCCCO 2501-1-0A [1,0,0,0,0,0|0,0,2]=3 21 B8R0.4 C=CCCCCCCC 1300-1-28 [1,0,0,0,0,0|0,0,2]=3 22 B8R0.4 C=CCCCCCCCl 1300-5-X2 [1,0,0,0,0,0|1,0,2]=4 23 B8R0.4 CCCCC#CCCO 2501-1-12 [1,0,0,0,0,0|0,0,2]=3 24 B8R0.4 CCCCCCCCC 1100-1-37 [1,0,0,0,0,0|0,0,0]=1 25 B8R0.4 CCCCCCCCCl 1100-5-28 [1,0,0,0,0,0|1,0,0]=2 26 B8R0.4 CCCCCCCCI 1100-H-X2 [1,0,0,0,0,0|1,0,0]=2 27 B8R0.4 CCCCCCN=C=O 4149-1-16 [1,0,0,0,0,0|1,0,2]=4 28 B8R0.4 CCCCCCOCC 2107-1-14 [1,0,0,0,0,0|1,0,0]=2 29 B8R0.4 CCCCOCCCCl 2107-5-0W [1,0,0,0,0,0|2,0,0]=3 30 B8R0.4 CCCCOCCCF 2107-3-6D [1,0,0,0,0,0|2,0,0]=3 31 B8R0.4 CCCCSCCCC 5166-1-04 [1,0,0,0,0,0|1,0,0]=2 32 B8R0.4 CCC\C=C\CCCC 1300-1-19 [1,0,0,0,0,0|0,0,2]=3 33 B8R0.4 COCCNCCOC 4156-1-1J [1,0,0,0,0,0|3,0,0]=4 34 B8R0.4 COCCOCCCCl 2108-5-08 [1,0,0,0,0,0|3,0,0]=4 35 B8R0.4 COCCOCCCF 2108-3-1P [1,0,0,0,0,0|3,0,0]=4 36 B8R0.4 ClCCCOCCCCl 2107-5-0S [1,0,0,0,0,0|3,0,0]=4 37 B8R0.4 FCCCOCCCF 2107-3-1A [1,0,0,0,0,0|3,0,0]=4 38 B8R0.4 N#CCCCCCCBr 3137-9-X0 [1,0,0,0,0,0|2,0,1]=4 39 B8R0.7 C=C(Br)CCCCCC 1300-9-08 [1,0,0,0,0,0|1,0,2]=4 40 B8R0.7 C=C(C)CCCCCCl 1300-5-32 [1,0,0,0,0,0|2,0,1]=4 41 B8R0.7 C=C(Cl)CCCCCC 1300-5-26 [1,0,0,0,0,0|1,0,2]=4 42 B8R0.7 CC(C)CNCCCO 4256-1-0Y [1,0,0,0,0,0|3,0,0]=4 43 B8R0.7 CC(C)COCCCN 4156-1-3S [1,0,0,0,0,0|3,0,0]=4 44 B8R0.7 CC(C)NCCCCO 4131-1-01 [1,0,0,0,0,0|3,0,0]=4 45 B8R0.7 CCCCCCB(O)O 6160-1-00 [1,0,0,0,0,0|2,0,0]=3 46 B8R0.7 CCCCCCC(C)=O 2117-1-X1 [1,0,0,0,0,0|0,0,2]=3 47 B8R0.7 CCCCCCC(C)I 1100-H-15 [1,0,0,0,0,0|1,0,0]=2 48 B8R0.7 CCCCCC[C@@H](C)N 3130-1-R2 [1,0,0,0,0,0|1,0,0]=2 49 B8R0.7 CCCCCC[C@@H](C)O 2102-1-R1 [1,0,0,0,0,0|0,0,0]=1 50 B8R0.7 CCCCCC[C@H](C)N 3130-1-S2 [1,0,0,0,0,0|1,0,0]=2 51 B8R0.7 CCCCOCC(=O)O 2121-1-52 [1,0,0,0,0,0|2,0,1]=4 52 B8R0.7 CCCCOCC(C)F 2107-3-6C [1,0,0,0,0,0|2,0,0]=3 53 B8R0.7 CCCCOCC(F)F 2107-3-6H [1,0,0,0,0,0|3,0,0]=4 54 B8R0.7 CCNCCCN(C)C 3132-1-0H [1,0,0,0,0,0|3,0,0]=4 55 B8R0.7 CN(C)CCCCCN 3130-1-0B [1,0,0,0,0,0|3,0,0]=4 56 B8R0.7 COCCOCC(C)F 2108-3-1N [1,0,0,0,0,0|3,0,0]=4 57 B8R0.7 NCCCCCC(=O)O 4157-1-0B [1,0,0,0,0,0|2,0,1]=4 58 B8R0.7 O=C(O)CCCCCCl 2121-5-06 [1,0,0,0,0,0|2,0,1]=4 59 B8R0.7 O=C(O)CCCCCO 2129-1-0D [1,0,0,0,0,0|2,0,1]=4 60 B10R0.3 CCCC(S)CCOC(C)=O 6160-1-X2 [0,1,0,0,0,0|1,0,2]=4 61 B10R0.4 C=C(Br)CCCCCCCC 1300-9-06 [0,1,0,0,0,0|1,0,2]=4 62 B10R0.4 C=C(Br)CCCCCCCCl 1300-D-01 [0,1,0,0,0,0|1,0,2]=4 63 B10R0.4 C=C(C)CCCCCCC#N 3337-1-X3 [0,1,0,0,0,0|1,0,2]=4 64 B10R0.4 C=C(C)CCCCCCCC 1300-1-33 [0,1,0,0,0,0|1,0,1]=3 65 B10R0.4 C=C(C)CCCCCCCCl 1300-5-29 [0,1,0,0,0,0|1,0,1]=3 66 B10R0.4 C=C(Cl)CCCCCCCC 1300-5-24 [0,1,0,0,0,0|1,0,2]=4 67 B10R0.4 C=C(Cl)CCCCCCCCl 1300-5-33 [0,1,0,0,0,0|1,0,2]=4 68 B10R0.4 CCCCCCC#CC(=O)O 2521-1-10 [0,1,0,0,0,0|1,0,2]=4 69 B10R0.4 CCCCCCCCB(O)O 6160-1-12 [0,1,0,0,0,0|2,0,0]=3 70 B10R0.4 CCCCCCCCN(C)C 3132-1-12 [0,1,0,0,0,0|2,0,0]=3 71 B10R0.4 CCCCCCCC[C@@H](C)O 2101-1-X1 [0,1,0,0,0,0|0,0,0]=1 72 B10R0.4 CCCCCC\C=C\B(O)O 6360-1-E5 [0,1,0,0,0,0|2,0,1]=4 73 B10R0.4 O=C(O)CCCCCCCO 2129-1-51 [0,1,0,0,0,0|1,0,1]=3 74 B10R0.6 C=CCCCC(O)CC(C)O 2304-1-02 [0,1,0,0,0,0|0,0,2]=3 75 B10R0.22 CCCCCCCC(F)(F)F 1100-3-3R [0,1,0,0,0,0|2,0,0]=3 76 B10R0.22 NCCCCCCC(F)(F)F 3130-3-25 [0,1,0,0,0,0|3,0,0]=4 77 B10R0.74 CCCCCCCC(=O)CC 2117-1-07 [0,1,0,0,0,0|0,0,2]=3 78 B10R0.74 CCCCCCCC(=O)OC 2123-1-50 [0,1,0,0,0,0|0,0,2]=3 79 B10R0.74 COC(=O)CCCCCCBr 2123-9-0P [0,1,0,0,0,0|1,0,2]=4 80 B10R0.74 COC(=O)CCCCCCN 4158-5-0C [0,1,0,0,0,0|1,0,2]=4 81 B10R0.75 CCCCCCC(Br)C(=O)Br 2116-9-10 [0,1,0,0,0,0|1,0,2]=4 82 B10R0.75 CCCCCCC(Br)C(=O)O 2121-9-17 [0,1,0,0,0,0|1,0,1]=3 83 B10R0.75 CCCCSC[C@H](N)C(=O)O 8166-1-R2 [0,1,0,0,0,0|2,0,1]=4 84 B10R1.10 CCCC1CCCC(=O)C1 2217-1-34 [0,0,0,1,0,0|0,0,2]=3 85 B10R1.10 CCCN1CCCC(N)C1 3H30-1-UX [0,0,0,1,0,0|2,0,0]=3 86 B10R1.10 CN1CCCC(CCN)C1 3H30-1-DY [0,0,0,1,0,0|3,0,0]=4 87 B10R1.10 CN1CCCC(CCO)C1 4H01-1-B1 [0,0,0,1,0,0|3,0,0]=4 88 B10R1.10 NCCN1CCCC(O)C1 4H56-1-0AD [0,0,0,1,0,0|2,0,0]=3 89 B10R1.18 CC(C)CC1CCCCN1 3H31-5-BD [0,0,0,1,0,0|2,0,0]=3 90 B10R1.18 CC(C)N[C@H]1CCCNC1 3H31-5-S1 [0,0,0,1,0,0|3,0,0]=4 91 B10R1.18 CC(C)OC1CCNCC1 4H07-1-3U [0,0,0,1,0,0|3,0,0]=4 92 B10R1.18 CC(N)CN1CCCCC1 3H30-1-VU [0,0,0,1,0,0|2,0,0]=3 93 B10R1.18 CN(C)CC1CCCCN1 3H32-5-LA [0,0,0,1,0,0|3,0,0]=4 94 B10R1.18 CN(C)CC1CCCNC1 3H32-1-3P [0,0,0,1,0,0|3,0,0]=4 95 B10R1.18 CN(C)CC1CCNCC1 3H31-1-W6 [0,0,0,1,0,0|3,0,0]=4 96 B10R1.18 O=C(O)CC1CCCCN1 4H58-5-9H [0,0,0,1,0,0|2,0,1]=4 97 B10R1.18 O=C(O)CC1CCCNC1 4H58-1-G2 [0,0,0,1,0,0|2,0,1]=4 98 B10R1.18 O=C(O)C[C@@H]1CCCCN1 4H56-1-GP [0,0,0,1,0,0|2,0,1]=4 99 B10R1.18 OB(O)CC1CCCCC1 6260-1-05 [0,0,0,1,0,0|2,0,0]=3 100 B10R1.18 OB(O)CC1CCOCC1 6H60-1-3A [0,0,0,1,0,0|3,0,0]=4 101 B10R1.38 COC1CCNCC1(C)C 4H56-1-799 [0,0,0,1,0,0|3,0,0]=4 102 B10R1.38 C[C@]1(N)CCCC[C@H]1CO 4256-5-32 [0,0,0,1,0,0|2,0,0]=3 103 B10R1.38 C[C@]1(O)CCCC[C@H]1CN 4256-5-31 [0,0,0,1,0,0|1,0,0]=2 104 B10R1.38 C[N+]1(C)CCCCC1CBr 3H33-9-05 [0,0,0,1,0,0|3,0,0]=4 