COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.845   1.687  -0.528  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.368   2.322  -0.384  1.00  0.00           C  
HETATM    3  C   UNL     1       4.200   1.454   1.686  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.545   1.581  -0.329  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.783   3.687  -0.092  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.924   1.550  -0.129  1.00  0.00           C  
HETATM    7  C   UNL     1       3.092   1.051   0.971  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.937   0.098  -0.217  1.00  0.00           C  
HETATM    9  C   UNL     1       3.241   0.097  -0.035  1.00  0.00           C  
HETATM   10  C   UNL     1       0.910   0.298  -0.627  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.722  -0.595  -0.354  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.759  -1.958   2.037  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.482   0.178  -0.419  1.00  0.00           C  
HETATM   14  N   UNL     1       4.914  -2.177  -2.108  1.00  0.00           N  
HETATM   15  C   UNL     1       4.744  -1.398  -1.298  1.00  0.00           C  
HETATM   16  C   UNL     1       4.530  -0.417  -0.278  1.00  0.00           C  
HETATM   17  C   UNL     1       5.596   0.050   0.496  1.00  0.00           C  
HETATM   18 CL   UNL     1       7.195  -0.565   0.218  1.00  0.00          Cl  
HETATM   19  N   UNL     1       5.398   0.958   1.431  1.00  0.00           N  
HETATM   20  N   UNL     1       2.150  -0.334  -0.775  1.00  0.00           N  
HETATM   21  C   UNL     1      -0.247  -0.456  -0.578  1.00  0.00           C  
HETATM   22  N   UNL     1      -2.744  -1.961  -0.409  1.00  0.00           N  
HETATM   23  C   UNL     1      -3.199  -2.702   0.775  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.715  -2.831   0.770  1.00  0.00           C  
HETATM   25  O   UNL     1      -5.363  -1.542   0.847  1.00  0.00           O  
HETATM   26  C   UNL     1      -5.184  -0.677  -0.178  1.00  0.00           C  
HETATM   27  O   UNL     1      -6.030  -0.545  -1.041  1.00  0.00           O  
HETATM   28  O   UNL     1      -4.972   2.159  -0.003  1.00  0.00           O  
HETATM   29  N   UNL     1      -2.760   2.225  -0.185  1.00  0.00           N  
HETATM   30  H   UNL     1       1.753   2.270  -0.570  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.406   3.399  -0.313  1.00  0.00           H  
HETATM   32  H   UNL     1       4.088   2.193   2.465  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.875   4.113  -1.091  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.632   4.000   0.516  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.858   4.036   0.367  1.00  0.00           H  
HETATM   36  H   UNL     1       2.121   1.469   1.189  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.196  -0.960   2.042  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.095  -2.506   2.917  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.671  -1.879   2.052  1.00  0.00           H  
HETATM   40  H   UNL     1       2.247  -1.073  -1.395  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.196  -1.533  -0.654  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.466  -2.429  -1.212  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.755  -3.697   0.769  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.025  -3.330  -0.148  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.023  -3.436   1.623  1.00  0.00           H  
CONECT    1   10    2    2   30                                       
CONECT    2    1    1    4   31                                       
CONECT    3   19    7    7   32                                       
CONECT    4    2   13   13   29                                       
CONECT    5   29   33   34   35                                       
CONECT    6   29    8   28   28                                       
CONECT    7    3    3    9   36                                       
CONECT    8   11   11    6   26                                       
CONECT    9   16   16    7   20                                       
CONECT   10   20    1   21   21                                       
CONECT   11   13   22    8    8                                       
CONECT   12   23   37   38   39                                       
CONECT   13   21    4    4   11                                       
CONECT   14   15   15   15                                            
CONECT   15   16   14   14   14                                       
CONECT   16   17   15    9    9                                       
CONECT   17   18   19   19   16                                       
CONECT   18   17                                                      
CONECT   19   17   17    3                                            
CONECT   20    9   10   40                                            
CONECT   21   10   10   13   41                                       
CONECT   22   23   11   42                                            
CONECT   23   22   12   24   43                                       
CONECT   24   23   25   44   45                                       
CONECT   25   24   26                                                 
CONECT   26    8   25   27   27                                       
CONECT   27   26   26                                                 
CONECT   28    6    6                                                 
CONECT   29    4    5    6                                            
CONECT   30    1                                                      
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    5                                                      
CONECT   34    5                                                      
CONECT   35    5                                                      
CONECT   36    7                                                      
CONECT   37   12                                                      
CONECT   38   12                                                      
CONECT   39   12                                                      
CONECT   40   20                                                      
CONECT   41   21                                                      
CONECT   42   22                                                      
CONECT   43   23                                                      
CONECT   44   24                                                      
CONECT   45   24                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
