COMPND    HMDB0246347
HETATM    1  C1  UNL     1       3.048  -0.987  -1.509  1.00  0.00           C  
HETATM    2  C2  UNL     1       2.203  -0.272  -0.509  1.00  0.00           C  
HETATM    3  C3  UNL     1       0.820  -0.258  -0.652  1.00  0.00           C  
HETATM    4  C4  UNL     1       0.005   0.390   0.249  1.00  0.00           C  
HETATM    5  C5  UNL     1      -1.448   0.432   0.147  1.00  0.00           C  
HETATM    6  C6  UNL     1      -2.086   1.663   0.315  1.00  0.00           C  
HETATM    7  C7  UNL     1      -3.446   1.795   0.232  1.00  0.00           C  
HETATM    8  C8  UNL     1      -4.204   0.691  -0.024  1.00  0.00           C  
HETATM    9  C9  UNL     1      -3.587  -0.525  -0.191  1.00  0.00           C  
HETATM   10  C10 UNL     1      -2.207  -0.667  -0.108  1.00  0.00           C  
HETATM   11  C11 UNL     1      -1.600  -1.995  -0.292  1.00  0.00           C  
HETATM   12  C12 UNL     1       0.629   1.030   1.307  1.00  0.00           C  
HETATM   13  C13 UNL     1       2.003   1.017   1.449  1.00  0.00           C  
HETATM   14  C14 UNL     1       2.817   0.368   0.547  1.00  0.00           C  
HETATM   15  N1  UNL     1       4.227   0.331   0.658  1.00  0.00           N  
HETATM   16  H1  UNL     1       3.183  -0.322  -2.385  1.00  0.00           H  
HETATM   17  H2  UNL     1       2.558  -1.934  -1.826  1.00  0.00           H  
HETATM   18  H3  UNL     1       4.014  -1.274  -1.037  1.00  0.00           H  
HETATM   19  H4  UNL     1       0.352  -0.760  -1.485  1.00  0.00           H  
HETATM   20  H5  UNL     1      -1.461   2.521   0.517  1.00  0.00           H  
HETATM   21  H6  UNL     1      -3.882   2.774   0.372  1.00  0.00           H  
HETATM   22  H7  UNL     1      -5.289   0.820  -0.086  1.00  0.00           H  
HETATM   23  H8  UNL     1      -4.189  -1.397  -0.393  1.00  0.00           H  
HETATM   24  H9  UNL     1      -0.631  -2.129   0.211  1.00  0.00           H  
HETATM   25  H10 UNL     1      -1.526  -2.237  -1.372  1.00  0.00           H  
HETATM   26  H11 UNL     1      -2.359  -2.738   0.102  1.00  0.00           H  
HETATM   27  H12 UNL     1       0.045   1.558   2.049  1.00  0.00           H  
HETATM   28  H13 UNL     1       2.486   1.523   2.285  1.00  0.00           H  
HETATM   29  H14 UNL     1       4.859   1.080   0.316  1.00  0.00           H  
HETATM   30  H15 UNL     1       4.665  -0.497   1.112  1.00  0.00           H  
CONECT    1    2   16   17   18
CONECT    2    3    3   14
CONECT    3    4   19
CONECT    4    5   12   12
CONECT    5    6    6   10
CONECT    6    7   20
CONECT    7    8    8   21
CONECT    8    9   22
CONECT    9   10   10   23
CONECT   10   11
CONECT   11   24   25   26
CONECT   12   13   27
CONECT   13   14   14   28
CONECT   14   15
CONECT   15   29   30
END