0 B11R1.12 CCC(C#N)C1=CC=CC=C1 099619 [0,0,0,0,0,0|3,0,0]=3 1 B11R1.12 CCC(CC)C1=NC=CC=C1 032554 [0,0,0,0,0,0|3,0,0]=3 2 B11R1.12 CCC(CO)C1=NC=CC=C1 032577 [0,0,0,0,0,0|4,0,0]=4 3 B11R1.12 CCN(CC)C1=CC=CC=C1 043437 [0,0,0,0,0,0|3,0,0]=3 4 B11R1.12 CCN(CC)C1=CC=CC=C1 226653 [0,0,0,0,0,0|3,0,0]=3 5 B11R1.12 COC(OC)C1=CC=CC=C1 018193 [0,0,0,0,0,0|0,0,0]=0 6 B11R1.12 N#CC(C=O)C1=CC=CC=C1 020198 [0,0,0,0,0,0|4,0,0]=4 7 B10R1.15 C(=O)C(C)C1=CC=CC=C1 003859 [1,0,0,0,0,0|2,0,0]=3 8 B10R1.15 CC(C#N)C1=CC=CC=C1 001059 [1,0,0,0,0,0|2,0,0]=3 9 B10R1.15 CC(CN)C1=CC=CC=C1 008888 [1,0,0,0,0,0|2,0,0]=3 10 B10R1.15 CCC(=O)C1=CC=CC=C1 094675 [1,0,0,0,0,0|1,0,2]=4 11 B10R1.15 CCC(C)C1=CC=CC=C1 094615 [1,0,0,0,0,0|1,0,0]=2 12 B10R1.15 CCC(O)C1=CC=CC=C1 242652 [1,0,0,0,0,0|1,0,0]=2 13 B10R1.15 CCN(C)C1=CC=CC=C1 092421 [1,0,0,0,0,0|2,0,0]=3 14 B10R1.15 CC[C@@H](N)C1=CC=CC=C1 208825 [1,0,0,0,0,0|2,0,0]=3 15 B10R1.15 CC[C@@H](O)C1=CC=CC=C1 103637 [1,0,0,0,0,0|1,0,0]=2 16 B10R1.15 CC[C@H](N)C1=CC=CC=C1 227613 [1,0,0,0,0,0|2,0,0]=3 17 B10R1.15 CN(C=O)C1=CC=CC=C1 208822 [1,0,0,0,0,0|3,0,0]=4 18 B10R1.15 CNC(=O)C1=CC=CC=C1 341719 [1,0,0,0,0,0|1,0,2]=4 19 B10R1.15 CNC(=S)C1=CC=CC=C1 180197 [1,0,0,0,0,0|1,1,1]=4 20 B10R1.15 CNC(C)C1=CC=CC=C1 371108 [1,0,0,0,0,0|1,0,0]=2 21 B10R1.15 CN[C@H](C)C1=CC=CC=C1 337064 [1,0,0,0,0,0|1,0,0]=2 22 B10R1.15 COC(=O)C1=CC=CC=C1 223218 [1,0,0,0,0,0|0,0,2]=3 23 B10R1.15 COC(=O)C1=CC=NC=C1 040095 [1,0,0,0,0,0|1,0,2]=4 24 B10R1.15 COC(=O)C1=CN=CC=C1 078909 [1,0,0,0,0,0|1,0,2]=4 25 B10R1.15 COC(=O)C1=NC=CC=C1 078704 [1,0,0,0,0,0|1,0,2]=4 26 B10R1.15 COS(=O)C1=CC=CC=C1 023251 [1,0,0,0,0,0|1,0,1]=3 27 B10R1.15 N#CC(O)C1=CC=CC=C1 403371 [1,0,0,0,0,0|2,0,0]=3 28 B10R1.15 N#C[C@@H](N)C1=CC=CC=C1 324116 [1,0,0,0,0,0|3,0,0]=4 29 B10R1.15 NC(CO)C1=CC=CC=C1 364268 [1,0,0,0,0,0|3,0,0]=4 30 B10R1.15 NCC(O)C1=CC=CC=C1 008897 [1,0,0,0,0,0|2,0,0]=3 31 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 318280 [1,0,0,0,0,0|2,0,0]=3 32 B10R1.15 