COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.582   2.526   1.053  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.646   3.708   0.336  1.00  0.00           C  
HETATM    3  C   UNL     1       3.956   4.895   1.258  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.521   1.537   0.848  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.650   3.908  -0.591  1.00  0.00           C  
HETATM    6  C   UNL     1       3.292   3.709   1.462  1.00  0.00           C  
HETATM    7  C   UNL     1       1.861  -1.064   0.068  1.00  0.00           C  
HETATM    8  C   UNL     1       3.419  -3.218  -0.725  1.00  0.00           C  
HETATM    9  C   UNL     1       4.924   4.852   0.335  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.542   1.729  -0.081  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.639  -0.648   0.358  1.00  0.00           C  
HETATM   12  C   UNL     1       1.301  -2.330  -0.020  1.00  0.00           C  
HETATM   13  C   UNL     1       3.201  -0.877  -0.242  1.00  0.00           C  
HETATM   14  C   UNL     1       3.978  -1.958  -0.638  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.601   2.923  -0.808  1.00  0.00           C  
HETATM   16  C   UNL     1       2.086  -3.409  -0.412  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.554   0.670  -0.306  1.00  0.00           C  
HETATM   18  C   UNL     1       3.749   2.691   0.673  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.748  -1.211  -0.221  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.749  -1.218   1.384  1.00  0.00           C  
HETATM   21  C   UNL     1       3.233   1.319   0.672  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.335  -2.130   1.673  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.910  -1.801  -0.660  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.774  -2.522   2.025  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.373  -2.179  -0.404  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.325  -2.572   0.072  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.589   4.364  -2.420  1.00  0.00           C  
HETATM   28  N   UNL     1      -5.566   0.699  -1.137  1.00  0.00           N  
HETATM   29  N   UNL     1      -0.049  -2.522   0.287  1.00  0.00           N  
HETATM   30  N   UNL     1      -2.675  -1.944   1.016  1.00  0.00           N  
HETATM   31  N   UNL     1       3.768   0.399  -0.155  1.00  0.00           N  
HETATM   32  N   UNL     1       5.407  -1.758  -0.968  1.00  0.00           N1+
HETATM   33  O   UNL     1       5.925  -0.669  -0.800  1.00  0.00           O  
HETATM   34  O   UNL     1      -3.984  -1.033   2.563  1.00  0.00           O  
HETATM   35  O   UNL     1       2.322   1.011   1.418  1.00  0.00           O  
HETATM   36  O   UNL     1       6.065  -2.684  -1.409  1.00  0.00           O1-
HETATM   37  O   UNL     1      -6.216  -0.317  -1.095  1.00  0.00           O  
HETATM   38  O   UNL     1      -4.589   3.118  -1.719  1.00  0.00           O  
HETATM   39  S   UNL     1       5.055   3.290  -0.340  1.00  0.00           S  
HETATM   40 CL   UNL     1       1.388  -4.995  -0.523  1.00  0.00          Cl  
HETATM   41  H   UNL     1      -0.791   2.375   1.773  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.907   4.478   0.502  1.00  0.00           H  
HETATM   43  H   UNL     1       3.712   5.797   1.800  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.466   0.614   1.406  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.695   4.833  -1.147  1.00  0.00           H  
HETATM   46  H   UNL     1       2.489   3.593   2.175  1.00  0.00           H  
HETATM   47  H   UNL     1       1.253  -0.224   0.372  1.00  0.00           H  
HETATM   48  H   UNL     1       4.027  -4.058  -1.029  1.00  0.00           H  
HETATM   49  H   UNL     1       5.540   5.694   0.054  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.215  -1.052   1.778  1.00  0.00           H  
HETATM   51  H   UNL     1       0.356  -2.640   2.345  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.637  -2.072  -1.679  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.783  -0.727  -0.522  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.869  -3.608   2.021  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.029  -2.133   3.010  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.024  -1.563  -1.023  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.526  -3.231  -0.644  1.00  0.00           H  
HETATM   58  H   UNL     1      -7.055  -2.491   0.877  1.00  0.00           H  
HETATM   59  H   UNL     1      -6.811  -2.960  -0.823  1.00  0.00           H  
HETATM   60  H   UNL     1      -5.525  -3.248   0.373  1.00  0.00           H  
HETATM   61  H   UNL     1      -4.683   5.182  -1.706  1.00  0.00           H  
HETATM   62  H   UNL     1      -3.655   4.469  -2.973  1.00  0.00           H  
HETATM   63  H   UNL     1      -5.428   4.390  -3.115  1.00  0.00           H  
HETATM   64  H   UNL     1       4.546   0.621  -0.690  1.00  0.00           H  
CONECT    1    2    4    4   41                                       
CONECT    2    5    5    1   42                                       
CONECT    3    6    9    9   43                                       
CONECT    4    1    1   10   44                                       
CONECT    5    2    2   15   45                                       
CONECT    6    3   18   18   46                                       
CONECT    7   13   12   12   47                                       
CONECT    8   14   16   16   48                                       
CONECT    9    3    3   39   49                                       
CONECT   10   15   15    4   17                                       
CONECT   11   20   17   19   19                                       
CONECT   12    7    7   16   29                                       
CONECT   13   31   14   14    7                                       
CONECT   14   32   13   13    8                                       
CONECT   15    5   38   10   10                                       
CONECT   16    8    8   12   40                                       
CONECT   17   11   10   28   28                                       
CONECT   18    6    6   39   21                                       
CONECT   19   11   11   26   37                                       
CONECT   20   30   34   34   11                                       
CONECT   21   18   31   35   35                                       
CONECT   22   29   24   50   51                                       
CONECT   23   29   25   52   53                                       
CONECT   24   22   30   54   55                                       
CONECT   25   23   30   56   57                                       
CONECT   26   19   58   59   60                                       
CONECT   27   38   61   62   63                                       
CONECT   28   17   17   37                                            
CONECT   29   12   22   23                                            
CONECT   30   24   25   20                                            
CONECT   31   21   13   64                                            
CONECT   32   33   33   36   14                                       
CONECT   33   32   32                                                 
CONECT   34   20   20                                                 
CONECT   35   21   21                                                 
CONECT   36   32                                                      
CONECT   37   19   28                                                 
CONECT   38   27   15                                                 
CONECT   39    9   18                                                 
CONECT   40   16                                                      
CONECT   41    1                                                      
CONECT   42    2                                                      
CONECT   43    3                                                      
CONECT   44    4                                                      
CONECT   45    5                                                      
CONECT   46    6                                                      
CONECT   47    7                                                      
CONECT   48    8                                                      
CONECT   49    9                                                      
CONECT   50   22                                                      
CONECT   51   22                                                      
CONECT   52   23                                                      
CONECT   53   23                                                      
CONECT   54   24                                                      
CONECT   55   24                                                      
CONECT   56   25                                                      
CONECT   57   25                                                      
CONECT   58   26                                                      
CONECT   59   26                                                      
CONECT   60   26                                                      
CONECT   61   27                                                      
CONECT   62   27                                                      
CONECT   63   27                                                      
CONECT   64   31                                                      
MASTER        0    0    0    0    0    0    0    0   64    0   64    0
END
