COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.997   0.023   0.093  1.00  0.00           C  
HETATM    2  C   UNL     1      -7.064  -1.324   0.407  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.266  -2.608  -0.357  1.00  0.00           C  
HETATM    4  C   UNL     1      -8.415  -0.639   0.618  1.00  0.00           C  
HETATM    5  C   UNL     1      -8.228   0.598   1.499  1.00  0.00           C  
HETATM    6  C   UNL     1      -9.559   1.273   1.707  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.444   0.024  -1.589  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.320   0.882  -2.019  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.401   0.877  -0.948  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.216   1.603  -1.052  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.061   2.371  -0.120  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.241   2.207   1.161  1.00  0.00           C  
HETATM   13  C   UNL     1       0.941   0.581   2.466  1.00  0.00           C  
HETATM   14  C   UNL     1       1.318  -0.902   2.506  1.00  0.00           C  
HETATM   15  C   UNL     1       2.591  -2.571   1.350  1.00  0.00           C  
HETATM   16  C   UNL     1       3.504  -2.779   0.140  1.00  0.00           C  
HETATM   17  C   UNL     1       5.696  -2.040  -0.627  1.00  0.00           C  
HETATM   18  C   UNL     1       6.940  -1.263  -0.445  1.00  0.00           C  
HETATM   19  C   UNL     1       7.935  -1.292  -1.423  1.00  0.00           C  
HETATM   20  C   UNL     1       9.093  -0.565  -1.247  1.00  0.00           C  
HETATM   21  C   UNL     1       9.271   0.193  -0.104  1.00  0.00           C  
HETATM   22  C   UNL     1       8.289   0.227   0.871  1.00  0.00           C  
HETATM   23  C   UNL     1       7.123  -0.491   0.704  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.953   2.327  -2.217  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.856   2.326  -3.257  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.040   1.606  -3.164  1.00  0.00           C  
HETATM   27  N   UNL     1      -6.180  -0.438  -0.353  1.00  0.00           N  
HETATM   28  N   UNL     1      -8.048  -3.580   0.153  1.00  0.00           N  
HETATM   29  N   UNL     1      -2.305   1.606  -0.006  1.00  0.00           N  
HETATM   30  N   UNL     1       4.737  -2.009   0.320  1.00  0.00           N  
HETATM   31  N   UNL     1      10.498   2.617  -0.544  1.00  0.00           N  
HETATM   32  O   UNL     1      -4.501  -0.228   1.173  1.00  0.00           O  
HETATM   33  O   UNL     1      -6.724  -2.766  -1.431  1.00  0.00           O  
HETATM   34  O   UNL     1      -9.637   2.386   2.453  1.00  0.00           O  
HETATM   35  O   UNL     1     -10.555   0.813   1.202  1.00  0.00           O  
HETATM   36  O   UNL     1       0.165   0.844   1.295  1.00  0.00           O  
HETATM   37  O   UNL     1       2.178  -1.204   1.406  1.00  0.00           O  
HETATM   38  O   UNL     1      10.903   1.315   1.513  1.00  0.00           O  
HETATM   39  O   UNL     1      11.741   0.491  -0.693  1.00  0.00           O  
HETATM   40  O   UNL     1       5.537  -2.707  -1.630  1.00  0.00           O  
HETATM   41  O   UNL     1      -7.438  -0.225  -2.242  1.00  0.00           O  
HETATM   42  S   UNL     1      10.754   1.119   0.114  1.00  0.00           S  
HETATM   43  H   UNL     1      -6.613  -1.545   1.375  1.00  0.00           H  
HETATM   44  H   UNL     1      -8.825  -0.339  -0.346  1.00  0.00           H  
HETATM   45  H   UNL     1      -9.102  -1.331   1.105  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.818   0.298   2.464  1.00  0.00           H  
HETATM   47  H   UNL     1      -7.541   1.290   1.012  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.295   3.425  -0.269  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.485   2.004  -0.970  1.00  0.00           H  
HETATM   50  H   UNL     1       0.641   2.845   1.112  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.848   2.492   2.020  1.00  0.00           H  
HETATM   52  H   UNL     1       0.358   0.831   3.352  1.00  0.00           H  
HETATM   53  H   UNL     1       1.848   1.185   2.444  1.00  0.00           H  
HETATM   54  H   UNL     1       1.833  -1.121   3.441  1.00  0.00           H  
HETATM   55  H   UNL     1       0.414  -1.508   2.438  1.00  0.00           H  
HETATM   56  H   UNL     1       1.714  -3.212   1.258  1.00  0.00           H  
HETATM   57  H   UNL     1       3.133  -2.825   2.261  1.00  0.00           H  
HETATM   58  H   UNL     1       3.747  -3.838   0.046  1.00  0.00           H  
HETATM   59  H   UNL     1       2.994  -2.442  -0.762  1.00  0.00           H  
HETATM   60  H   UNL     1       7.798  -1.884  -2.317  1.00  0.00           H  
HETATM   61  H   UNL     1       9.864  -0.587  -2.004  1.00  0.00           H  
HETATM   62  H   UNL     1       8.434   0.820   1.762  1.00  0.00           H  
HETATM   63  H   UNL     1       6.355  -0.460   1.463  1.00  0.00           H  
HETATM   64  H   UNL     1      -2.036   2.892  -2.302  1.00  0.00           H  
HETATM   65  H   UNL     1      -3.642   2.891  -4.152  1.00  0.00           H  
HETATM   66  H   UNL     1      -5.742   1.611  -3.986  1.00  0.00           H  
HETATM   67  H   UNL     1      -8.481  -3.453   1.012  1.00  0.00           H  
HETATM   68  H   UNL     1      -8.178  -4.406  -0.339  1.00  0.00           H  
HETATM   69  H   UNL     1      -2.491   1.102   0.802  1.00  0.00           H  
HETATM   70  H   UNL     1       4.864  -1.477   1.121  1.00  0.00           H  