NC[C@H](O)C1=CC=CC=C1 077860 [1,0,0,0,0,0|2,0,0]=3 33 B10R1.15 N[C@@H](CO)C1=CC=CC=C1 040100 [1,0,0,0,0,0|3,0,0]=4 34 B10R1.15 N[C@H](CO)C1=CC=CC=C1 034311 [1,0,0,0,0,0|3,0,0]=4 35 B10R1.15 O[C@H](CCl)C1=CC=CC=C1 103828 [1,0,0,0,0,0|2,0,0]=3 36 B12R1.3 CCN(CCO)C1=CC=CC=C1 228743 [0,1,0,0,0,0|3,0,0]=4 37 B12R1.12 CCN(CC)C1=CC=C(N)C=C1 129800 [0,1,0,0,0,0|3,0,0]=4 38 B12R1.475 CCC(O)(CC)C1=CC=CC=C1 399514 [0,1,0,0,0,0|2,0,0]=3 39 B12R1.475 CCC(O)(CC)C1=CN=CC=C1 180311 [0,1,0,0,0,0|3,0,0]=4 40 B12R1.475 COC(C)(OC)C1=CC=CC=C1 103050 [0,1,0,0,0,0|0,0,0]=1 41 B12R1.478 CCC(C(=O)O)C1=CC=CC=C1 235701 [0,1,0,0,0,0|3,0,0]=4 42 B12R1.478 CN(C)C(C#N)C1=CC=CC=C1 341735 [0,1,0,0,0,0|3,0,0]=4 43 B12R1.478 COC(C(=O)O)C1=CC=CC=C1 209415 [0,1,0,0,0,0|2,0,0]=3 44 B12R1.478 CO[C@@H](C(=O)O)C1=CC=CC=C1 223096 [0,1,0,0,0,0|2,0,0]=3 45 B12R2.2 C1=CC=C(C2=NCCN2)C=C1 232941 [0,0,0,1,0,0|2,0,1]=4 46 B12R2.2 C1=CC=C(C2CCCN2)C=C1 021298 [0,0,0,1,0,0|2,0,0]=3 47 B12R2.2 C1=CN=CC(C2CCCN2)=C1 077422 [0,0,0,1,0,0|3,0,0]=4 48 B12R2.48 N#CC1(C2=CC=CC=C2)CC1 068003 [0,0,0,1,0,0|3,0,0]=4 49 B10R1.9 COC(OC)C1=NC=CN1 038330 [0,0,0,0,1,0|2,0,0]=3 50 B12R1.118 CN[C@H](CO)CC1=CC=CC=C1 209399 [0,0,0,0,0,1|3,0,0]=4 51 B12R1.118 COC(CC1=CC=CC=C1)OC 103319 [0,0,0,0,0,1|0,0,0]=1 52 B9R1.6 BrC(Br)C1=CC=CC=C1 243023 [2,0,0,0,0,0|2,0,0]=4 53 B9R1.6 C=C(C)C1=CC=CC=C1 245708 [2,0,0,0,0,0|0,0,2]=4 54 B9R1.6 CC(=O)C1=CC=CC=C1 043319 [2,0,0,0,0,0|0,0,2]=4 55 B9R1.6 CC(Br)C1=CC=CC=C1 001003 [2,0,0,0,0,0|1,0,0]=3 56 B9R1.6 CC(C)C1=CC=CC=C1 094649 [2,0,0,0,0,0|0,0,0]=2 57 B9R1.6 CC(C)C1=CC=NC=C1 024693 [2,0,0,0,0,0|1,0,0]=3 58 B9R1.6 CC(C)C1=NC=CC=C1 078691 [2,0,0,0,0,0|1,0,0]=3 59 B9R1.6 CC(N)C1=CC=CC=C1 208695 [2,0,0,0,0,0|1,0,0]=3 60 B9R1.6 CC(N)C1=CC=NC=C1 030534 [2,0,0,0,0,0|2,0,0]=4 61 B9R1.6 CC(N)C1=CC=NC=C1 097930 [2,0,0,0,0,0|2,0,0]=4 62 B9R1.6 CC(N)C1=CN=CC=C1 030750 [2,0,0,0,0,0|2,0,0]=4 63 B9R1.6 CC(N)C1=NC=CC=C1 060819 [2,0,0,0,0,0|2,0,0]=4 64 B9R1.6 CC(O)C1=CC=CC=C1 098924 [2,0,0,0,0,0|0,0,0]=2 65 B9R1.6 CC(O)C1=CC=CN=C1 094012 [2,0,0,0,0,0|1,0,0]=3 66 B9R1.6 CC(O)C1=NC=CC=C1 088389 [2,0,0,0,0,0|1,0,0]=3 67 B9R1.6 CN(C)C1=CC=CC=C1 098810 [2,0,0,0,0,0|1,0,0]=3 68 B9R1.6 CN(C)C1=CC=CN=C1 032574 [2,0,0,0,0,0|2,0,0]=4 69 B9R1.6 CN(C)C1=CC=NC=C1 001704 [2,0,0,0,0,0|2,0,0]=4 70 B9R1.6 CN(C)C1=CC=NC=C1 133700 [2,0,0,0,0,0|2,0,0]=4 71 B9R1.6 CN(C)C1=NC=CC=C1 219108 [2,0,0,0,0,0|2,0,0]=4 72 B9R1.6 CS(=O)C1=CC=CC=C1 180124 [2,0,0,0,0,0|1,0,1]=4 73 B9R1.6 C[C@@H](N)C1=CC=CC=C1 037431 [2,0,0,0,0,0|1,0,0]=3 74 B9R1.6 C[C@@H](N)C1=NC=CC=C1 078110 [2,0,0,0,0,0|2,0,0]=4 75 B9R1.6 C[C@@H](O)C1=CC=CC=C1 222634 [2,0,0,0,0,0|0,0,0]=2 76 B9R1.6 C[C@H](N)C1=CC=CC=C1 037432 [2,0,0,0,0,0|1,0,0]=3 77 B9R1.6 C[SiH](C)C1=CC=CC=C1 S13425 [2,0,0,0,0,0|0,1,0]=3 78 B9R1.6 C[SiH](Cl)C1=CC=CC=C1 S13525 [2,0,0,0,0,0|1,1,0]=4 79 B9R1.6 FC(F)C1=CC=CC=C1 035819 [2,0,0,0,0,0|2,0,0]=4 80 B9R1.6 O=C(O)C1=CC=CC=C1 102544 [2,0,0,0,0,0|0,0,2]=4 81 B9R1.6 O=C(O)C1=CC=CC=C1 237766 [2,0,0,0,0,0|0,0,2]=4 82 B9R1.6 O=[PH](O)C1=CC=CC=C1 003643 [2,0,0,0,0,0|1,0,1]=4 83 B9R1.6 O=[Se](O)C1=CC=CC=C1 005551 [2,0,0,0,0,0|1,0,1]=4 84 B9R1.6 OB(O)C1=CC=CC=C1 019491 [2,0,0,0,0,0|1,0,0]=3 85 B9R1.6 OB(O)C1=CC=CN=C1 010819 [2,0,0,0,0,0|2,0,0]=4 86 B9R1.6 OB(O)C1=CC=NC=C1 010820 [2,0,0,0,0,0|2,0,0]=4 87 B9R1.6 OB(O)C1=CC=NC=C1 017173 [2,0,0,0,0,0|2,0,0]=4 88 B9R1.8 BrCCC1=CC=CC=C1 019261 [2,0,0,0,0,0|2,0,0]=4 89 B9R1.8 C#CCC1=CC=CC=C1 080054 [2,0,0,0,0,0|1,0,1]=4 90 B9R1.8 C=CCC1=CC=CC=C1 005425 [2,0,0,0,0,0|1,0,1]=4 91 B9R1.8 CC#CC1=CC=CC=C1 166000 [2,0,0,0,0,0|1,0,1]=4 92 B9R1.8 CCCC1=CC=CC=C1 095067 [2,0,0,0,0,0|1,0,0]=3 93 B9R1.8 CCCC1=CC=NC=C1 235894 [2,0,0,0,0,0|2,0,0]=4 94 B9R1.8 CCCC1=NC=CC=C1 242850 [2,0,0,0,0,0|2,0,0]=4 95 B9R1.8 CCNC1=CC=CC=C1 216665 [2,0,0,0,0,0|2,0,0]=4 96 B9R1.8 CCOC1=CC=CC=C1 098890 [2,0,0,0,0,0|2,0,0]=4 97 B9R1.8 CCSC1=CC=CC=C1 001759 [2,0,0,0,0,0|2,0,0]=4 98 B9R1.8 CNCC1=CC=CC=C1 020695 [2,0,0,0,0,0|1,0,0]=3 99 B9R1.8 CNCC1=CC=NC=C1 