COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -0.099   0.614   0.119  1.00  0.00           N  
HETATM    2  C   UNL     1      -2.070  -2.458  -0.323  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.046  -2.858  -1.806  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.792  -2.539   0.316  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.064   3.543  -0.032  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.981   1.746   1.127  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.183   3.393  -1.093  1.00  0.00           C  
HETATM    8 CL   UNL     1      -3.811  -2.087   2.106  1.00  0.00          Cl  
HETATM    9  C   UNL     1      -4.427  -2.430   0.520  1.00  0.00           C  
HETATM   10  C   UNL     1      -6.281  -2.813  -0.947  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.409  -2.972  -2.008  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.555  -2.583  -0.543  1.00  0.00           C  
HETATM   13  N   UNL     1      -1.718  -1.045  -0.160  1.00  0.00           N  
HETATM   14  C   UNL     1      -0.435  -0.690   0.049  1.00  0.00           C  
HETATM   15  O   UNL     1       0.420  -1.545   0.176  1.00  0.00           O  
HETATM   16  C   UNL     1      -1.096   1.598   0.068  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.963   2.716   1.077  1.00  0.00           C  
HETATM   18  O   UNL     1      -4.030   4.499  -0.081  1.00  0.00           O  
HETATM   19  C   UNL     1      -3.878   5.177  -1.329  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.198   2.427  -1.041  1.00  0.00           C  
HETATM   21  C   UNL     1       1.237   0.982   0.241  1.00  0.00           C  
HETATM   22  C   UNL     1       1.584   2.304   0.522  1.00  0.00           C  
HETATM   23  C   UNL     1       2.923   2.625   0.634  1.00  0.00           C  
HETATM   24  N   UNL     1       3.832   1.675   0.474  1.00  0.00           N  
HETATM   25  C   UNL     1       3.474   0.428   0.208  1.00  0.00           C  
HETATM   26  N   UNL     1       2.201   0.079   0.098  1.00  0.00           N  
HETATM   27  N   UNL     1       4.454  -0.536   0.048  1.00  0.00           N  
HETATM   28  C   UNL     1       5.868  -0.171   0.172  1.00  0.00           C  
HETATM   29  C   UNL     1       6.276  -0.211   1.646  1.00  0.00           C  
HETATM   30  C   UNL     1       6.722  -1.163  -0.620  1.00  0.00           C  
HETATM   31  C   UNL     1       6.313  -1.123  -2.094  1.00  0.00           C  
HETATM   32  O   UNL     1       6.523  -2.481  -0.106  1.00  0.00           O  
HETATM   33  C   UNL     1       8.198  -0.782  -0.490  1.00  0.00           C  
HETATM   34  H   UNL     1      -1.539  -2.868  -1.182  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.787  -3.008   0.575  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.365  -2.982  -2.635  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.473  -2.414   1.144  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.902   1.102   1.991  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.263   4.037  -1.956  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.346  -2.902  -1.106  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.792  -3.186  -2.995  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.408  -0.365  -0.204  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.652   2.830   1.901  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.996   4.464  -2.146  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.635   5.956  -1.414  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.887   5.626  -1.380  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.510   2.313  -1.865  1.00  0.00           H  
HETATM   48  H   UNL     1       0.822   3.060   0.648  1.00  0.00           H  
HETATM   49  H   UNL     1       3.225   3.639   0.850  1.00  0.00           H  
HETATM   50  H   UNL     1       4.205  -1.453  -0.147  1.00  0.00           H  
HETATM   51  H   UNL     1       6.019   0.834  -0.220  1.00  0.00           H  
HETATM   52  H   UNL     1       6.125  -1.216   2.039  1.00  0.00           H  
HETATM   53  H   UNL     1       7.328   0.061   1.739  1.00  0.00           H  
HETATM   54  H   UNL     1       5.668   0.496   2.211  1.00  0.00           H  
HETATM   55  H   UNL     1       6.465  -0.118  -2.487  1.00  0.00           H  
HETATM   56  H   UNL     1       6.921  -1.830  -2.659  1.00  0.00           H  
HETATM   57  H   UNL     1       5.261  -1.395  -2.187  1.00  0.00           H  
HETATM   58  H   UNL     1       7.078  -3.073  -0.632  1.00  0.00           H  
HETATM   59  H   UNL     1       8.489  -0.810   0.560  1.00  0.00           H  
HETATM   60  H   UNL     1       8.806  -1.488  -1.055  1.00  0.00           H  
HETATM   61  H   UNL     1       8.350   0.224  -0.883  1.00  0.00           H  
CONECT    1   14   16   21                                            
CONECT    2   12   13   34   35                                       
CONECT    3   11   11   12   36                                       
CONECT    4    9   10   10   37                                       
CONECT    5    7    7   17   18                                       
CONECT    6   16   17   17   38                                       
CONECT    7    5    5   20   39                                       
CONECT    8    9                                                      
CONECT    9    4    8   12   12                                       
CONECT   10    4    4   11   40                                       
CONECT   11    3    3   10   41                                       
CONECT   12    2    3    9    9                                       
CONECT   13    2   14   42                                            
CONECT   14    1   13   15   15                                       
CONECT   15   14   14                                                 
CONECT   16    1    6   20   20                                       
CONECT   17    5    6    6   43                                       
CONECT   18    5   19                                                 
CONECT   19   18   44   45   46                                       
CONECT   20    7   16   16   47                                       
CONECT   21    1   22   26   26                                       
CONECT   22   21   23   23   48                                       
CONECT   23   22   22   24   49                                       
CONECT   24   23   25   25                                            
CONECT   25   24   24   26   27                                       
CONECT   26   21   21   25                                            
CONECT   27   25   28   50                                            
CONECT   28   27   29   30   51                                       
CONECT   29   28   52   53   54                                       
CONECT   30   28   31   32   33                                       
CONECT   31   30   55   56   57                                       
CONECT   32   30   58                                                 
CONECT   33   30   59   60   61                                       
CONECT   34    2                                                      
CONECT   35    2                                                      
CONECT   36    3                                                      
CONECT   37    4                                                      
CONECT   38    6                                                      
CONECT   39    7                                                      
CONECT   40   10                                                      
CONECT   41   11                                                      
CONECT   42   13                                                      
CONECT   43   17                                                      
CONECT   44   19                                                      
CONECT   45   19                                                      
CONECT   46   19                                                      
CONECT   47   20                                                      
CONECT   48   22                                                      
CONECT   49   23                                                      
CONECT   50   27                                                      
CONECT   51   28                                                      
CONECT   52   29                                                      
CONECT   53   29                                                      
CONECT   54   29                                                      
CONECT   55   31                                                      
CONECT   56   31                                                      
CONECT   57   31                                                      
CONECT   58   32                                                      
CONECT   59   33                                                      
CONECT   60   33                                                      
CONECT   61   33                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
