COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -0.746   0.052  -1.301  1.00  0.00           N  
HETATM    2  N   UNL     1      -4.762   1.011   0.041  1.00  0.00           N  
HETATM    3  C   UNL     1       6.248   1.295   1.190  1.00  0.00           C  
HETATM    4  C   UNL     1       0.554  -1.922  -0.342  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.915   0.601  -1.137  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.619  -0.128  -0.151  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.776  -1.171   0.273  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.266  -0.928   1.398  1.00  0.00           C  
HETATM    9  C   UNL     1      -7.028   1.811  -0.294  1.00  0.00           C  
HETATM   10  C   UNL     1      -7.400   3.337  -2.101  1.00  0.00           C  
HETATM   11  C   UNL     1      -9.254   2.204  -1.096  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.897  -0.004   0.428  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.378  -1.927   1.759  1.00  0.00           C  
HETATM   14 CL   UNL     1      -3.845  -3.078   2.972  1.00  0.00          Cl  
HETATM   15  N   UNL     1      -2.186  -2.024   1.205  1.00  0.00           N  
HETATM   16  N   UNL     1      -0.618  -1.050  -0.447  1.00  0.00           N  
HETATM   17  C   UNL     1       0.673  -2.817  -1.596  1.00  0.00           C  
HETATM   18  O   UNL     1       0.134  -4.115  -1.338  1.00  0.00           O  
HETATM   19  O   UNL     1       1.766  -1.137  -0.332  1.00  0.00           O  
HETATM   20  C   UNL     1       2.814  -2.051  -0.723  1.00  0.00           C  
HETATM   21  C   UNL     1       2.194  -2.903  -1.852  1.00  0.00           C  
HETATM   22  O   UNL     1       2.642  -4.257  -1.760  1.00  0.00           O  
HETATM   23  C   UNL     1       4.028  -1.278  -1.244  1.00  0.00           C  
HETATM   24  O   UNL     1       4.611  -0.530  -0.175  1.00  0.00           O  
HETATM   25  P   UNL     1       5.910   0.403  -0.363  1.00  0.00           P  
HETATM   26  O   UNL     1       5.663   1.378  -1.449  1.00  0.00           O  
HETATM   27  O   UNL     1       7.178  -0.514  -0.743  1.00  0.00           O  
HETATM   28  P   UNL     1       7.719   2.351   0.976  1.00  0.00           P  
HETATM   29  O   UNL     1       7.472   3.326  -0.110  1.00  0.00           O  
HETATM   30  O   UNL     1       8.017   3.139   2.348  1.00  0.00           O  
HETATM   31  O   UNL     1       8.987   1.434   0.596  1.00  0.00           O  
HETATM   32  F   UNL     1      -8.872   0.696   0.692  1.00  0.00           F  
HETATM   33  C   UNL     1      -8.389   1.563  -0.225  1.00  0.00           C  
HETATM   34  C   UNL     1      -8.758   3.091  -2.033  1.00  0.00           C  
HETATM   35  C   UNL     1      -6.535   2.698  -1.232  1.00  0.00           C  
HETATM   36  C   UNL     1      -6.087   1.119   0.658  1.00  0.00           C  
HETATM   37  C   UNL     1      -5.982   1.930   1.951  1.00  0.00           C  
HETATM   38  H   UNL     1      -4.489   1.648  -0.638  1.00  0.00           H  
HETATM   39  H   UNL     1       5.389   1.916   1.447  1.00  0.00           H  
HETATM   40  H   UNL     1       6.430   0.577   1.989  1.00  0.00           H  
HETATM   41  H   UNL     1       0.491  -2.534   0.558  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.285   1.468  -1.664  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.238  -0.867   1.865  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.014   4.030  -2.834  1.00  0.00           H  
HETATM   45  H   UNL     1     -10.315   2.011  -1.042  1.00  0.00           H  
HETATM   46  H   UNL     1       0.169  -2.355  -2.444  1.00  0.00           H  
HETATM   47  H   UNL     1       0.184  -4.718  -2.092  1.00  0.00           H  
HETATM   48  H   UNL     1       3.100  -2.682   0.118  1.00  0.00           H  
HETATM   49  H   UNL     1       2.442  -2.484  -2.827  1.00  0.00           H  
HETATM   50  H   UNL     1       2.237  -4.850  -2.409  1.00  0.00           H  
HETATM   51  H   UNL     1       4.762  -1.979  -1.640  1.00  0.00           H  
HETATM   52  H   UNL     1       3.713  -0.596  -2.034  1.00  0.00           H  
HETATM   53  H   UNL     1       7.398  -1.177  -0.075  1.00  0.00           H  
HETATM   54  H   UNL     1       8.788   3.721   2.307  1.00  0.00           H  
HETATM   55  H   UNL     1       9.207   0.771   1.265  1.00  0.00           H  
HETATM   56  H   UNL     1      -9.432   3.591  -2.712  1.00  0.00           H  
HETATM   57  H   UNL     1      -5.474   2.892  -1.286  1.00  0.00           H  
HETATM   58  H   UNL     1      -6.465   0.123   0.883  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.301   1.429   2.639  1.00  0.00           H  
