COMPND    HMDB0249857
HETATM    1  N1  UNL     1      -4.080  -4.569  -1.850  1.00  0.00           N  
HETATM    2  C1  UNL     1      -3.478  -3.657  -1.466  1.00  0.00           C  
HETATM    3  C2  UNL     1      -2.711  -2.526  -0.979  1.00  0.00           C  
HETATM    4  C3  UNL     1      -2.009  -1.713  -1.832  1.00  0.00           C  
HETATM    5  C4  UNL     1      -1.274  -0.627  -1.349  1.00  0.00           C  
HETATM    6  C5  UNL     1      -1.228  -0.333  -0.004  1.00  0.00           C  
HETATM    7  C6  UNL     1      -0.444   0.823   0.535  1.00  0.00           C  
HETATM    8  F1  UNL     1      -0.979   1.087   1.793  1.00  0.00           F  
HETATM    9  C7  UNL     1       0.976   0.434   0.720  1.00  0.00           C  
HETATM   10  C8  UNL     1       1.847   0.224  -0.335  1.00  0.00           C  
HETATM   11  C9  UNL     1       3.153  -0.139  -0.086  1.00  0.00           C  
HETATM   12  C10 UNL     1       3.622  -0.301   1.203  1.00  0.00           C  
HETATM   13  C11 UNL     1       4.969  -0.676   1.502  1.00  0.00           C  
HETATM   14  N2  UNL     1       6.076  -0.987   1.739  1.00  0.00           N  
HETATM   15  C12 UNL     1       2.764  -0.094   2.270  1.00  0.00           C  
HETATM   16  C13 UNL     1       1.469   0.266   1.996  1.00  0.00           C  
HETATM   17  N3  UNL     1      -0.584   1.992  -0.293  1.00  0.00           N  
HETATM   18  C14 UNL     1      -1.430   3.017  -0.112  1.00  0.00           C  
HETATM   19  N4  UNL     1      -1.254   3.926  -1.113  1.00  0.00           N  
HETATM   20  C15 UNL     1      -0.288   3.433  -1.902  1.00  0.00           C  
HETATM   21  N5  UNL     1       0.100   2.256  -1.378  1.00  0.00           N  
HETATM   22  C16 UNL     1      -1.941  -1.162   0.838  1.00  0.00           C  
HETATM   23  C17 UNL     1      -2.669  -2.237   0.370  1.00  0.00           C  
HETATM   24  H1  UNL     1      -2.022  -1.917  -2.914  1.00  0.00           H  
HETATM   25  H2  UNL     1      -0.738  -0.006  -2.031  1.00  0.00           H  
HETATM   26  H3  UNL     1       1.515   0.343  -1.356  1.00  0.00           H  
HETATM   27  H4  UNL     1       3.837  -0.305  -0.895  1.00  0.00           H  
HETATM   28  H5  UNL     1       3.133  -0.222   3.293  1.00  0.00           H  
HETATM   29  H6  UNL     1       0.807   0.424   2.837  1.00  0.00           H  
HETATM   30  H7  UNL     1      -2.147   3.157   0.669  1.00  0.00           H  
HETATM   31  H8  UNL     1       0.123   3.880  -2.802  1.00  0.00           H  
HETATM   32  H9  UNL     1      -1.894  -0.916   1.899  1.00  0.00           H  
HETATM   33  H10 UNL     1      -3.223  -2.879   1.032  1.00  0.00           H  
CONECT    1    2    2    2
CONECT    2    3
CONECT    3    4    4   23
CONECT    4    5   24
CONECT    5    6    6   25
CONECT    6    7   22
CONECT    7    8    9   17
CONECT    9   10   10   16
CONECT   10   11   26
CONECT   11   12   12   27
CONECT   12   13   15
CONECT   13   14   14   14
CONECT   15   16   16   28
CONECT   16   29
CONECT   17   18   21
CONECT   18   19   19   30
CONECT   19   20
CONECT   20   21   21   31
CONECT   22   23   23   32
CONECT   23   33
END