COMPND    HMDB0037547
HETATM    1 BR1  UNL     1       5.439  -0.653   0.812  1.00  0.00          BR  
HETATM    2  C1  UNL     1       3.684  -0.129   0.228  1.00  0.00           C  
HETATM    3  C2  UNL     1       3.257   1.170   0.408  1.00  0.00           C  
HETATM    4  C3  UNL     1       1.996   1.522  -0.018  1.00  0.00           C  
HETATM    5  C4  UNL     1       1.126   0.610  -0.629  1.00  0.00           C  
HETATM    6  O1  UNL     1      -0.131   1.013  -1.040  1.00  0.00           O  
HETATM    7  C5  UNL     1      -1.231   0.432  -0.423  1.00  0.00           C  
HETATM    8  C6  UNL     1      -1.147  -0.469   0.618  1.00  0.00           C  
HETATM    9  C7  UNL     1      -2.270  -1.034   1.210  1.00  0.00           C  
HETATM   10  C8  UNL     1      -3.511  -0.676   0.735  1.00  0.00           C  
HETATM   11 BR2  UNL     1      -5.072  -1.445   1.540  1.00  0.00          BR  
HETATM   12  C9  UNL     1      -3.653   0.221  -0.302  1.00  0.00           C  
HETATM   13  C10 UNL     1      -2.518   0.759  -0.864  1.00  0.00           C  
HETATM   14 BR3  UNL     1      -2.653   1.999  -2.297  1.00  0.00          BR  
HETATM   15  C11 UNL     1       1.588  -0.665  -0.789  1.00  0.00           C  
HETATM   16 BR4  UNL     1       0.494  -1.990  -1.655  1.00  0.00          BR  
HETATM   17  C12 UNL     1       2.847  -1.045  -0.371  1.00  0.00           C  
HETATM   18  H1  UNL     1       3.918   1.886   0.878  1.00  0.00           H  
HETATM   19  H2  UNL     1       1.634   2.549   0.115  1.00  0.00           H  
HETATM   20  H3  UNL     1      -0.168  -0.745   1.010  1.00  0.00           H  
HETATM   21  H4  UNL     1      -2.181  -1.732   2.017  1.00  0.00           H  
HETATM   22  H5  UNL     1      -4.651   0.502  -0.676  1.00  0.00           H  
HETATM   23  H6  UNL     1       3.202  -2.077  -0.508  1.00  0.00           H  
CONECT    1    2
CONECT    2    3    3   17
CONECT    3    4   18
CONECT    4    5    5   19
CONECT    5    6   15
CONECT    6    7
CONECT    7    8    8   13
CONECT    8    9   20
CONECT    9   10   10   21
CONECT   10   11   12
CONECT   12   13   13   22
CONECT   13   14
CONECT   15   16   17   17
CONECT   17   23
END