046176 [2,0,0,0,0,0|2,0,0]=4 100 B9R1.8 CSCC1=CC=CC=C1 099640 [2,0,0,0,0,0|0,1,0]=3 101 B9R1.8 C\C=C/C1=CC=CC=C1 167700 [2,0,0,0,0,0|1,0,1]=4 102 B9R1.8 C\C=C\C1=CC=CC=C1 018868 [2,0,0,0,0,0|1,0,1]=4 103 B9R1.8 C\N=C\C1=CC=CC=C1 240625 [2,0,0,0,0,0|1,0,1]=4 104 B9R1.8 ClCCC1=CC=CC=C1 208883 [2,0,0,0,0,0|2,0,0]=4 105 B9R1.8 Cl[Mg]CC1=CC=CC=C1 103558 [2,0,0,0,0,0|2,0,0]=4 106 B9R1.8 ICCC1=CC=CC=C1 001087 [2,0,0,0,0,0|2,0,0]=4 107 B9R1.8 NCCC1=CC=CC=C1 046873 [2,0,0,0,0,0|2,0,0]=4 108 B9R1.8 NNCC1=CC=CC=C1 036859 [2,0,0,0,0,0|2,0,0]=4 109 B9R1.8 NOCC1=CC=CC=C1 036957 [2,0,0,0,0,0|1,0,0]=3 110 B9R1.8 O=CCC1=CC=CC=C1 098878 [2,0,0,0,0,0|2,0,0]=4 111 B9R1.8 OCCC1=CC=CC=C1 222397 [2,0,0,0,0,0|2,0,0]=4 112 B9R1.8 ONCC1=CC=CC=C1 091512 [2,0,0,0,0,0|2,0,0]=4 113 B9R1.8 ONCC1=CC=CC=C1 238633 [2,0,0,0,0,0|2,0,0]=4 114 B11R1.7 C#CC(C)(O)C1=CC=CC=C1 008691 [1,1,0,0,0,0|1,0,1]=4 115 B11R1.7 CCC(C)(C)C1=CC=CC=C1 226678 [1,1,0,0,0,0|1,0,0]=3 116 B11R1.16 CC(CC=O)C1=CC=CC=C1 520893 [1,1,0,0,0,0|1,0,1]=4 117 B11R1.16 CC(N=C=S)C1=CC=CC=C1 009523 [1,1,0,0,0,0|1,0,1]=4 118 B11R1.16 CCC[C@@H](O)C1=CC=CC=C1 355875 [1,1,0,0,0,0|1,0,0]=3 119 B11R1.16 CCC[C@H](O)C1=CC=CC=C1 488025 [1,1,0,0,0,0|1,0,0]=3 120 B11R1.16 CCOC(=O)C1=CC=CC=C1 300758 [1,1,0,0,0,0|0,0,2]=4 121 B11R1.16 CCO[PH](=O)C1=CC=CC=C1 230391 [1,1,0,0,0,0|1,0,1]=4 122 B11R1.16 CN(CCO)C1=CC=CC=C1 241296 [1,1,0,0,0,0|2,0,0]=4 123 B11R1.16 CNCC(O)C1=CC=CC=C1 402378 [1,1,0,0,0,0|1,0,0]=3 124 B11R1.16 COCC(=O)C1=CC=CC=C1 321462 [1,1,0,0,0,0|0,0,2]=4 125 B11R1.16 C[C@@H](N=C=O)C1=CC=CC=C1 013633 [1,1,0,0,0,0|1,0,1]=4 126 B11R1.16 C[C@@H](N=C=S)C1=CC=CC=C1 009522 [1,1,0,0,0,0|1,0,1]=4 127 B11R1.16 C[C@H](N=C=O)C1=CC=CC=C1 013634 [1,1,0,0,0,0|1,0,1]=4 128 B11R1.16 C[C@H](N=C=S)C1=CC=CC=C1 009524 [1,1,0,0,0,0|1,0,1]=4 129 B11R1.16 O=C(OCCl)C1=CC=CC=C1 209542 [1,1,0,0,0,0|0,0,2]=4 130 B11R1.22 CC(C#N)C1=CC=C(Br)C=C1 215518 [1,1,0,0,0,0|2,0,0]=4 131 B11R1.22 CCC(C)C1=CC=C(O)C=C1 098816 [1,1,0,0,0,0|1,0,0]=3 