COMPND    HMDB0014350
HETATM    1  C1  UNL     1      -0.625  -2.762  -0.243  1.00  0.00           C  
HETATM    2  C2  UNL     1      -0.951  -1.557  -1.091  1.00  0.00           C  
HETATM    3  C3  UNL     1      -1.346  -0.369  -0.300  1.00  0.00           C  
HETATM    4  N1  UNL     1      -2.680  -0.161  -0.058  1.00  0.00           N  
HETATM    5  C4  UNL     1      -3.102   0.868   0.696  1.00  0.00           C  
HETATM    6  N2  UNL     1      -4.499   1.082   0.952  1.00  0.00           N  
HETATM    7  N3  UNL     1      -2.187   1.699   1.211  1.00  0.00           N  
HETATM    8  C5  UNL     1      -0.859   1.537   1.000  1.00  0.00           C  
HETATM    9  N4  UNL     1       0.126   2.393   1.532  1.00  0.00           N  
HETATM   10  C6  UNL     1      -0.417   0.472   0.220  1.00  0.00           C  
HETATM   11  C7  UNL     1       0.993   0.274  -0.070  1.00  0.00           C  
HETATM   12  C8  UNL     1       1.826  -0.613   0.574  1.00  0.00           C  
HETATM   13  C9  UNL     1       3.148  -0.739   0.218  1.00  0.00           C  
HETATM   14  C10 UNL     1       3.702   0.022  -0.800  1.00  0.00           C  
HETATM   15 CL1  UNL     1       5.400  -0.169  -1.225  1.00  0.00          CL  
HETATM   16  C11 UNL     1       2.897   0.918  -1.459  1.00  0.00           C  
HETATM   17  C12 UNL     1       1.578   1.028  -1.090  1.00  0.00           C  
HETATM   18  H1  UNL     1      -1.021  -2.644   0.785  1.00  0.00           H  
HETATM   19  H2  UNL     1      -1.049  -3.681  -0.753  1.00  0.00           H  
HETATM   20  H3  UNL     1       0.463  -2.929  -0.249  1.00  0.00           H  
HETATM   21  H4  UNL     1      -0.094  -1.294  -1.761  1.00  0.00           H  
HETATM   22  H5  UNL     1      -1.795  -1.820  -1.762  1.00  0.00           H  
HETATM   23  H6  UNL     1      -5.074   1.410   0.164  1.00  0.00           H  
HETATM   24  H7  UNL     1      -4.931   0.924   1.873  1.00  0.00           H  
HETATM   25  H8  UNL     1       0.224   3.343   1.068  1.00  0.00           H  
HETATM   26  H9  UNL     1       0.757   2.199   2.319  1.00  0.00           H  
HETATM   27  H10 UNL     1       1.420  -1.220   1.387  1.00  0.00           H  
HETATM   28  H11 UNL     1       3.825  -1.445   0.717  1.00  0.00           H  
HETATM   29  H12 UNL     1       3.331   1.509  -2.254  1.00  0.00           H  
HETATM   30  H13 UNL     1       0.941   1.726  -1.601  1.00  0.00           H  
CONECT    1    2   18   19   20
CONECT    2    3   21   22
CONECT    3    4    4   10
CONECT    4    5
CONECT    5    6    7    7
CONECT    6   23   24
CONECT    7    8
CONECT    8    9   10   10
CONECT    9   25   26
CONECT   10   11
CONECT   11   12   12   17
CONECT   12   13   27
CONECT   13   14   14   28
CONECT   14   15   16
CONECT   16   17   17   29
CONECT   17   30
END