COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.984  -2.341   0.191  1.00  0.00           C  
HETATM    2  N   UNL     1      -2.013   0.720  -0.272  1.00  0.00           N  
HETATM    3  C   UNL     1      -3.657  -0.986   0.042  1.00  0.00           C  
HETATM    4  N   UNL     1      -1.089   3.197  -0.406  1.00  0.00           N  
HETATM    5  C   UNL     1      -2.351  -0.609  -0.123  1.00  0.00           C  
HETATM    6  N   UNL     1      -3.141   4.193  -0.092  1.00  0.00           N  
HETATM    7  C   UNL     1      -3.035   1.758  -0.114  1.00  0.00           C  
HETATM    8  N   UNL     1       2.328  -2.034  -0.492  1.00  0.00           N  
HETATM    9  C   UNL     1      -4.083   1.613  -1.219  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.709   1.607   1.251  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.390   3.116  -0.208  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.488   4.372  -0.494  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.245   5.527  -0.377  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.610   5.402  -0.170  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.318  -1.656  -0.139  1.00  0.00           C  
HETATM   16  C   UNL     1       0.030  -1.336  -0.308  1.00  0.00           C  
HETATM   17  C   UNL     1       0.975  -2.347  -0.323  1.00  0.00           C  
HETATM   18  C   UNL     1       2.870  -0.932   0.150  1.00  0.00           C  
HETATM   19  C   UNL     1       2.134  -0.219   1.096  1.00  0.00           C  
HETATM   20  C   UNL     1       2.708   0.872   1.714  1.00  0.00           C  
HETATM   21  C   UNL     1       4.683   0.613   0.545  1.00  0.00           C  
HETATM   22  C   UNL     1       4.183  -0.503  -0.130  1.00  0.00           C  
HETATM   23  C   UNL     1       4.989  -1.198  -1.088  1.00  0.00           C  
HETATM   24  C   UNL     1       0.583  -3.676  -0.170  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.745  -4.000  -0.003  1.00  0.00           C  
HETATM   26  C   UNL     1      -1.709  -2.997   0.015  1.00  0.00           C  
HETATM   27  N   UNL     1       5.628  -1.750  -1.848  1.00  0.00           N  
HETATM   28 CL   UNL     1       6.297   1.164   0.220  1.00  0.00          Cl  
HETATM   29  N   UNL     1       3.940   1.253   1.426  1.00  0.00           N  
HETATM   30  N   UNL     1      -3.046  -3.303   0.183  1.00  0.00           N  
HETATM   31  C   UNL     1      -3.450  -4.702   0.343  1.00  0.00           C  
HETATM   32  O   UNL     1      -5.154  -2.655   0.336  1.00  0.00           O  
HETATM   33  H   UNL     1      -1.099   0.967  -0.481  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.436  -0.239   0.057  1.00  0.00           H  
HETATM   35  H   UNL     1       2.887  -2.589  -1.059  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.583   0.650  -1.122  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.817   2.414  -1.130  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.596   1.673  -2.193  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.950   1.609   2.033  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.397   2.437   1.410  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.260   0.667   1.282  1.00  0.00           H  
HETATM   42  H   UNL     1       0.578   4.431  -0.656  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.783   6.501  -0.444  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.231   6.280  -0.074  1.00  0.00           H  
HETATM   45  H   UNL     1       0.334  -0.307  -0.428  1.00  0.00           H  
HETATM   46  H   UNL     1       1.126  -0.517   1.341  1.00  0.00           H  
HETATM   47  H   UNL     1       2.139   1.425   2.446  1.00  0.00           H  
HETATM   48  H   UNL     1       1.327  -4.458  -0.183  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.038  -5.033   0.114  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.442  -4.963   1.402  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.454  -4.839  -0.057  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.753  -5.345  -0.195  1.00  0.00           H  
CONECT    1   30    3   32   32                                       
CONECT    2    7    5   33                                            
CONECT    3    5    5    1   34                                       
CONECT    4   11   11   12                                            
CONECT    5   15    2    3    3                                       
CONECT    6   14   14   11                                            
CONECT    7   10   11    2    9                                       
CONECT    8   18   17   35                                            
CONECT    9    7   36   37   38                                       
CONECT   10    7   39   40   41                                       
CONECT   11    6    7    4    4                                       
CONECT   12   13   13    4   42                                       
CONECT   13   14   12   12   43                                       
CONECT   14    6    6   13   44                                       
CONECT   15   16   26   26    5                                       
CONECT   16   17   17   15   45                                       
CONECT   17    8   24   16   16                                       
CONECT   18   22   22   19    8                                       
CONECT   19   20   20   18   46                                       
CONECT   20   29   19   19   47                                       
CONECT   21   28   29   29   22                                       
CONECT   22   21   23   18   18                                       
CONECT   23   22   27   27   27                                       
CONECT   24   17   25   25   48                                       
CONECT   25   24   24   26   49                                       
CONECT   26   25   15   15   30                                       
CONECT   27   23   23   23                                            
CONECT   28   21                                                      
CONECT   29   21   21   20                                            
CONECT   30   26   31    1                                            
CONECT   31   30   50   51   52                                       
CONECT   32    1    1                                                 
CONECT   33    2                                                      
CONECT   34    3                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37    9                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   10                                                      
CONECT   41   10                                                      
CONECT   42   12                                                      
CONECT   43   13                                                      
CONECT   44   14                                                      
CONECT   45   16                                                      
CONECT   46   19                                                      
CONECT   47   20                                                      
CONECT   48   24                                                      
CONECT   49   25                                                      
CONECT   50   31                                                      
CONECT   51   31                                                      
CONECT   52   31                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