132 B11R1.22 COC(=O)C1=CC=C(Br)C=C1 078890 [1,1,0,0,0,0|0,0,2]=4 133 B11R1.22 COC(=O)C1=CC=C(C)C=C1 349109 [1,1,0,0,0,0|0,0,2]=4 134 B11R1.22 COC(=O)C1=CC=C(Cl)C=C1 018826 [1,1,0,0,0,0|0,0,2]=4 135 B11R1.22 COC(=O)C1=CC=C(F)C=C1 006802 [1,1,0,0,0,0|0,0,2]=4 136 B11R1.22 COC(=O)C1=CC=C(I)C=C1 079685 [1,1,0,0,0,0|0,0,2]=4 137 B11R1.22 COC(=O)C1=CC=C(N)C=C1 035825 [1,1,0,0,0,0|0,0,2]=4 138 B11R1.22 COC(=O)C1=CC=C(O)C=C1 209090 [1,1,0,0,0,0|0,0,2]=4 139 B11R1.22 NCC(O)C1=CC=C(O)C=C1 375146 [1,1,0,0,0,0|2,0,0]=4 140 B11R1.23 COC(=O)C1=CC(C)=CC=C1 358396 [1,1,0,0,0,0|0,0,2]=4 141 B11R1.23 COC(=O)C1=CC(F)=CC=C1 009502 [1,1,0,0,0,0|0,0,2]=4 142 B11R1.23 COC(=O)C1=CC(I)=CC=C1 037328 [1,1,0,0,0,0|0,0,2]=4 143 B11R1.23 COC(=O)C1=CC=CC(Br)=C1 155102 [1,1,0,0,0,0|0,0,2]=4 144 B11R1.23 COC(=O)C1=CC=CC(Cl)=C1 243026 [1,1,0,0,0,0|0,0,2]=4 145 B11R1.23 COC(=O)C1=CC=CC(N)=C1 038247 [1,1,0,0,0,0|0,0,2]=4 146 B11R1.23 COC(=O)C1=CC=CC(O)=C1 078900 [1,1,0,0,0,0|0,0,2]=4 147 B11R1.36 CC(=O)N(C)C1=CC=CC=C1 154800 [1,1,0,0,0,0|2,0,0]=4 148 B11R1.36 CC(C(=O)O)C1=CC=CC=C1 093725 [1,1,0,0,0,0|2,0,0]=4 149 B11R1.36 CC(C)C(C)C1=CC=NC=C1 032640 [1,1,0,0,0,0|2,0,0]=4 150 B11R1.36 CC(C)C(O)C1=CC=CC=C1 242324 [1,1,0,0,0,0|1,0,0]=3 151 B11R1.36 C[C@@H](C(=O)O)C1=CC=CC=C1 034471 [1,1,0,0,0,0|2,0,0]=4 152 B11R1.36 NC(=O)C(O)C1=CC=CC=C1 018765 [1,1,0,0,0,0|2,0,0]=4 153 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 093723 [1,1,0,0,0,0|2,0,0]=4 154 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 046847 [1,1,0,0,0,0|2,0,0]=4 155 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 093732 [1,1,0,0,0,0|2,0,0]=4 156 B11R1.36 O=C([O-])C(O)C1=CC=CC=C1 103518 [1,1,0,0,0,0|2,0,0]=4 157 B11R1.222 CCC(C)C1=C(O)C=CC=C1 099269 [1,1,0,0,0,0|1,0,0]=3 158 B11R1.222 CCC(C)C1=CC=CC=C1N 320033 [1,1,0,0,0,0|1,0,0]=3 159 B11R1.222 COC(=O)C1=C(C)C=CC=C1 018884 [1,1,0,0,0,0|0,0,2]=4 160 B11R1.222 COC(=O)C1=C(Cl)C=CC=C1 018825 [1,1,0,0,0,0|0,0,2]=4 161 B11R1.222 