HETATM   71  H   UNL     1       9.642   2.829  -0.948  1.00  0.00           H  
HETATM   72  H   UNL     1      11.203   3.283  -0.524  1.00  0.00           H  
HETATM   73  H   UNL     1     -10.513   2.784   2.558  1.00  0.00           H  
CONECT    1   27   32   32    9                                       
CONECT    2    3   27    4   43                                       
CONECT    3   33   33   28    2                                       
CONECT    4    2    5   44   45                                       
CONECT    5    4    6   46   47                                       
CONECT    6   35   35    5   34                                       
CONECT    7   41   41   27    8                                       
CONECT    8    7   26   26    9                                       
CONECT    9    1    8   10   10                                       
CONECT   10    9    9   24   29                                       
CONECT   11   12   29   48   49                                       
CONECT   12   11   36   50   51                                       
CONECT   13   36   14   52   53                                       
CONECT   14   37   13   54   55                                       
CONECT   15   16   37   56   57                                       
CONECT   16   30   15   58   59                                       
CONECT   17   30   40   40   18                                       
CONECT   18   17   19   19   23                                       
CONECT   19   18   18   20   60                                       
CONECT   20   19   21   21   61                                       
CONECT   21   20   20   22   42                                       
CONECT   22   23   23   21   62                                       
CONECT   23   18   22   22   63                                       
CONECT   24   25   25   10   64                                       
CONECT   25   26   24   24   65                                       
CONECT   26    8    8   25   66                                       
CONECT   27    2    7    1                                            
CONECT   28    3   67   68                                            
CONECT   29   11   10   69                                            
CONECT   30   16   17   70                                            
CONECT   31   42   71   72                                            
CONECT   32    1    1                                                 
CONECT   33    3    3                                                 
CONECT   34    6   73                                                 
CONECT   35    6    6                                                 
CONECT   36   12   13                                                 
CONECT   37   15   14                                                 
CONECT   38   42   42                                                 
CONECT   39   42   42                                                 
CONECT   40   17   17                                                 
CONECT   41    7    7                                                 
CONECT   42   21   31   38   38                                       
CONECT   42   39   39                                                 
CONECT   43    2                                                      
CONECT   44    4                                                      
CONECT   45    4                                                      
CONECT   46    5                                                      
CONECT   47    5                                                      
CONECT   48   11                                                      
CONECT   49   11                                                      
CONECT   50   12                                                      
CONECT   51   12                                                      
CONECT   52   13                                                      
CONECT   53   13                                                      
CONECT   54   14                                                      
CONECT   55   14                                                      
CONECT   56   15                                                      
CONECT   57   15                                                      
CONECT   58   16                                                      
CONECT   59   16                                                      
CONECT   60   19                                                      
CONECT   61   20                                                      
CONECT   62   22                                                      
CONECT   63   23                                                      
CONECT   64   24                                                      
CONECT   65   25                                                      
CONECT   66   26                                                      
CONECT   67   28                                                      
CONECT   68   28                                                      
CONECT   69   29                                                      
CONECT   70   30                                                      
CONECT   71   31                                                      
CONECT   72   31                                                      
CONECT   73   34                                                      
MASTER        0    0    0    0    0    0    0    0   73    0   73    0
END