105 B10R1.39 CCN1CCCC1C(=O)O 4H58-1-00U [0,0,0,1,0,0|2,0,1]=4 106 B10R1.39 CCN1CCC[C@@H]1C(=O)O 4H57-1-1N [0,0,0,1,0,0|2,0,1]=4 107 B10R1.61 CC1CCCCC1C(=O)O 2221-1-1J [0,0,0,1,0,0|1,0,1]=3 108 B10R1.61 CC1CNCCC1C(=O)O 4H58-5-6B [0,0,0,1,0,0|2,0,1]=4 109 B10R1.61 CN(C)[C@H]1CCCC[C@@H]1N 3232-1-03 [0,0,0,1,0,0|3,0,0]=4 110 B10R1.61 CN1CCCC[C@@H]1C(=O)O 4H56-1-JS [0,0,0,1,0,0|2,0,1]=4 111 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O 4257-1-19 [0,0,0,1,0,0|2,0,1]=4 112 B10R1.61 O=C(O)C1CCCCC1O 2229-1-1P [0,0,0,1,0,0|2,0,1]=4 113 B10R1.66 O=C(Cl)CCC1CCCC1 2216-5-08 [0,0,0,1,0,0|1,0,2]=4 114 B10R1.66 O=C(O)CCC1CCCO1 2H21-1-0X [0,0,0,1,0,0|2,0,1]=4 115 B10R1.66 O=C(O)COC1CCCC1 2221-1-0H [0,0,0,1,0,0|2,0,1]=4 116 B10R1.348 N=C(N)C1CCCCCC1 3241-5-04 [0,0,0,1,0,0|2,0,1]=4 117 B10R1.348 NC(=O)C1CCCCCC1 4248-1-0D [0,0,0,1,0,0|1,0,2]=4 118 B10R1.348 O=C(O)C1CCCNCC1 4H58-1-H9 [0,0,0,1,0,0|2,0,1]=4 119 B10R1.375 CCCCCC1CC1(Br)Br 1200-9-08 [0,0,0,1,0,0|2,0,0]=3 120 B7R0.1 C#CCCCCCO 2501-1-0B [2,0,0,0,0,0|0,0,2]=4 121 B7R0.1 C=CCCCCCO 2301-1-0C [2,0,0,0,0,0|0,0,2]=4 122 B7R0.1 CCCC#CCCC 1500-1-12 [2,0,0,0,0,0|0,0,2]=4 123 B7R0.1 CCCC#CCCO 2501-1-10 [2,0,0,0,0,0|0,0,2]=4 124 B7R0.1 CCCCC#CCO 2501-1-06 [2,0,0,0,0,0|0,0,2]=4 125 B7R0.1 CCCCCCC#N 3137-1-X1 [2,0,0,0,0,0|1,0,1]=4 126 B7R0.1 CCCCCCC=O 2115-1-10 [2,0,0,0,0,0|0,0,2]=4 127 B7R0.1 CCCCCCCBr 1100-9-07 [2,0,0,0,0,0|1,0,0]=3 128 B7R0.1 CCCCCCCCl 1100-5-42 [2,0,0,0,0,0|1,0,0]=3 129 B7R0.1 CCCCCCCI 1100-H-11 [2,0,0,0,0,0|1,0,0]=3 130 B7R0.1 CCCCCC[Mg]Cl 9112-5-00 [2,0,0,0,0,0|2,0,0]=4 131 B7R0.1 CCCCCOCC 2107-1-15 [2,0,0,0,0,0|1,0,0]=3 132 B7R0.1 CCCCNCCN 3131-1-03 [2,0,0,0,0,0|2,0,0]=4 133 B7R0.1 CCCCOCCBr 2107-9-07 [2,0,0,0,0,0|2,0,0]=4 134 B7R0.1 CCCCOCCCl 2107-5-0M [2,0,0,0,0,0|2,0,0]=4 135 B7R0.1 CCCOCCCCl 2107-5-0Z [2,0,0,0,0,0|2,0,0]=4 136 B7R0.1 CCCOCCCF 2107-3-7R [2,0,0,0,0,0|2,0,0]=4 137 B7R0.1 CCCOCCCN 4156-1-2Q [2,0,0,0,0,0|2,0,0]=4 138 B7R0.1 CCNCCCCO 4156-1-3R [2,0,0,0,0,0|1,0,0]=3 139 B7R0.1 CCOCCOCC 2208-1-07 [2,0,0,0,0,0|2,0,0]=4 140 B7R0.1 CC\C=C/CCCO 2301-1-Z1 [2,0,0,0,0,0|0,0,2]=4 141 B7R0.1 CNCCCCNC 3131-1-0F [2,0,0,0,0,0|2,0,0]=4 142 B7R0.1 ClCCCCCCCl 1100-5-00 [2,0,0,0,0,0|2,0,0]=4 143 B7R0.1 NCCCCCCN 3130-1-09 [2,0,0,0,0,0|2,0,0]=4 144 B7R0.1 OCCOCCCCl 2107-5-0X [2,0,0,0,0,0|2,0,0]=4 145 B7R0.1 OCCOCCCF 2101-3-1A [2,0,0,0,0,0|2,0,0]=4 146 B7R0.1 [C-]#[N+]CCCCCC 3137-1-0G [2,0,0,0,0,0|1,0,1]=4 147 B7R0.4 C=C(C)CCCCC 