COC(=O)C1=C(F)C=CC=C1 006801 [1,1,0,0,0,0|0,0,2]=4 162 B11R1.222 COC(=O)C1=C(I)C=CC=C1 005544 [1,1,0,0,0,0|0,0,2]=4 163 B11R1.222 COC(=O)C1=C(S)C=CC=C1 008066 [1,1,0,0,0,0|0,0,2]=4 164 B11R1.222 COC(=O)C1=CC=CC=C1Br 079461 [1,1,0,0,0,0|0,0,2]=4 165 B11R1.222 COC(=O)C1=CC=CC=C1O 066745 [1,1,0,0,0,0|0,0,2]=4 166 B13R1.3080 COP(=O)(CC1=CC=CC=C1)OC 239297 [0,1,0,0,0,1|1,0,0]=3 167 B13R1.398 CCOC(OCC)C1=CC=CC=C1 336067 [0,2,0,0,0,0|0,0,0]=2 168 B13R1.398 CCOP(OCC)C1=CC=CC=C1 324278 [0,2,0,0,0,0|1,0,0]=3 169 B13R1.39 COC1=CC=C(C(OC)OC)C=C1 239230 [0,2,0,0,0,0|0,0,0]=2 170 B13R1.412 CO[Si](OC)(OC)C1=CC=CC=C1 S13750 [0,2,0,0,0,0|0,1,0]=3 171 B11R2.1 CC1CNC2=C1C=CC=C2 209516 [1,0,0,1,0,0|2,0,0]=4 172 B11R2.1 NC1CCC2=C1C=CC=C2 219954 [1,0,0,1,0,0|2,0,0]=4 173 B11R2.1 O=C1OCC2=C1C=CC=C2 091677 [1,0,0,1,0,0|0,0,2]=4 174 B11R2.1 OB1OCC2=C1C=CC=C2 107020 [1,0,0,1,0,0|1,0,0]=3 175 B11R2.1 OC1CCC2=CC=CC=C21 008845 [1,0,0,1,0,0|1,0,0]=3 176 B11R2.1 O[C@@H]1CCC2=CC=CC=C21 454961 [1,0,0,1,0,0|1,0,0]=3 177 B11R2.1 O[C@H]1CCC2=CC=CC=C21 106570 [1,0,0,1,0,0|1,0,0]=3 178 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 390375 [1,0,0,1,0,0|2,0,0]=4 179 B11R2.2 C1=COC(C2OCCO2)=C1 099788 [0,0,0,1,1,0|1,0,0]=3 180 B13R2.64 C1=CC=C(OC2CCCC2)C=C1 038461 [0,0,0,1,0,1|2,0,0]=4 181 B13R2.3 C1=CC=C(C2CCCCC2)C=C1 040215 [0,1,0,1,0,0|2,0,0]=4 182 B13R2.3 C1=CC=C(C2CCCCN2)C=C1 022075 [0,1,0,1,0,0|2,0,0]=4 183 B13R2.3 C1=CC=C(C2CCCNC2)C=C1 019443 [0,1,0,1,0,0|2,0,0]=4 184 B13R2.3 C1=CC=C(C2CCNCC2)C=C1 009826 [0,1,0,1,0,0|2,0,0]=4 185 B13R2.3 C1=CC=C(C2COCCN2)C=C1 061565 [0,1,0,1,0,0|1,0,0]=3 186 B13R2.3 C1=CN=CC(B2OCCCO2)=C1 045307 [0,1,0,1,0,0|2,0,0]=4 187 B13R2.12 NC1=CC=C(C2=NCCO2)C=C1 017010 [0,1,0,1,0,0|1,0,1]=4 188 B13R2.18 CC1=CC=CC=C1C2CCCN2 032049 [0,1,0,1,0,0|2,0,0]=4 189 B13R2.135 CO[C@H]1C2=CC=CC=C2C[C@H]1O 103211 [0,1,0,1,0,0|1,0,0]=3 190 B11R1.40 CCC(O)CC1=CC=CC=C1 103563 [1,0,0,0,0,1|1,0,0]=3 191 B11R1.40 O[C@H](CCl)CC1=CC=CC=C1 036095 [1,0,0,0,0,1|2,0,0]=4