COMPND    HMDB0041835
HETATM    1  N1  UNL     1       4.943   0.138  -0.155  1.00  0.00           N  
HETATM    2  C1  UNL     1       3.518   0.071  -0.128  1.00  0.00           C  
HETATM    3  C2  UNL     1       2.817   1.084   0.474  1.00  0.00           C  
HETATM    4  C3  UNL     1       1.423   1.035   0.509  1.00  0.00           C  
HETATM    5  C4  UNL     1       0.727  -0.006  -0.046  1.00  0.00           C  
HETATM    6  C5  UNL     1      -0.713  -0.034   0.006  1.00  0.00           C  
HETATM    7  C6  UNL     1      -1.486  -0.616  -0.979  1.00  0.00           C  
HETATM    8  C7  UNL     1      -2.862  -0.647  -0.933  1.00  0.00           C  
HETATM    9  C8  UNL     1      -3.531  -0.072   0.141  1.00  0.00           C  
HETATM   10  N2  UNL     1      -4.963  -0.101   0.192  1.00  0.00           N  
HETATM   11  C9  UNL     1      -2.781   0.516   1.137  1.00  0.00           C  
HETATM   12  C10 UNL     1      -1.403   0.535   1.071  1.00  0.00           C  
HETATM   13  C11 UNL     1       1.445  -1.006  -0.642  1.00  0.00           C  
HETATM   14  C12 UNL     1       2.830  -0.979  -0.689  1.00  0.00           C  
HETATM   15  H1  UNL     1       5.426  -0.098  -1.038  1.00  0.00           H  
HETATM   16  H2  UNL     1       5.440   0.420   0.710  1.00  0.00           H  
HETATM   17  H3  UNL     1       3.362   1.926   0.925  1.00  0.00           H  
HETATM   18  H4  UNL     1       0.937   1.868   1.000  1.00  0.00           H  
HETATM   19  H5  UNL     1      -0.979  -1.065  -1.817  1.00  0.00           H  
HETATM   20  H6  UNL     1      -3.450  -1.114  -1.726  1.00  0.00           H  
HETATM   21  H7  UNL     1      -5.537   0.778   0.047  1.00  0.00           H  
HETATM   22  H8  UNL     1      -5.504  -0.974   0.373  1.00  0.00           H  
HETATM   23  H9  UNL     1      -3.259   0.975   1.990  1.00  0.00           H  
HETATM   24  H10 UNL     1      -0.776   0.991   1.837  1.00  0.00           H  
HETATM   25  H11 UNL     1       0.954  -1.863  -1.104  1.00  0.00           H  
HETATM   26  H12 UNL     1       3.420  -1.761  -1.155  1.00  0.00           H  
CONECT    1    2   15   16
CONECT    2    3    3   14
CONECT    3    4   17
CONECT    4    5    5   18
CONECT    5    6   13
CONECT    6    7    7   12
CONECT    7    8   19
CONECT    8    9    9   20
CONECT    9   10   11
CONECT   10   21   22
CONECT   11   12   12   23
CONECT   12   24
CONECT   13   14   14   25
CONECT   14   26
END