COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.125   1.092   0.065  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.190   0.886  -0.300  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.567  -0.309  -0.902  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.917   0.154  -0.605  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.623   1.166  -1.244  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.633   1.830  -0.579  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.952   1.495   0.728  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.264   0.495   1.378  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.241  -0.192   0.717  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.502  -1.263   1.406  1.00  0.00           C  
HETATM   11  O   UNL     1      -2.726  -1.503   2.714  1.00  0.00           O  
HETATM   12  O   UNL     1      -1.690  -1.930   0.796  1.00  0.00           O  
HETATM   13  N   UNL     1      -1.900  -0.516  -1.271  1.00  0.00           N  
HETATM   14  C   UNL     1       0.381  -1.299  -1.139  1.00  0.00           C  
HETATM   15 CL   UNL     1      -0.091  -2.790  -1.893  1.00  0.00          Cl  
HETATM   16 CL   UNL     1      -1.376   2.119  -0.005  1.00  0.00          Cl  
HETATM   17  C   UNL     1       2.076   0.101  -0.172  1.00  0.00           C  
HETATM   18  C   UNL     1       1.697  -1.096  -0.776  1.00  0.00           C  
HETATM   19  C   UNL     1       3.492   0.323   0.214  1.00  0.00           C  
HETATM   20  C   UNL     1       4.225  -0.344   1.154  1.00  0.00           C  
HETATM   21  C   UNL     1       3.757  -1.479   2.028  1.00  0.00           C  
HETATM   22  O   UNL     1       5.445   0.211   1.142  1.00  0.00           O  
HETATM   23  N   UNL     1       5.524   1.104   0.332  1.00  0.00           N  
HETATM   24  C   UNL     1       4.407   1.278  -0.311  1.00  0.00           C  
HETATM   25  C   UNL     1       4.135   2.290  -1.394  1.00  0.00           C  
HETATM   26  H   UNL     1       1.417   2.022   0.530  1.00  0.00           H  
HETATM   27  H   UNL     1      -3.380   1.433  -2.262  1.00  0.00           H  
HETATM   28  H   UNL     1      -5.178   2.616  -1.080  1.00  0.00           H  
HETATM   29  H   UNL     1      -5.742   2.024   1.240  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.517   0.238   2.396  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.216  -2.216   3.122  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.114  -1.128  -1.993  1.00  0.00           H  
HETATM   33  H   UNL     1       2.433  -1.865  -0.960  1.00  0.00           H  
HETATM   34  H   UNL     1       3.945  -2.427   1.525  1.00  0.00           H  
HETATM   35  H   UNL     1       4.298  -1.456   2.974  1.00  0.00           H  
HETATM   36  H   UNL     1       2.689  -1.374   2.218  1.00  0.00           H  
HETATM   37  H   UNL     1       3.770   3.213  -0.945  1.00  0.00           H  
HETATM   38  H   UNL     1       5.056   2.492  -1.942  1.00  0.00           H  
HETATM   39  H   UNL     1       3.384   1.896  -2.079  1.00  0.00           H  
CONECT    1    2    2   17   26                                       
CONECT    2    3   16    1    1                                       
CONECT    3   13   14   14    2                                       
CONECT    4    9    9    5   13                                       
CONECT    5    6    6    4   27                                       
CONECT    6    7    5    5   28                                       
CONECT    7    8    8    6   29                                       
CONECT    8    7    7    9   30                                       
CONECT    9    8   10    4    4                                       
CONECT   10    9   12   12   11                                       
CONECT   11   10   31                                                 
CONECT   12   10   10                                                 
CONECT   13    4    3   32                                            
CONECT   14   15    3    3   18                                       
CONECT   15   14                                                      
CONECT   16    2                                                      
CONECT   17   18   18    1   19                                       
CONECT   18   14   17   17   33                                       
CONECT   19   17   24   20   20                                       
CONECT   20   19   19   22   21                                       
CONECT   21   20   34   35   36                                       
CONECT   22   23   20                                                 
CONECT   23   24   24   22                                            
CONECT   24   25   19   23   23                                       
CONECT   25   24   37   38   39                                       
CONECT   26    1                                                      
CONECT   27    5                                                      
CONECT   28    6                                                      
CONECT   29    7                                                      
CONECT   30    8                                                      
CONECT   31   11                                                      
CONECT   32   13                                                      
CONECT   33   18                                                      
CONECT   34   21                                                      
CONECT   35   21                                                      
CONECT   36   21                                                      
CONECT   37   25                                                      
CONECT   38   25                                                      
CONECT   39   25                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
