COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.420   0.297  -1.057  1.00  0.00           C  
HETATM    2  C   UNL     1       5.270  -0.361  -1.921  1.00  0.00           C  
HETATM    3  C   UNL     1       5.207  -1.738  -2.043  1.00  0.00           C  
HETATM    4  C   UNL     1       6.138  -2.451  -2.990  1.00  0.00           C  
HETATM    5  C   UNL     1       4.294  -2.464  -1.300  1.00  0.00           C  
HETATM    6  C   UNL     1       3.438  -1.818  -0.431  1.00  0.00           C  
HETATM    7  C   UNL     1       3.496  -0.429  -0.304  1.00  0.00           C  
HETATM    8  C   UNL     1       2.586   0.270   0.629  1.00  0.00           C  
HETATM    9  O   UNL     1       2.942   1.299   1.169  1.00  0.00           O  
HETATM   10  N   UNL     1       1.362  -0.235   0.880  1.00  0.00           N  
HETATM   11  C   UNL     1       1.007  -1.572   0.398  1.00  0.00           C  
HETATM   12  C   UNL     1       1.028  -2.558   1.568  1.00  0.00           C  
HETATM   13  C   UNL     1       0.658  -3.954   1.065  1.00  0.00           C  
HETATM   14  N   UNL     1       0.678  -4.901   2.188  1.00  0.00           N  
HETATM   15  C   UNL     1       0.385   0.555   1.635  1.00  0.00           C  
HETATM   16  C   UNL     1       0.211  -0.049   3.030  1.00  0.00           C  
HETATM   17  C   UNL     1       1.554  -0.035   3.763  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.809   0.775   3.819  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.937   0.541   0.913  1.00  0.00           C  
HETATM   20  O   UNL     1      -1.419  -0.629   0.483  1.00  0.00           O  
HETATM   21  C   UNL     1      -2.595  -0.730  -0.171  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.069  -1.962  -0.605  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.276  -2.034  -1.271  1.00  0.00           C  
HETATM   24 CL   UNL     1      -4.867  -3.574  -1.813  1.00  0.00          Cl  
HETATM   25  C   UNL     1      -5.022  -0.888  -1.513  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.571   0.333  -1.093  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.355   0.424  -0.419  1.00  0.00           C  
HETATM   28  C   UNL     1      -2.830   1.720   0.052  1.00  0.00           C  
HETATM   29  O   UNL     1      -3.443   2.759  -0.132  1.00  0.00           O  
HETATM   30  C   UNL     1      -1.584   1.707   0.734  1.00  0.00           C  
HETATM   31  C   UNL     1      -0.988   2.992   1.249  1.00  0.00           C  
HETATM   32  C   UNL     1      -0.285   3.705   0.124  1.00  0.00           C  
HETATM   33  C   UNL     1       1.008   3.353  -0.217  1.00  0.00           C  
HETATM   34  C   UNL     1       1.653   4.008  -1.249  1.00  0.00           C  
HETATM   35  C   UNL     1       1.007   5.016  -1.940  1.00  0.00           C  
HETATM   36  C   UNL     1      -0.286   5.368  -1.599  1.00  0.00           C  
HETATM   37  C   UNL     1      -0.934   4.709  -0.571  1.00  0.00           C  
HETATM   38  H   UNL     1       2.725  -2.385   0.148  1.00  0.00           H  
HETATM   39  H   UNL     1       4.249  -3.538  -1.400  1.00  0.00           H  
HETATM   40  H   UNL     1       7.054  -2.721  -2.464  1.00  0.00           H  
HETATM   41  H   UNL     1       5.655  -3.353  -3.365  1.00  0.00           H  
HETATM   42  H   UNL     1       6.379  -1.794  -3.826  1.00  0.00           H  
HETATM   43  H   UNL     1       5.986   0.199  -2.504  1.00  0.00           H  
HETATM   44  H   UNL     1       4.473   1.371  -0.959  1.00  0.00           H  
HETATM   45  H   UNL     1       0.009  -1.548  -0.039  1.00  0.00           H  
HETATM   46  H   UNL     1       1.727  -1.889  -0.357  1.00  0.00           H  
HETATM   47  H   UNL     1       0.740   1.582   1.725  1.00  0.00           H  
HETATM   48  H   UNL     1       2.026  -2.582   2.005  1.00  0.00           H  
HETATM   49  H   UNL     1       0.308  -2.241   2.323  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.340  -3.930   0.628  1.00  0.00           H  
HETATM   51  H   UNL     1       1.378  -4.271   0.310  1.00  0.00           H  
HETATM   52  H   UNL     1       0.066  -4.595   2.930  1.00  0.00           H  
HETATM   53  H   UNL     1       0.437  -5.831   1.882  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.143  -1.076   2.940  1.00  0.00           H  
HETATM   55  H   UNL     1       1.908   0.992   3.853  1.00  0.00           H  
HETATM   56  H   UNL     1       1.430  -0.465   4.757  1.00  0.00           H  
HETATM   57  H   UNL     1       2.280  -0.623   3.201  1.00  0.00           H  
HETATM   58  H   UNL     1      -1.765   0.766   3.296  1.00  0.00           H  
HETATM   59  H   UNL     1      -0.933   0.345   4.813  1.00  0.00           H  
HETATM   60  H   UNL     1      -0.454   1.802   3.909  1.00  0.00           H  
HETATM   61  H   UNL     1      -2.497  -2.859  -0.423  1.00  0.00           H  
HETATM   62  H   UNL     1      -5.964  -0.961  -2.035  1.00  0.00           H  
HETATM   63  H   UNL     1      -5.155   1.222  -1.284  1.00  0.00           H  
HETATM   64  H   UNL     1      -1.781   3.628   1.644  1.00  0.00           H  
HETATM   65  H   UNL     1      -0.274   2.769   2.041  1.00  0.00           H  
HETATM   66  H   UNL     1      -1.945   4.981  -0.307  1.00  0.00           H  
