COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.646   1.724   0.850  1.00  0.00           C  
HETATM    2  O   UNL     1       7.040   0.452   0.615  1.00  0.00           O  
HETATM    3  C   UNL     1       5.695   0.435   0.437  1.00  0.00           C  
HETATM    4  C   UNL     1       4.992   1.603   0.488  1.00  0.00           C  
HETATM    5  C   UNL     1       3.600   1.596   0.305  1.00  0.00           C  
HETATM    6  N   UNL     1       2.899   2.734   0.353  1.00  0.00           N  
HETATM    7  C   UNL     1       1.597   2.751   0.185  1.00  0.00           C  
HETATM    8  C   UNL     1       0.873   1.590  -0.052  1.00  0.00           C  
HETATM    9  C   UNL     1       1.530   0.373  -0.115  1.00  0.00           C  
HETATM   10  C   UNL     1       2.934   0.367   0.067  1.00  0.00           C  
HETATM   11  C   UNL     1       3.664  -0.825   0.015  1.00  0.00           C  
HETATM   12  C   UNL     1       5.039  -0.791   0.195  1.00  0.00           C  
HETATM   13  C   UNL     1       5.817  -2.043   0.142  1.00  0.00           C  
HETATM   14  O   UNL     1       7.023  -2.016   0.299  1.00  0.00           O  
HETATM   15  N   UNL     1       5.193  -3.216  -0.081  1.00  0.00           N  
HETATM   16  O   UNL     1       0.851  -0.776  -0.345  1.00  0.00           O  
HETATM   17  C   UNL     1      -0.506  -0.714  -0.411  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.121  -0.196  -1.541  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.500  -0.132  -1.609  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.269  -0.586  -0.545  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.652  -1.104   0.586  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.274  -1.172   0.650  1.00  0.00           C  
HETATM   23  N   UNL     1      -4.668  -0.521  -0.612  1.00  0.00           N  
HETATM   24  C   UNL     1      -5.385  -0.273   0.502  1.00  0.00           C  
HETATM   25  O   UNL     1      -4.826  -0.183   1.578  1.00  0.00           O  
HETATM   26  N   UNL     1      -6.723  -0.125   0.423  1.00  0.00           N  
HETATM   27  C   UNL     1      -7.503   0.144   1.633  1.00  0.00           C  
HETATM   28  C   UNL     1      -8.844   0.861   1.464  1.00  0.00           C  
HETATM   29  C   UNL     1      -8.811  -0.628   1.817  1.00  0.00           C  
HETATM   30 CL   UNL     1      -3.271   0.516  -3.023  1.00  0.00          Cl  
HETATM   31  H   UNL     1       7.455   2.381   0.002  1.00  0.00           H  
HETATM   32  H   UNL     1       7.225   2.166   1.753  1.00  0.00           H  
HETATM   33  H   UNL     1       8.722   1.596   0.976  1.00  0.00           H  
HETATM   34  H   UNL     1       5.508   2.534   0.670  1.00  0.00           H  
HETATM   35  H   UNL     1       1.074   3.695   0.233  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.198   1.636  -0.185  1.00  0.00           H  
HETATM   37  H   UNL     1       3.161  -1.763  -0.165  1.00  0.00           H  
HETATM   38  H   UNL     1       4.231  -3.237  -0.207  1.00  0.00           H  
HETATM   39  H   UNL     1       5.705  -4.039  -0.116  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.523   0.157  -2.368  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.249  -1.457   1.414  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.794  -1.575   1.529  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.119  -0.655  -1.460  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.169  -0.197  -0.436  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.921   0.369   2.527  1.00  0.00           H  
HETATM   46  H   UNL     1      -9.144   1.557   2.247  1.00  0.00           H  
HETATM   47  H   UNL     1      -9.146   1.133   0.453  1.00  0.00           H  
HETATM   48  H   UNL     1      -9.091  -1.337   1.038  1.00  0.00           H  
HETATM   49  H   UNL     1      -9.089  -0.911   2.832  1.00  0.00           H  
CONECT    1    2   31   32   33                                       
CONECT    2    3    1                                                 
CONECT    3    4    4   12    2                                       
CONECT    4    5    3    3   34                                       
CONECT    5    6   10   10    4                                       
CONECT    6    7    7    5                                            
CONECT    7    8    6    6   35                                       
CONECT    8    9    9    7   36                                       
CONECT    9    8    8   16   10                                       
CONECT   10    9    5    5   11                                       
CONECT   11   10   12   12   37                                       
CONECT   12   11   11    3   13                                       
CONECT   13   12   14   14   15                                       
CONECT   14   13   13                                                 
CONECT   15   13   38   39                                            
CONECT   16   17    9                                                 
CONECT   17   18   18   22   16                                       
CONECT   18   19   17   17   40                                       
CONECT   19   30   20   20   18                                       
CONECT   20   23   19   19   21                                       
CONECT   21   20   22   22   41                                       
CONECT   22   21   21   17   42                                       
CONECT   23   24   20   43                                            
CONECT   24   26   23   25   25                                       
CONECT   25   24   24                                                 
CONECT   26   27   24   44                                            
CONECT   27   29   28   26   45                                       
CONECT   28   29   27   46   47                                       
CONECT   29   28   27   48   49                                       
CONECT   30   19                                                      
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    4                                                      
CONECT   35    7                                                      
CONECT   36    8                                                      
CONECT   37   11                                                      
CONECT   38   15                                                      
CONECT   39   15                                                      
CONECT   40   18                                                      
CONECT   41   21                                                      
CONECT   42   22                                                      
CONECT   43   23                                                      
CONECT   44   26                                                      
CONECT   45   27                                                      
CONECT   46   28                                                      
CONECT   47   28                                                      
CONECT   48   29                                                      
CONECT   49   29                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