1300-1-36 [2,0,0,0,0,0|1,0,1]=4 148 B7R0.4 CCCCCC(C)=O 2117-1-14 [2,0,0,0,0,0|0,0,2]=4 149 B7R0.4 CCCCCC(C)N 3130-1-X7 [2,0,0,0,0,0|1,0,0]=3 150 B7R0.4 CCCCCC(C)O 2102-1-05 [2,0,0,0,0,0|0,0,0]=2 151 B7R0.4 CCCOCC(C)F 2107-3-7Q [2,0,0,0,0,0|2,0,0]=4 152 B9R0.5 CCOC(=O)CCCCO 2129-1-60 [1,1,0,0,0,0|1,0,1]=4 153 B9R0.18 CCCCC(=O)CCCC 2117-1-X3 [1,1,0,0,0,0|0,0,1]=3 154 B9R0.18 CCCCC(O)CCCC 2102-1-06 [1,1,0,0,0,0|0,0,0]=2 155 B9R0.45 C=CCCCCCCCCl 1300-5-36 [1,1,0,0,0,0|0,0,2]=4 156 B9R0.45 CCCCCCCCCC 1100-1-38 [1,1,0,0,0,0|0,0,0]=2 157 B9R0.45 CCCCCCCCCN 3130-1-13 [1,1,0,0,0,0|0,0,0]=2 158 B9R0.45 CCCCCCCCNC 3131-1-09 [1,1,0,0,0,0|0,0,0]=2 159 B9R0.45 CCCCCCCCOC 2107-1-00 [1,1,0,0,0,0|0,0,0]=2 160 B9R0.45 CCCCCCCC[Mg]Cl 9112-5-07 [1,1,0,0,0,0|1,0,0]=3 161 B9R0.45 CCCCCCCC[Mg]Cl 9112-5-08 [1,1,0,0,0,0|1,0,0]=3 162 B9R0.45 CCCCCCCC[Mg]Cl 9112-5-09 [1,1,0,0,0,0|1,0,0]=3 163 B9R0.45 CCCCCC\C=C/CO 2301-1-Z0 [1,1,0,0,0,0|0,0,1]=3 164 B9R0.45 OCCCCCCCCBr 2101-9-09 [1,1,0,0,0,0|0,0,0]=2 165 B9R0.45 OCCCCCCCCO 2104-1-00 [1,1,0,0,0,0|0,0,0]=2 166 B9R0.45 OCCSCCSCCO 6166-1-04 [1,1,0,0,0,0|2,0,0]=4 167 B9R0.46 CCCC#CCC(O)CC 2501-1-08 [1,1,0,0,0,0|0,0,2]=4 168 B9R0.46 CCCCCCC(=O)CC 2117-1-08 [1,1,0,0,0,0|0,0,1]=3 169 B9R0.46 CCCCCCC(O)CC 2102-1-10 [1,1,0,0,0,0|0,0,0]=2 170 B9R0.46 CCCCCCC(O)CN 4156-1-97 [1,1,0,0,0,0|1,0,0]=3 171 B9R0.46 CCCCCCC(O)CO 2104-1-34 [1,1,0,0,0,0|0,0,0]=2 172 B9R0.46 OCC(O)COCCCCl 2107-5-0T [1,1,0,0,0,0|2,0,0]=4 173 B9R0.46 OCC(O)COCCCF 2104-3-1A [1,1,0,0,0,0|2,0,0]=4 174 B9R0.4 CCCCC(C)CC(C)C 1100-1-29 [1,1,0,0,0,0|1,0,0]=3 175 B9R0.38 CCCCCCC(C)(C)C 1100-1-X3 [1,1,0,0,0,0|1,0,0]=3 176 B9R0.38 CCCCCCC(F)(Cl)Cl 1100-7-93 [1,1,0,0,0,0|2,0,0]=4 177 B9R0.38 CCCCCCC(F)(F)F 1100-3-3A [1,1,0,0,0,0|2,0,0]=4 178 B9R0.38 CCCCCCP(=O)(O)O 6177-1-97 [1,1,0,0,0,0|2,0,0]=4 179 B9R0.38 CCCCCC[Si](C)(C)Cl 5181-5-13 [1,1,0,0,0,0|1,1,0]=4 180 B9R0.38 CCCCOCC(C)(F)F 2107-3-8Y [1,1,0,0,0,0|2,0,0]=4 181 B11R0.180 CC(CC=O)CCCC(C)(C)O 2115-1-0E [0,2,0,0,0,0|1,0,1]=4 182 B11R0.2 CCCCCCC(O)CC(C)O 2104-1-32 [0,2,0,0,0,0|0,0,0]=2 183 B11R0.30 CC(C)CCCCCCC(=O)O 2121-1-X2 [0,2,0,0,0,0|1,0,1]=4 184 B11R0.40 CCCCCCCCC(O)CN 4156-1-98 [0,2,0,0,0,0|0,0,0]=2 185 B11R0.46 CCCCOC(C)OCC(C)F 2108-3-0L [0,2,0,0,0,0|2,0,0]=4 186 B11R0.148 C=C(C)CCCCCCCC#N 3337-1-X4 [0,2,0,0,0,0|1,0,1]=4 187 B11R0.148 C=C(C)CCCCCCCCC 1300-1-32 [0,2,0,0,0,0|1,0,1]=4 188 B11R0.148 O=C(O)CCCCCCCCO 2129-1-50 [0,2,0,0,0,0|1,0,1]=4 189 B11R0.159 