COMPND    HMDB0038444
HETATM    1  S1  UNL     1       4.885   1.766  -0.315  1.00  0.00           S  
HETATM    2  C1  UNL     1       3.965   0.651   0.387  1.00  0.00           C  
HETATM    3  N1  UNL     1       3.278  -0.365   0.750  1.00  0.00           N  
HETATM    4  C2  UNL     1       2.651  -1.253  -0.190  1.00  0.00           C  
HETATM    5  C3  UNL     1       1.291  -0.705  -0.643  1.00  0.00           C  
HETATM    6  C4  UNL     1       0.447  -0.578   0.591  1.00  0.00           C  
HETATM    7  C5  UNL     1      -0.897  -0.063   0.342  1.00  0.00           C  
HETATM    8  C6  UNL     1      -2.001  -0.828   0.059  1.00  0.00           C  
HETATM    9  C7  UNL     1      -3.241  -0.244  -0.163  1.00  0.00           C  
HETATM   10  C8  UNL     1      -3.402   1.135  -0.107  1.00  0.00           C  
HETATM   11  C9  UNL     1      -2.297   1.914   0.177  1.00  0.00           C  
HETATM   12  C10 UNL     1      -1.087   1.313   0.393  1.00  0.00           C  
HETATM   13  H1  UNL     1       3.278  -1.492  -1.053  1.00  0.00           H  
HETATM   14  H2  UNL     1       2.459  -2.231   0.337  1.00  0.00           H  
HETATM   15  H3  UNL     1       1.439   0.234  -1.178  1.00  0.00           H  
HETATM   16  H4  UNL     1       0.859  -1.437  -1.356  1.00  0.00           H  
HETATM   17  H5  UNL     1       0.419  -1.600   1.067  1.00  0.00           H  
HETATM   18  H6  UNL     1       0.977   0.064   1.325  1.00  0.00           H  
HETATM   19  H7  UNL     1      -1.852  -1.902   0.020  1.00  0.00           H  
HETATM   20  H8  UNL     1      -4.108  -0.875  -0.387  1.00  0.00           H  
HETATM   21  H9  UNL     1      -4.388   1.547  -0.287  1.00  0.00           H  
HETATM   22  H10 UNL     1      -2.443   2.987   0.217  1.00  0.00           H  
HETATM   23  H11 UNL     1      -0.233   1.962   0.615  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3    3
CONECT    3    4
CONECT    4    5   13   14
CONECT    5    6   15   16
CONECT    6    7   17   18
CONECT    7    8    8   12
CONECT    8    9   19
CONECT    9   10   10   20
CONECT   10   11   21
CONECT   11   12   12   22
CONECT   12   23
END