HETATM   60  H   UNL     1      -5.603   2.927   1.726  1.00  0.00           H  
HETATM   61  H   UNL     1      -6.968   2.011   2.410  1.00  0.00           H  
CONECT    1   16    5    5                                            
CONECT    2   12   36   38                                            
CONECT    3   25   28   39   40                                       
CONECT    4   17   16   19   41                                       
CONECT    5    6    1    1   42                                       
CONECT    6    7   12   12    5                                       
CONECT    7   15   15    6   16                                       
CONECT    8   13   13   12   43                                       
CONECT    9   36   35   35   33                                       
CONECT   10   35   34   34   44                                       
CONECT   11   33   33   34   45                                       
CONECT   12    8    6    6    2                                       
CONECT   13   14    8    8   15                                       
CONECT   14   13                                                      
CONECT   15   13    7    7                                            
CONECT   16    7    4    1                                            
CONECT   17   18    4   21   46                                       
CONECT   18   17   47                                                 
CONECT   19    4   20                                                 
CONECT   20   21   19   23   48                                       
CONECT   21   17   22   20   49                                       
CONECT   22   21   50                                                 
CONECT   23   20   24   51   52                                       
CONECT   24   23   25                                                 
CONECT   25   24   26   26   27                                       
CONECT   25    3                                                      
CONECT   26   25   25                                                 
CONECT   27   25   53                                                 
CONECT   28   29   29    3   31                                       
CONECT   28   30                                                      
CONECT   29   28   28                                                 
CONECT   30   28   54                                                 
CONECT   31   28   55                                                 
CONECT   32   33                                                      
CONECT   33    9   32   11   11                                       
CONECT   34   10   10   11   56                                       
CONECT   35    9    9   10   57                                       
CONECT   36   37    2    9   58                                       
CONECT   37   36   59   60   61                                       
CONECT   38    2                                                      
CONECT   39    3                                                      
CONECT   40    3                                                      
CONECT   41    4                                                      
CONECT   42    5                                                      
CONECT   43    8                                                      
CONECT   44   10                                                      
CONECT   45   11                                                      
CONECT   46   17                                                      
CONECT   47   18                                                      
CONECT   48   20                                                      
CONECT   49   21                                                      
CONECT   50   22                                                      
CONECT   51   23                                                      
CONECT   52   23                                                      
CONECT   53   27                                                      
CONECT   54   30                                                      
CONECT   55   31                                                      
CONECT   56   34                                                      
CONECT   57   35                                                      
CONECT   58   36                                                      
CONECT   59   37                                                      
CONECT   60   37                                                      
CONECT   61   37                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
