COMPND    HMDB0037498
HETATM    1  C1  UNL     1       2.390   2.655   0.388  1.00  0.00           C  
HETATM    2  C2  UNL     1       1.248   2.125   0.806  1.00  0.00           C  
HETATM    3  C3  UNL     1       0.269   1.624  -0.195  1.00  0.00           C  
HETATM    4  C4  UNL     1      -1.157   2.085   0.090  1.00  0.00           C  
HETATM    5  C5  UNL     1      -1.678   1.648   1.412  1.00  0.00           C  
HETATM    6  C6  UNL     1      -1.733   0.161   1.632  1.00  0.00           C  
HETATM    7  C7  UNL     1      -2.629  -0.475   0.624  1.00  0.00           C  
HETATM    8  C8  UNL     1      -2.732  -1.971   0.779  1.00  0.00           C  
HETATM    9  O1  UNL     1       0.336   0.234  -0.384  1.00  0.00           O  
HETATM   10  C9  UNL     1       0.665  -0.339  -1.578  1.00  0.00           C  
HETATM   11  O2  UNL     1       0.933   0.334  -2.591  1.00  0.00           O  
HETATM   12  C10 UNL     1       0.709  -1.820  -1.689  1.00  0.00           C  
HETATM   13  C11 UNL     1       2.008  -2.245  -1.020  1.00  0.00           C  
HETATM   14  C12 UNL     1       3.165  -1.594  -1.751  1.00  0.00           C  
HETATM   15  H1  UNL     1       3.083   3.011   1.174  1.00  0.00           H  
HETATM   16  H2  UNL     1       2.694   2.782  -0.625  1.00  0.00           H  
HETATM   17  H3  UNL     1       1.074   2.080   1.872  1.00  0.00           H  
HETATM   18  H4  UNL     1       0.530   2.098  -1.169  1.00  0.00           H  
HETATM   19  H5  UNL     1      -1.154   3.179  -0.019  1.00  0.00           H  
HETATM   20  H6  UNL     1      -1.777   1.660  -0.728  1.00  0.00           H  
HETATM   21  H7  UNL     1      -1.194   2.182   2.265  1.00  0.00           H  
HETATM   22  H8  UNL     1      -2.754   1.990   1.465  1.00  0.00           H  
HETATM   23  H9  UNL     1      -2.123  -0.002   2.670  1.00  0.00           H  
HETATM   24  H10 UNL     1      -0.702  -0.221   1.633  1.00  0.00           H  
HETATM   25  H11 UNL     1      -3.656  -0.027   0.771  1.00  0.00           H  
HETATM   26  H12 UNL     1      -2.340  -0.261  -0.406  1.00  0.00           H  
HETATM   27  H13 UNL     1      -3.615  -2.202   1.436  1.00  0.00           H  
HETATM   28  H14 UNL     1      -2.976  -2.450  -0.209  1.00  0.00           H  
HETATM   29  H15 UNL     1      -1.806  -2.452   1.123  1.00  0.00           H  
HETATM   30  H16 UNL     1       0.680  -2.173  -2.752  1.00  0.00           H  
HETATM   31  H17 UNL     1      -0.152  -2.306  -1.183  1.00  0.00           H  
HETATM   32  H18 UNL     1       2.094  -3.350  -0.978  1.00  0.00           H  
HETATM   33  H19 UNL     1       2.024  -1.821   0.032  1.00  0.00           H  
HETATM   34  H20 UNL     1       4.095  -1.688  -1.173  1.00  0.00           H  
HETATM   35  H21 UNL     1       2.954  -0.486  -1.787  1.00  0.00           H  
HETATM   36  H22 UNL     1       3.228  -1.962  -2.785  1.00  0.00           H  
CONECT    1    2    2   15   16
CONECT    2    3   17
CONECT    3    4    9   18
CONECT    4    5   19   20
CONECT    5    6   21   22
CONECT    6    7   23   24
CONECT    7    8   25   26
CONECT    8   27   28   29
CONECT    9   10
CONECT   10   11   11   12
CONECT   12   13   30   31
CONECT   13   14   32   33
CONECT   14   34   35   36
END