COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.426   0.441  -1.054  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.195   0.368   1.231  1.00  0.00           C  
HETATM    3  C   UNL     1       2.276  -0.124  -1.118  1.00  0.00           C  
HETATM    4  C   UNL     1       6.426  -2.205  -0.172  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.605  -0.145  -1.467  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.377  -0.206   0.813  1.00  0.00           C  
HETATM    7  C   UNL     1       5.998  -3.518  -0.236  1.00  0.00           C  
HETATM    8  C   UNL     1       1.360   0.907  -1.003  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.598   1.649   2.072  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.908   1.706  -0.055  1.00  0.00           C  
HETATM   11  C   UNL     1       3.045   0.433   1.091  1.00  0.00           C  
HETATM   12  C   UNL     1       7.211   0.603  -0.020  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.215   0.701   0.299  1.00  0.00           C  
HETATM   14  C   UNL     1       3.138  -0.369  -0.045  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.947   1.331   0.746  1.00  0.00           C  
HETATM   16  C   UNL     1       4.134  -1.466  -0.114  1.00  0.00           C  
HETATM   17  C   UNL     1       5.502  -1.174  -0.107  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.583  -0.470  -0.536  1.00  0.00           C  
HETATM   19  C   UNL     1       3.711  -2.793  -0.185  1.00  0.00           C  
HETATM   20  C   UNL     1       4.645  -3.812  -0.243  1.00  0.00           C  
HETATM   21  C   UNL     1       1.327   1.656   0.160  1.00  0.00           C  
HETATM   22  C   UNL     1      -8.383  -1.986  -0.181  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.156   5.436  -2.180  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.158   6.058  -1.200  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.759   4.681  -0.910  1.00  0.00           C  
HETATM   26  C   UNL     1     -10.080  -3.605   0.262  1.00  0.00           C  
HETATM   27  C   UNL     1       0.154   3.464  -1.067  1.00  0.00           C  
HETATM   28  C   UNL     1       0.331   2.780   0.290  1.00  0.00           C  
HETATM   29  N   UNL     1      -1.410   2.192   2.061  1.00  0.00           N  
HETATM   30  N   UNL     1       7.165   1.907   0.053  1.00  0.00           N  
HETATM   31  N   UNL     1       5.947   2.316   0.085  1.00  0.00           N  
HETATM   32  N   UNL     1       5.139   1.312   0.035  1.00  0.00           N  
HETATM   33  N   UNL     1      -0.956   2.243   0.737  1.00  0.00           N  
HETATM   34  N   UNL     1       5.936   0.156  -0.036  1.00  0.00           N  
HETATM   35  N   UNL     1       2.153   1.401   1.157  1.00  0.00           N1+
HETATM   36  N   UNL     1      -7.779  -1.064  -0.957  1.00  0.00           N  
HETATM   37  O   UNL     1       2.083   2.193   2.329  1.00  0.00           O1-
HETATM   38  O   UNL     1      -7.936  -2.241   0.919  1.00  0.00           O  
HETATM   39  O   UNL     1      -9.481  -2.625  -0.627  1.00  0.00           O  
HETATM   40  F   UNL     1       2.391  -3.083  -0.191  1.00  0.00           F  
HETATM   41 CL   UNL     1       4.120  -5.464  -0.332  1.00  0.00          Cl  
HETATM   42  H   UNL     1      -3.666   0.694  -1.778  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.035   0.573   2.280  1.00  0.00           H  
HETATM   44  H   UNL     1       2.320  -0.728  -2.013  1.00  0.00           H  
HETATM   45  H   UNL     1       7.483  -1.983  -0.167  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.767  -0.350  -2.514  1.00  0.00           H  
HETATM   47  H   UNL     1      -7.143  -0.451   1.534  1.00  0.00           H  
HETATM   48  H   UNL     1       6.722  -4.318  -0.282  1.00  0.00           H  
HETATM   49  H   UNL     1       0.679   1.125  -1.812  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.208   1.477   2.947  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.858   1.599  -1.128  1.00  0.00           H  
HETATM   52  H   UNL     1       3.704   0.254   1.927  1.00  0.00           H  
HETATM   53  H   UNL     1       8.103  -0.005  -0.064  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.157   5.865  -2.219  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.765   5.066  -3.128  1.00  0.00           H  
HETATM   56  H   UNL     1       0.888   6.097  -1.503  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.503   6.896  -0.595  1.00  0.00           H  
HETATM   58  H   UNL     1      -1.500   4.613  -0.113  1.00  0.00           H  
HETATM   59  H   UNL     1     -10.955  -4.044  -0.217  1.00  0.00           H  
HETATM   60  H   UNL     1      -9.354  -4.389   0.480  1.00  0.00           H  
HETATM   61  H   UNL     1     -10.379  -3.119   1.191  1.00  0.00           H  
HETATM   62  H   UNL     1      -0.293   2.763  -1.772  1.00  0.00           H  