CCCCCCCCC(F)(F)F 1100-3-4E [0,2,0,0,0,0|2,0,0]=4 190 B11R0.159 FC(F)(F)CCCCCCCBr 1100-B-0B [0,2,0,0,0,0|2,0,0]=4 191 B11R0.165 CCCCCC(I)CC(F)(F)F 1100-K-2H [0,2,0,0,0,0|2,0,0]=4 192 B11R0.151 CCCCCC[C@H](O)C(F)(F)F 2102-3-X1 [0,2,0,0,0,0|2,0,0]=4 193 B11R0.4 CCCCCCC[C@H](C)N=C=S 7168-1-S4 [0,2,0,0,0,0|0,1,0]=3 194 B9R1.8 BrCCC1CCOCC1 2H10-9-55 [1,0,0,1,0,0|2,0,0]=4 195 B9R1.8 BrCCC1OCCCO1 2H10-9-0E [1,0,0,1,0,0|2,0,0]=4 196 B9R1.8 BrCCN1CCCCC1 3H32-9-E6 [1,0,0,1,0,0|2,0,0]=4 197 B9R1.8 C#CCC1CCCCC1 1500-1-16 [1,0,0,1,0,0|0,0,2]=4 198 B9R1.8 CCCC1CCCCN1 3H31-1-AM [1,0,0,1,0,0|1,0,0]=3 199 B9R1.8 CCCC1CCNCC1 3H31-1-Q5 [1,0,0,1,0,0|1,0,0]=3 200 B9R1.8 CCCN1CCNCC1 3H32-1-3K [1,0,0,1,0,0|2,0,0]=4 201 B9R1.8 CCN[C@@H]1CCCNC1 3H31-5-R1 [1,0,0,1,0,0|2,0,0]=4 202 B9R1.8 CCOC1CCCNC1 4H07-1-3T [1,0,0,1,0,0|2,0,0]=4 203 B9R1.8 CNCC1CCCCC1 3231-1-0C [1,0,0,1,0,0|1,0,0]=3 204 B9R1.8 CNCC1CCCCO1 4H31-1-1B [1,0,0,1,0,0|1,0,0]=3 205 B9R1.8 CNCC1CCSCC1 7H31-1-13 [1,0,0,1,0,0|2,0,0]=4 206 B9R1.8 COCC1CCCCN1 4H07-1-6G [1,0,0,1,0,0|2,0,0]=4 207 B9R1.8 COCC1CCCNC1 4H07-5-1E [1,0,0,1,0,0|2,0,0]=4 208 B9R1.8 COCC1CCCNC1 4H56-1-964 [1,0,0,1,0,0|2,0,0]=4 209 B9R1.8 COCC1CCNCC1 4H56-1-0S1 [1,0,0,1,0,0|2,0,0]=4 210 B9R1.8 CSCC1CCCCN1 7H66-5-0X [1,0,0,1,0,0|2,0,0]=4 211 B9R1.8 CSCN1CCCCC1 7H66-1-28 [1,0,0,1,0,0|2,0,0]=4 212 B9R1.8 ClCCC1CCCCC1 1200-5-15 [1,0,0,1,0,0|1,0,0]=3 213 B9R1.8 ClCCN1CCCCC1 3H32-5-00 [1,0,0,1,0,0|2,0,0]=4 214 B9R1.8 ClCCN1CCCCC1 3H32-5-2W [1,0,0,1,0,0|2,0,0]=4 215 B9R1.8 ClCOC1CCCCC1 2207-5-00 [1,0,0,1,0,0|2,0,0]=4 216 B9R1.8 N#CCC1CCCCC1 3237-1-0D [1,0,0,1,0,0|1,0,1]=4 217 B9R1.8 NCCC1CCCCC1 3233-5-02 [1,0,0,1,0,0|1,0,0]=3 218 B9R1.8 NCCC1CCCCO1 4H30-1-13 [1,0,0,1,0,0|1,0,0]=3 219 B9R1.8 NCCC1CCCCO1 4H33-5-0P [1,0,0,1,0,0|1,0,0]=3 220 B9R1.8 NCCC1CCNCC1 3H31-5-01 [1,0,0,1,0,0|2,0,0]=4 221 B9R1.8 NCCC1CCOCC1 4H30-1-W3 [1,0,0,1,0,0|2,0,0]=4 222 B9R1.8 NCCC1CCOCC1 4H30-5-18 [1,0,0,1,0,0|2,0,0]=4 223 B9R1.8 NOCC1CCCCC1 4247-1-01 [1,0,0,1,0,0|2,0,0]=4 224 B9R1.8 OCCC1CCCCC1 2201-1-0F [1,0,0,1,0,0|0,0,0]=2 225 B9R1.8 OCCC1CCCCN1 4H56-1-911 [1,0,0,1,0,0|1,0,0]=3 226 B9R1.8 OCCC1CCOCC1 2H10-1-Y5 [1,0,0,1,0,0|1,0,0]=3 227 B9R1.8 OCCC1COCCN1 4H01-5-1T [1,0,0,1,0,0|2,0,0]=4 228 B9R1.8 OCC[C@H]1CCCCN1 4H56-1-R20 [1,0,0,1,0,0|1,0,0]=3 229 B9R1.8 OCC[C@H]1CNCCN1 4H01-5-S3 [1,0,0,1,0,0|2,0,0]=4 230 B9R1.12 BrCCCC1OCCO1 2H10-9-0P [1,0,0,1,0,0|2,0,0]=4 231 B9R1.12 CCCCC1CCCN1 3H31-1-FC [1,0,0,1,0,0|1,0,0]=3 