COMPND    HMDB0258189
HETATM    1  F1  UNL     1       0.700  -2.533  -0.582  1.00  0.00           F  
HETATM    2  C1  UNL     1       1.995  -2.179  -0.594  1.00  0.00           C  
HETATM    3  C2  UNL     1       2.988  -3.140  -0.832  1.00  0.00           C  
HETATM    4  C3  UNL     1       4.320  -2.797  -0.861  1.00  0.00           C  
HETATM    5  C4  UNL     1       4.697  -1.486  -0.652  1.00  0.00           C  
HETATM    6 CL1  UNL     1       6.400  -1.069  -0.693  1.00  0.00          CL  
HETATM    7  C5  UNL     1       3.713  -0.567  -0.422  1.00  0.00           C  
HETATM    8  C6  UNL     1       2.358  -0.873  -0.385  1.00  0.00           C  
HETATM    9  C7  UNL     1       1.378   0.213  -0.138  1.00  0.00           C  
HETATM   10  N1  UNL     1       0.081   0.005   0.000  1.00  0.00           N  
HETATM   11  C8  UNL     1      -0.823   0.975   0.201  1.00  0.00           C  
HETATM   12  N2  UNL     1      -2.204   0.833   0.335  1.00  0.00           N  
HETATM   13  C9  UNL     1      -2.947  -0.378   0.347  1.00  0.00           C  
HETATM   14  C10 UNL     1      -2.409  -1.626   0.570  1.00  0.00           C  
HETATM   15  C11 UNL     1      -3.155  -2.794   0.555  1.00  0.00           C  
HETATM   16  N3  UNL     1      -4.465  -2.698   0.311  1.00  0.00           N  
HETATM   17  C12 UNL     1      -5.079  -1.526   0.083  1.00  0.00           C  
HETATM   18  C13 UNL     1      -4.326  -0.374   0.100  1.00  0.00           C  
HETATM   19  C14 UNL     1      -0.301   2.275   0.259  1.00  0.00           C  
HETATM   20  N4  UNL     1      -1.137   3.320   0.459  1.00  0.00           N  
HETATM   21  C15 UNL     1      -0.632   4.563   0.514  1.00  0.00           C  
HETATM   22  C16 UNL     1       0.715   4.817   0.374  1.00  0.00           C  
HETATM   23  N5  UNL     1       1.550   3.797   0.177  1.00  0.00           N  
HETATM   24  C17 UNL     1       1.040   2.540   0.121  1.00  0.00           C  
HETATM   25  N6  UNL     1       1.843   1.481  -0.076  1.00  0.00           N  
HETATM   26  H1  UNL     1       2.700  -4.162  -0.995  1.00  0.00           H  
HETATM   27  H2  UNL     1       5.032  -3.589  -1.050  1.00  0.00           H  
HETATM   28  H3  UNL     1       3.979   0.466  -0.255  1.00  0.00           H  
HETATM   29  H4  UNL     1      -2.802   1.707   0.443  1.00  0.00           H  
HETATM   30  H5  UNL     1      -1.361  -1.691   0.779  1.00  0.00           H  
HETATM   31  H6  UNL     1      -2.713  -3.767   0.732  1.00  0.00           H  
HETATM   32  H7  UNL     1      -6.139  -1.536  -0.106  1.00  0.00           H  
HETATM   33  H8  UNL     1      -4.782   0.597  -0.080  1.00  0.00           H  
HETATM   34  H9  UNL     1      -1.323   5.383   0.675  1.00  0.00           H  
HETATM   35  H10 UNL     1       1.111   5.815   0.420  1.00  0.00           H  
CONECT    1    2
CONECT    2    3    3    8
CONECT    3    4   26
CONECT    4    5    5   27
CONECT    5    6    7
CONECT    7    8    8   28
CONECT    8    9
CONECT    9   10   10   25
CONECT   10   11
CONECT   11   12   19   19
CONECT   12   13   29
CONECT   13   14   14   18
CONECT   14   15   30
CONECT   15   16   16   31
CONECT   16   17
CONECT   17   18   18   32
CONECT   18   33
CONECT   19   20   24
CONECT   20   21   21
CONECT   21   22   34
CONECT   22   23   23   35
CONECT   23   24
CONECT   24   25   25
END