HETATM   67  H   UNL     1       1.513   2.566   0.323  1.00  0.00           H  
HETATM   68  H   UNL     1      -0.791   6.156  -2.138  1.00  0.00           H  
HETATM   69  H   UNL     1       1.511   5.528  -2.746  1.00  0.00           H  
HETATM   70  H   UNL     1       2.663   3.733  -1.515  1.00  0.00           H  
CONECT    1    2    7    7   44                                       
CONECT    2    3    3    1   43                                       
CONECT    3    5    4    2    2                                       
CONECT    4    3   40   41   42                                       
CONECT    5    6    6    3   39                                       
CONECT    6    5    5    7   38                                       
CONECT    7    6    1    1    8                                       
CONECT    8    7    9    9   10                                       
CONECT    9    8    8                                                 
CONECT   10    8   11   15                                            
CONECT   11   10   12   45   46                                       
CONECT   12   11   13   48   49                                       
CONECT   13   12   14   50   51                                       
CONECT   14   13   52   53                                            
CONECT   15   10   16   19   47                                       
CONECT   16   15   17   18   54                                       
CONECT   17   16   55   56   57                                       
CONECT   18   16   58   59   60                                       
CONECT   19   15   20   30   30                                       
CONECT   20   19   21                                                 
CONECT   21   20   22   27   27                                       
CONECT   22   21   23   23   61                                       
CONECT   23   22   22   24   25                                       
CONECT   24   23                                                      
CONECT   25   23   26   26   62                                       
CONECT   26   25   25   27   63                                       
CONECT   27   21   21   26   28                                       
CONECT   28   27   29   29   30                                       
CONECT   29   28   28                                                 
CONECT   30   19   19   28   31                                       
CONECT   31   30   32   64   65                                       
CONECT   32   31   37   37   33                                       
CONECT   33   32   34   34   67                                       
CONECT   34   35   33   33   70                                       
CONECT   35   36   36   34   69                                       
CONECT   36   37   35   35   68                                       
CONECT   37   32   32   36   66                                       
CONECT   38    6                                                      
CONECT   39    5                                                      
CONECT   40    4                                                      
CONECT   41    4                                                      
CONECT   42    4                                                      
CONECT   43    2                                                      
CONECT   44    1                                                      
CONECT   45   11                                                      
CONECT   46   11                                                      
CONECT   47   15                                                      
CONECT   48   12                                                      
CONECT   49   12                                                      
CONECT   50   13                                                      
CONECT   51   13                                                      
CONECT   52   14                                                      
CONECT   53   14                                                      
CONECT   54   16                                                      
CONECT   55   17                                                      
CONECT   56   17                                                      
CONECT   57   17                                                      
CONECT   58   18                                                      
CONECT   59   18                                                      
CONECT   60   18                                                      
CONECT   61   22                                                      
CONECT   62   25                                                      
CONECT   63   26                                                      
CONECT   64   31                                                      
CONECT   65   31                                                      
CONECT   66   37                                                      
CONECT   67   33                                                      
CONECT   68   36                                                      
CONECT   69   35                                                      
CONECT   70   34                                                      
MASTER        0    0    0    0    0    0    0    0   70    0   70    0
END