232 B9R1.12 CCCCN1CCCC1 3H32-1-44 [1,0,0,1,0,0|1,0,0]=3 233 B9R1.12 COCCC1CCCN1 4H07-1-78 [1,0,0,1,0,0|2,0,0]=4 234 B9R1.12 ClCCCC1OCCO1 2H08-5-03 [1,0,0,1,0,0|2,0,0]=4 235 B9R1.12 ClCCCN1CCCC1 3H32-5-E6 [1,0,0,1,0,0|2,0,0]=4 236 B9R1.12 ClCCCN1CCCC1 4H33-5-01 [1,0,0,1,0,0|2,0,0]=4 237 B9R1.12 NCCOC1CCCC1 4256-1-0R [1,0,0,1,0,0|2,0,0]=4 238 B9R1.12 O=CCCC1CCCC1 2215-1-09 [1,0,0,1,0,0|0,0,2]=4 239 B9R1.12 OCCCC1CCCC1 2201-1-X0 [1,0,0,1,0,0|0,0,0]=2 240 B9R1.12 OCCCN1CCCC1 4H01-1-AT [1,0,0,1,0,0|1,0,0]=3 241 B9R1.12 OCCOC1CCCC1 2207-1-00 [1,0,0,1,0,0|1,0,0]=3 242 B9R1.15 CCC1CCCCC1O 2202-1-1G [1,0,0,1,0,0|0,0,0]=2 243 B9R1.15 CN1CCCCC1CCl 3H32-5-5A [1,0,0,1,0,0|2,0,0]=4 244 B9R1.15 CN1CCCCC1CO 4H56-1-879 [1,0,0,1,0,0|1,0,0]=3 245 B9R1.15 CN1CCOC[C@H]1CO 4H01-1-R2 [1,0,0,1,0,0|2,0,0]=4 246 B9R1.15 CN[C@@H]1CCCC[C@@H]1O 4256-5-33 [1,0,0,1,0,0|1,0,0]=3 247 B9R1.15 CO[C@H]1CCNC[C@@H]1O 4H56-1-795 [1,0,0,1,0,0|2,0,0]=4 248 B9R1.15 NC[C@@H]1CCCC[C@@H]1N 3230-5-00 [1,0,0,1,0,0|2,0,0]=4 249 B9R1.15 NC[C@@H]1CCCC[C@H]1O 4256-1-49 [1,0,0,1,0,0|1,0,0]=3 250 B9R1.15 N[C@@H]1CCCC[C@H]1CO 4256-5-58 [1,0,0,1,0,0|1,0,0]=3 251 B9R1.15 O=C1CCCCC1CO 2220-1-03 [1,0,0,1,0,0|1,0,1]=4 252 B9R1.15 OC[C@@H]1CCNC[C@@H]1O 4H56-1-830 [1,0,0,1,0,0|2,0,0]=4 253 B9R1.15 OC[C@H]1CCNC[C@H]1F 4H56-3-E8 [1,0,0,1,0,0|2,0,0]=4 254 B9R1.33 CN1CCCC1CCO 4H56-1-878 [1,0,0,1,0,0|1,0,0]=3 255 B9R1.33 CN1CCC[C@@H]1CCN 3H32-1-R7 [1,0,0,1,0,0|2,0,0]=4 256 B9R1.33 CN1CCC[C@H]1CCN 3H32-1-S7 [1,0,0,1,0,0|2,0,0]=4 257 B9R1.50 OC1CCC=CCCC1 2401-1-0B [1,0,0,1,0,0|0,0,2]=4 258 B9R1.50 OC1CCCCCCC1 2201-1-X2 [1,0,0,1,0,0|0,0,0]=2 259 B9R1.83 CCCCOC[C@@H]1CO1 2109-1-09 [1,0,0,1,0,0|1,0,0]=3 260 B9R1.83 ClCCCOCC1CO1 2109-5-03 [1,0,0,1,0,0|2,0,0]=4 261 B9R1.83 FCCCOCC1CO1 2109-3-1A [1,0,0,1,0,0|2,0,0]=4 262 B9R1.83 NCCCOCC1CC1 4256-1-0Z [1,0,0,1,0,0|2,0,0]=4 263 B9R1.89 CNC1CCCCNC1 3H31-1-DC [1,0,0,1,0,0|2,0,0]=4 264 B9R1.89 COC1CCCNCC1 4H07-1-18 [1,0,0,1,0,0|2,0,0]=4 265 B9R1.89 COC1CCCNCC1 4H56-5-45 [1,0,0,1,0,0|2,0,0]=4 266 B9R1.89 NCC1CCCCCC1 3230-1-01 [1,0,0,1,0,0|1,0,0]=3 267 B9R1.89 NCC1CCCCCC1 3230-5-0F [1,0,0,1,0,0|1,0,0]=3 268 B9R1.89 O=CC1CCCCCC1 2215-1-08 [1,0,0,1,0,0|0,0,2]=4 269 B9R1.89 ON=C1CCCCCC1 4247-1-0C [1,0,0,1,0,0|1,0,1]=4 270 B9R1.89 [C-]#[N+]C1CCCCCC1 3237-1-0C [1,0,0,1,0,0|1,0,1]=4 271 B9R1.103 C1CCCCCCCC1 1200-1-18 [1,0,0,1,0,0|0,0,0]=2 272 B9R1.103 C1CCCCNCCC1 3H31-1-13 [1,0,0,1,0,0|1,0,0]=3 273 B9R1.2 CC1CCCC(CO)N1 