COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.045  -0.623  -6.479  1.00  0.00           C  
HETATM    2  C   UNL     1       0.952  -0.444  -5.116  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.250  -0.012  -4.551  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.354   0.229  -5.373  1.00  0.00           C  
HETATM    5 CL   UNL     1      -2.854   0.764  -4.682  1.00  0.00          Cl  
HETATM    6  C   UNL     1      -1.246   0.051  -6.738  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.051  -0.376  -7.291  1.00  0.00           C  
HETATM    8  N   UNL     1       0.708  -0.059  -2.301  1.00  0.00           N  
HETATM    9  C   UNL     1      -0.356   0.180  -3.091  1.00  0.00           C  
HETATM   10  O   UNL     1      -1.404   0.555  -2.603  1.00  0.00           O  
HETATM   11  N   UNL     1       1.675  -0.122  -0.177  1.00  0.00           N  
HETATM   12  C   UNL     1       1.540  -0.064   1.215  1.00  0.00           C  
HETATM   13  C   UNL     1       0.299  -0.272   1.803  1.00  0.00           C  
HETATM   14  C   UNL     1       0.167  -0.214   3.176  1.00  0.00           C  
HETATM   15  C   UNL     1       1.275   0.047   3.969  1.00  0.00           C  
HETATM   16  O   UNL     1       1.144   0.105   5.321  1.00  0.00           O  
HETATM   17  C   UNL     1      -0.232  -0.141   5.614  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.449  -0.090   7.128  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.923  -0.355   7.441  1.00  0.00           C  
HETATM   20  C   UNL     1       2.516   0.250   3.384  1.00  0.00           C  
HETATM   21  C   UNL     1       2.649   0.192   2.010  1.00  0.00           C  
HETATM   22  C   UNL     1       0.611   0.117  -0.968  1.00  0.00           C  
HETATM   23  O   UNL     1      -0.436   0.492  -0.479  1.00  0.00           O  
HETATM   24 CL   UNL     1       0.075  -0.603  -9.007  1.00  0.00          Cl  
HETATM   25  C   UNL     1       3.997   0.414   1.374  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.137  -0.305   8.932  1.00  0.00           C  
HETATM   27  O   UNL     1      -3.361  -0.509   9.441  1.00  0.00           O  
HETATM   28  O   UNL     1      -1.206  -0.080   9.668  1.00  0.00           O  
HETATM   29  C   UNL     1       3.718   0.535   4.246  1.00  0.00           C  
HETATM   30  H   UNL     1       1.974  -0.956  -6.917  1.00  0.00           H  
HETATM   31  H   UNL     1       1.807  -0.636  -4.486  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.096   0.241  -7.376  1.00  0.00           H  
HETATM   33  H   UNL     1       1.544  -0.358  -2.691  1.00  0.00           H  
HETATM   34  H   UNL     1       2.535  -0.335  -0.573  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.562  -0.476   1.185  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.798  -0.372   3.632  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.848   0.617   5.133  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.512  -1.126   5.240  1.00  0.00           H  
HETATM   39  H   UNL     1       0.166  -0.850   7.609  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.169   0.894   7.502  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.539   0.404   6.960  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.203  -1.340   7.067  1.00  0.00           H  
HETATM   43  H   UNL     1       4.517  -0.539   1.282  1.00  0.00           H  
HETATM   44  H   UNL     1       3.865   0.852   0.385  1.00  0.00           H  
HETATM   45  H   UNL     1       4.586   1.089   1.995  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.498  -0.477  10.398  1.00  0.00           H  
HETATM   47  H   UNL     1       3.814   1.611   4.393  1.00  0.00           H  
HETATM   48  H   UNL     1       3.596   0.046   5.213  1.00  0.00           H  
HETATM   49  H   UNL     1       4.615   0.154   3.757  1.00  0.00           H  
CONECT    1    2    7    7   30                                       
CONECT    2    1    3    3   31                                       
CONECT    3    2    2    4    9                                       
CONECT    4    3    5    6    6                                       
CONECT    5    4                                                      
CONECT    6    4    4    7   32                                       
CONECT    7    1    1    6   24                                       
CONECT    8    9   22   33                                            
CONECT    9    3    8   10   10                                       
CONECT   10    9    9                                                 
CONECT   11   12   22   34                                            
CONECT   12   11   13   13   21                                       
CONECT   13   12   12   14   35                                       
CONECT   14   13   15   15   36                                       
CONECT   15   14   14   16   20                                       
CONECT   16   15   17                                                 
CONECT   17   16   18   37   38                                       
CONECT   18   17   19   39   40                                       
CONECT   19   18   26   41   42                                       
CONECT   20   15   21   21   29                                       
CONECT   21   12   20   20   25                                       
CONECT   22    8   11   23   23                                       
CONECT   23   22   22                                                 
CONECT   24    7                                                      
CONECT   25   21   43   44   45                                       
CONECT   26   19   27   28   28                                       
CONECT   27   26   46                                                 
CONECT   28   26   26                                                 
CONECT   29   20   47   48   49                                       
CONECT   30    1                                                      
CONECT   31    2                                                      
CONECT   32    6                                                      
CONECT   33    8                                                      
CONECT   34   11                                                      
CONECT   35   13                                                      
CONECT   36   14                                                      
CONECT   37   17                                                      
CONECT   38   17                                                      
CONECT   39   18                                                      
CONECT   40   18                                                      
CONECT   41   19                                                      
CONECT   42   19                                                      
CONECT   43   25                                                      
CONECT   44   25                                                      
CONECT   45   25                                                      
CONECT   46   27                                                      
CONECT   47   29                                                      
CONECT   48   29                                                      
CONECT   49   29                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
