COMPND    HMDB0244438
HETATM    1  O1  UNL     1      -0.867  -1.055  -2.201  1.00  0.00           O  
HETATM    2  C1  UNL     1      -1.373  -0.356  -1.284  1.00  0.00           C  
HETATM    3  C2  UNL     1      -2.793   0.067  -1.169  1.00  0.00           C  
HETATM    4  C3  UNL     1      -2.932   0.336   0.308  1.00  0.00           C  
HETATM    5  O2  UNL     1      -3.279  -0.831   0.976  1.00  0.00           O  
HETATM    6  C4  UNL     1      -1.556   0.738   0.685  1.00  0.00           C  
HETATM    7  O3  UNL     1      -1.298   1.501   1.648  1.00  0.00           O  
HETATM    8  N1  UNL     1      -0.612   0.138  -0.191  1.00  0.00           N  
HETATM    9  C5  UNL     1       0.795   0.054  -0.007  1.00  0.00           C  
HETATM   10  C6  UNL     1       1.458  -1.168  -0.050  1.00  0.00           C  
HETATM   11  C7  UNL     1       2.822  -1.277   0.126  1.00  0.00           C  
HETATM   12 CL1  UNL     1       3.632  -2.833   0.067  1.00  0.00          CL  
HETATM   13  C8  UNL     1       3.581  -0.149   0.353  1.00  0.00           C  
HETATM   14  C9  UNL     1       2.956   1.088   0.402  1.00  0.00           C  
HETATM   15 CL2  UNL     1       3.940   2.518   0.694  1.00  0.00          CL  
HETATM   16  C10 UNL     1       1.582   1.169   0.222  1.00  0.00           C  
HETATM   17  H1  UNL     1      -3.489  -0.770  -1.432  1.00  0.00           H  
HETATM   18  H2  UNL     1      -3.015   0.970  -1.787  1.00  0.00           H  
HETATM   19  H3  UNL     1      -3.633   1.167   0.525  1.00  0.00           H  
HETATM   20  H4  UNL     1      -2.559  -1.146   1.589  1.00  0.00           H  
HETATM   21  H5  UNL     1       0.887  -2.053  -0.225  1.00  0.00           H  
HETATM   22  H6  UNL     1       4.647  -0.263   0.487  1.00  0.00           H  
HETATM   23  H7  UNL     1       1.103   2.155   0.265  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3    8
CONECT    3    4   17   18
CONECT    4    5    6   19
CONECT    5   20
CONECT    6    7    7    8
CONECT    8    9
CONECT    9   10   10   16
CONECT   10   11   21
CONECT   11   12   13   13
CONECT   13   14   22
CONECT   14   15   16   16
CONECT   16   23
END