4H56-1-JN [1,0,0,1,0,0|2,0,0]=4 274 B9R1.2 CCN1CCCC(N)C1 3H32-1-N1 [1,0,0,1,0,0|2,0,0]=4 275 B9R1.2 CCN1CCCC(O)C1 4H01-1-BE [1,0,0,1,0,0|1,0,0]=3 276 B9R1.2 CNC1CCCC(O)C1 4256-1-0X [1,0,0,1,0,0|1,0,0]=3 277 B9R1.6 CC(=O)C1CCCCC1 2217-1-X2 [1,0,0,1,0,0|0,0,2]=4 278 B9R1.6 CC(C)C1CCCCN1 3H33-5-1T [1,0,0,1,0,0|2,0,0]=4 279 B9R1.6 CC(C)C1CCNCC1 3H31-1-DL [1,0,0,1,0,0|2,0,0]=4 280 B9R1.6 CC(O)C1CCNCC1 4H02-1-0J [1,0,0,1,0,0|1,0,0]=3 281 B9R1.6 CN(C)C1CCCCC1 3232-1-00 [1,0,0,1,0,0|2,0,0]=4 282 B9R1.6 O=C(O)C1CCCCC1 2221-1-22 [1,0,0,1,0,0|1,0,1]=4 283 B9R1.7 NCCC1CCC(F)C1 3230-3-07 [1,0,0,1,0,0|2,0,0]=4 284 B9R1.7 NCCN1CCC(O)C1 4H56-1-326 [1,0,0,1,0,0|2,0,0]=4 285 B9R1.24 C[C@]1(N)CCC[C@H]1CO 4256-5-26 [1,0,0,1,0,0|2,0,0]=4 286 B9R1.40 CC1CCCCC1(F)F 1200-3-0A [1,0,0,1,0,0|2,0,0]=4 287 B9R1.148 CC1(O)CCCNCC1 4H56-1-077 [1,0,0,1,0,0|1,0,0]=3 288 B9R1.148 CC1(O)CCCNCC1 4H56-5-B4 [1,0,0,1,0,0|1,0,0]=3 289 B11R1.166 CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1O 2202-1-0V [0,1,0,1,0,0|2,0,0]=4 290 B11R1.166 CC(C)[C@H]1CC[C@@H](C)C[C@@H]1O 2202-1-0A [0,1,0,1,0,0|2,0,0]=4 291 B11R1.166 CC(C)[C@H]1CC[C@H](C)C[C@@H]1O 2202-1-0N [0,1,0,1,0,0|2,0,0]=4 292 B11R1.86 CC(=O)OC1CCCCC1C 2223-1-0Z [0,1,0,1,0,0|0,0,2]=4 293 B11R1.91 CC(=O)OCC1CCCCC1 2223-1-0V [0,1,0,1,0,0|0,0,2]=4 294 B11R1.91 CC(C)CN[C@H]1CCCNC1 3H31-5-S2 [0,1,0,1,0,0|2,0,0]=4 295 B11R1.91 CC(N)CCN1CCOCC1 4H56-1-0HG [0,1,0,1,0,0|2,0,0]=4 296 B11R1.91 CN(C)CCC1CCCCN1 3H31-1-8N [0,1,0,1,0,0|2,0,0]=4 297 B11R1.91 O=C(O)CCC1CCCCC1 2221-1-0D [0,1,0,1,0,0|1,0,1]=4 298 B11R1.91 O=C(O)COC1CCCCC1 2221-1-0J [0,1,0,1,0,0|1,0,1]=4 299 B11R1.91 OB(O)CCC1CCCCC1 6260-1-04 [0,1,0,1,0,0|2,0,0]=4 300 B11R1.101 O=C1CCCCCCCCC1 2217-1-15 [0,1,0,1,0,0|0,0,2]=4 301 B11R1.101 OC1CCCCCCCCC1 2201-1-02 [0,1,0,1,0,0|0,0,0]=2 302 B11R1.742 CC(C)CC1CCCCCN1 3H31-1-FX [0,1,0,1,0,0|1,0,0]=3 303 B11R1.742 O=C(O)CC1CCCCCC1 2221-1-1K [0,1,0,1,0,0|1,0,1]=4 304 B11R1.742 O=C(O)CN1CCCCCC1 4H21-5-61 [0,1,0,1,0,0|1,0,1]=4 305 B11R1.898 CCCCCCC1CC1(Br)Br 1200-9-09 [0,1,0,1,0,0|1,0,0]=3 306 B11R1.230 CCCCC1OC(=O)CC1C 2H25-1-3D [0,1,0,1,0,0|1,0,1]=4 307 B11R1.928 NC1(CC(=O)O)CCCCC1 4232-1-00 [0,1,0,1,0,0|1,0,1]=4 308 B11R1.509 CC(C)(C)CC1CCCCN1 3H31-1-F2 [0,1,0,1,0,0|2,0,0]=4 309 B11R1.509 C[C@](N)(O)C[C@H]1CCCOC1 4H56-1-889 [0,1,0,1,0,0|1,0,0]=3 310 B11R1.20 CC(C)CN1CCC(N)CC1 3H33-5-1Y [0,1,0,1,0,0|2,0,0]=4 311 B11R1.20 CC1CCC(CC(=O)O)CC1 2721-1-4B [0,1,0,1,0,0|1,0,1]=4 312 