HETATM   63  H   UNL     1       1.126   3.786  -1.441  1.00  0.00           H  
HETATM   64  H   UNL     1       0.695   3.505   1.018  1.00  0.00           H  
HETATM   65  H   UNL     1      -8.172  -0.812  -1.807  1.00  0.00           H  
CONECT    1   13    5    5   42                                       
CONECT    2   13   13    6   43                                       
CONECT    3    8    8   14   44                                       
CONECT    4   17   17    7   45                                       
CONECT    5    1    1   18   46                                       
CONECT    6    2   18   18   47                                       
CONECT    7   20   20    4   48                                       
CONECT    8    3    3   21   49                                       
CONECT    9   29   29   15   50                                       
CONECT   10   33   15   15   51                                       
CONECT   11   14   14   35   52                                       
CONECT   12   30   30   34   53                                       
CONECT   13   15    2    2    1                                       
CONECT   14    3   16   11   11                                       
CONECT   15    9   10   10   13                                       
CONECT   16   14   19   19   17                                       
CONECT   17   16   34    4    4                                       
CONECT   18    6    6    5   36                                       
CONECT   19   40   16   16   20                                       
CONECT   20   19   41    7    7                                       
CONECT   21    8   28   35   35                                       
CONECT   22   36   39   38   38                                       
CONECT   23   25   24   54   55                                       
CONECT   24   23   25   56   57                                       
CONECT   25   23   27   24   58                                       
CONECT   26   39   59   60   61                                       
CONECT   27   25   28   62   63                                       
CONECT   28   27   21   33   64                                       
CONECT   29   33    9    9                                            
CONECT   30   12   12   31                                            
CONECT   31   30   32   32                                            
CONECT   32   34   31   31                                            
CONECT   33   28   29   10                                            
CONECT   34   12   17   32                                            
CONECT   35   21   21   11   37                                       
CONECT   36   18   22   65                                            
CONECT   37   35                                                      
CONECT   38   22   22                                                 
CONECT   39   22   26                                                 
CONECT   40   19                                                      
CONECT   41   20                                                      
CONECT   42    1                                                      
CONECT   43    2                                                      
CONECT   44    3                                                      
CONECT   45    4                                                      
CONECT   46    5                                                      
CONECT   47    6                                                      
CONECT   48    7                                                      
CONECT   49    8                                                      
CONECT   50    9                                                      
CONECT   51   10                                                      
CONECT   52   11                                                      
CONECT   53   12                                                      
CONECT   54   23                                                      
CONECT   55   23                                                      
CONECT   56   24                                                      
CONECT   57   24                                                      
CONECT   58   25                                                      
CONECT   59   26                                                      
CONECT   60   26                                                      
CONECT   61   26                                                      
CONECT   62   27                                                      
CONECT   63   27                                                      
CONECT   64   28                                                      
CONECT   65   36                                                      
MASTER        0    0    0    0    0    0    0    0   65    0   65    0
END