B11R1.20 O=C(O)CC1CCC(O)CC1 2229-1-79 [0,1,0,1,0,0|1,0,1]=4 313 B11R1.20 O=C(O)C[C@H]1CC[C@@H](O)CC1 2229-1-08 [0,1,0,1,0,0|1,0,1]=4 314 B11R1.20 O=C(O)C[C@H]1CC[C@H](O)CC1 2229-1-78 [0,1,0,1,0,0|1,0,1]=4 315 B11R1.23 COC(=O)C1CCCC(O)C1 2229-1-1M [0,1,0,1,0,0|1,0,1]=4 316 B11R1.1 CCCCC1CCC(O)CC1 2202-1-1D [0,1,0,1,0,0|0,0,0]=2 317 B11R1.1 CCCCN1CCC(O)CC1 4H02-1-07 [0,1,0,1,0,0|1,0,0]=3 318 B11R1.1 OC1CCN(CCCCl)CC1 4H01-5-2B [0,1,0,1,0,0|2,0,0]=4 319 B11R1.25 COC(=O)CCC1CCCC1 2223-1-0Q [0,1,0,1,0,0|0,0,2]=4 320 B11R1.40 CC(C=O)CC1CCCCC1 2215-1-06 [0,1,0,1,0,0|0,0,1]=3 321 B11R1.40 NC[C@H](O)CN1CCOCC1 4H56-1-1C [0,1,0,1,0,0|2,0,0]=4 322 B11R1.40 N[C@@H](CO)CC1CCCCC1 4256-1-RU [0,1,0,1,0,0|1,0,0]=3 323 B11R1.40 N[C@H](CO)CC1CCCCC1 4256-1-SU [0,1,0,1,0,0|1,0,0]=3 324 B11R1.189 NCCN1CCCC(CO)C1 4H56-1-0AC [0,1,0,1,0,0|2,0,0]=4 325 B11R1.381 CCC1CCCCC(=O)N1C 4H48-1-K4 [0,1,0,1,0,0|0,0,2]=4 326 B11R1.852 COC(=O)C1CCCCCC1 2223-1-60 [0,1,0,1,0,0|0,0,2]=4 327 B11R1.35 N[C@@H](CC1CCCC1)C(=O)O 4257-1-S6 [0,1,0,1,0,0|1,0,1]=4 328 B11R1.36 NC(C(=O)O)C1CCCCC1 4257-1-0B [0,1,0,1,0,0|1,0,1]=4 329 B11R1.359 CCCCCC1C(C)C1(Br)Br 1200-9-13 [0,1,0,1,0,0|2,0,0]=4 330 B11R1.737 NC1(C(=O)O)CCCCCC1 4257-1-0G [0,1,0,1,0,0|1,0,1]=4 331 B11R2.36 OC1CCC2CNCC2C1 4H56-5-0Z [0,0,0,2,0,0|1,0,0]=3 332 B11R2.48 OC1CC2CCCC1CC2 2202-1-04 [0,0,0,2,0,0|0,0,0]=2 333 B11R2.118 C[C@@H]1CC2CCC1[C@H](O)C2 2202-1-11 [0,0,0,2,0,0|0,0,0]=2 334 B11R2.484 OC12CCCC(CCC1)C2 2203-1-03 [0,0,0,2,0,0|0,0,0]=2 335 B11R2.678 O[C@@H]1C[C@@H]2CCC[C@H](C1)N2 4H56-5-C7 [0,0,0,2,0,0|1,0,0]=3 336 B11R2.16 OC[C@H]1C[C@@H]2CC[C@H](C1)N2 4H01-1-6A [0,0,0,2,0,0|2,0,0]=4 337 B11R2.352 O[C@@H]1CCN(C2CNC2)C1 4H02-5-R1 [0,0,0,2,0,0|2,0,0]=4 338 B11R2.352 O[C@H]1CCN(C2CNC2)C1 4H02-5-S1 [0,0,0,2,0,0|2,0,0]=4 339 B11R2.391 OC1(O)CCC2CCC1C2 2204-1-04 [0,0,0,2,0,0|1,0,0]=3 340 B11R2.845 CC(=O)C1CC2CCC1C2 2217-1-37 [0,0,0,2,0,0|0,0,2]=4 341 B11R2.845 [C@@H]12CC[C@H](CC1C(C)N)C2 3230-1-0L [0,0,0,2,0,0|1,0,0]=3 342 B11R2.2362 CC12CCCCC1C2(Cl)Cl 1200-5-10 [0,0,0,2,0,0|2,0,0]=4 343 B11R2.432 CN1C2CCC1CC(O)C2 4H02-5-04 [0,0,0,2,0,0|1,0,0]=3 344 B11R2.432 CN1[C@H]2CC[C@@H]1C[C@@H](N)C2 3H30-1-DR [0,0,0,2,0,0|2,0,0]=4 345 B11R2.432 [C@H]12CC[C@H](CC(S)C1)N2C 7H61-5-0D [0,0,0,2,0,0|1,1,0]=4 346 B11R2.684 CC1(C)CC2CC1CC2O 2203-1-05 [0,0,0,2,0,0|2,0,0]=4 347 B11R2.684 CC1(O)CC2CC1CC2O 2204-1-06 [0,0,0,2,0,0|1,0,0]=3 348 B11R2.1034 C(CCC1CO1)CC2CO2 2109-1-16 [0,0,0,2,0,0|1,0,0]=3