COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.834   4.322   0.738  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.146   2.206  -0.102  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.478   1.831  -0.087  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.845   0.558  -0.505  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.353  -1.202  -0.969  1.00  0.00           C  
HETATM    6  C   UNL     1      -7.844  -1.533  -1.076  1.00  0.00           C  
HETATM    7  C   UNL     1      -8.498  -1.370   0.298  1.00  0.00           C  
HETATM    8  C   UNL     1      -8.273   0.061   0.795  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.771   0.346   0.849  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.875  -0.338  -0.937  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.545   0.036  -0.953  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.176   1.308  -0.542  1.00  0.00           C  
HETATM   13  C   UNL     1       0.160   0.737  -0.378  1.00  0.00           C  
HETATM   14  C   UNL     1       0.711  -1.447   0.117  1.00  0.00           C  
HETATM   15  C   UNL     1       2.067  -1.127  -0.023  1.00  0.00           C  
HETATM   16  C   UNL     1       3.108  -2.147   0.171  1.00  0.00           C  
HETATM   17  C   UNL     1       3.853  -4.334   0.772  1.00  0.00           C  
HETATM   18  C   UNL     1       3.496  -5.316   1.890  1.00  0.00           C  
HETATM   19  C   UNL     1       4.063  -5.103  -0.534  1.00  0.00           C  
HETATM   20  C   UNL     1       2.406   0.205  -0.362  1.00  0.00           C  
HETATM   21  C   UNL     1       3.817   0.603  -0.525  1.00  0.00           C  
HETATM   22  C   UNL     1       4.673   0.187  -1.496  1.00  0.00           C  
HETATM   23  C   UNL     1       7.054   0.552  -2.178  1.00  0.00           C  
HETATM   24  C   UNL     1       5.866   1.597  -0.215  1.00  0.00           C  
HETATM   25  C   UNL     1       4.573   1.535   0.331  1.00  0.00           C  
HETATM   26  C   UNL     1       4.257   2.281   1.464  1.00  0.00           C  
HETATM   27  C   UNL     1       5.218   3.079   2.045  1.00  0.00           C  
HETATM   28  C   UNL     1       6.495   3.141   1.506  1.00  0.00           C  
HETATM   29  C   UNL     1       6.822   2.409   0.386  1.00  0.00           C  
HETATM   30  N   UNL     1      -6.191   0.177  -0.490  1.00  0.00           N  
HETATM   31  N   UNL     1      -7.897  -2.319   1.244  1.00  0.00           N  
HETATM   32  N   UNL     1      -0.825   1.687  -0.558  1.00  0.00           N  
HETATM   33  N   UNL     1      -0.194  -0.504  -0.065  1.00  0.00           N  
HETATM   34  N   UNL     1       5.888   0.770  -1.319  1.00  0.00           N  
HETATM   35  N   UNL     1       1.427   1.092  -0.528  1.00  0.00           N  
HETATM   36  O   UNL     1      -2.785   3.452   0.306  1.00  0.00           O  
HETATM   37  O   UNL     1       2.773  -3.379   0.603  1.00  0.00           O  
HETATM   38  O   UNL     1       4.271  -1.878  -0.059  1.00  0.00           O  
HETATM   39  H   UNL     1      -4.539   4.474  -0.079  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.351   3.875   1.586  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.410   5.282   1.035  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.232   2.527   0.250  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.878  -1.888  -0.268  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.887  -1.303  -1.949  1.00  0.00           H  
HETATM   45  H   UNL     1      -8.317  -0.856  -1.788  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.964  -2.562  -1.417  1.00  0.00           H  
HETATM   47  H   UNL     1      -9.568  -1.563   0.217  1.00  0.00           H  
HETATM   48  H   UNL     1      -8.753   0.763   0.114  1.00  0.00           H  
HETATM   49  H   UNL     1      -8.701   0.171   1.792  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.607   1.369   1.189  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.293  -0.348   1.541  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.161  -1.327  -1.261  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.793  -0.660  -1.293  1.00  0.00           H  
HETATM   54  H   UNL     1       0.410  -2.453   0.371  1.00  0.00           H  
HETATM   55  H   UNL     1       4.770  -3.805   1.033  1.00  0.00           H  
HETATM   56  H   UNL     1       2.580  -5.846   1.629  1.00  0.00           H  
HETATM   57  H   UNL     1       4.307  -6.033   2.016  1.00  0.00           H  
HETATM   58  H   UNL     1       3.346  -4.769   2.820  1.00  0.00           H  
HETATM   59  H   UNL     1       4.318  -4.403  -1.330  1.00  0.00           H  
HETATM   60  H   UNL     1       4.874  -5.820  -0.407  1.00  0.00           H  
HETATM   61  H   UNL     1       3.147  -5.633  -0.795  1.00  0.00           H  
HETATM   62  H   UNL     1       4.424  -0.502  -2.290  1.00  0.00           H  
HETATM   63  H   UNL     1       7.052   1.285  -2.985  1.00  0.00           H  
HETATM   64  H   UNL     1       7.965   0.661  -1.590  1.00  0.00           H  
HETATM   65  H   UNL     1       7.012  -0.452  -2.600  1.00  0.00           H  
HETATM   66  H   UNL     1       3.264   2.235   1.885  1.00  0.00           H  
HETATM   67  H   UNL     1       4.977   3.659   2.923  1.00  0.00           H  
HETATM   68  H   UNL     1       7.241   3.771   1.969  1.00  0.00           H  
HETATM   69  H   UNL     1       7.819   2.464  -0.025  1.00  0.00           H  
HETATM   70  H   UNL     1      -8.314  -2.230   2.159  1.00  0.00           H  
HETATM   71  H   UNL     1      -7.972  -3.266   0.903  1.00  0.00           H  
HETATM   72  H   UNL     1      -0.583   2.616  -0.696  1.00  0.00           H  
CONECT    1   36   39   40   41                                       
CONECT    2   12   36    3    3                                       
CONECT    3    2    2    4   42                                       
CONECT    4   10   10    3   30                                       
CONECT    5   30    6   43   44                                       
CONECT    6    5    7   45   46                                       
CONECT    7    6    8   31   47                                       
CONECT    8    9    7   48   49                                       
CONECT    9   30    8   50   51                                       
CONECT   10   11    4    4   52                                       
CONECT   11   12   12   10   53                                       
CONECT   12   32   11   11    2                                       
CONECT   13   33   33   35   32                                       
CONECT   14   15   15   33   54                                       
CONECT   15   16   14   14   20                                       
CONECT   16   37   38   38   15                                       
CONECT   17   19   18   37   55                                       
CONECT   18   17   56   57   58                                       
CONECT   19   17   59   60   61                                       
CONECT   20   15   21   35   35                                       
CONECT   21   22   22   20   25                                       
CONECT   22   34   21   21   62                                       
CONECT   23   34   63   64   65                                       
CONECT   24   34   29   29   25                                       
CONECT   25   24   21   26   26                                       
CONECT   26   25   25   27   66                                       
CONECT   27   28   28   26   67                                       
CONECT   28   29   27   27   68                                       
CONECT   29   24   24   28   69                                       
CONECT   30    4    5    9                                            
CONECT   31    7   70   71                                            
CONECT   32   13   12   72                                            
CONECT   33   14   13   13                                            
CONECT   34   23   22   24                                            
CONECT   35   20   20   13                                            
CONECT   36    2    1                                                 
CONECT   37   17   16                                                 
CONECT   38   16   16                                                 
CONECT   39    1                                                      
CONECT   40    1                                                      
CONECT   41    1                                                      
CONECT   42    3                                                      
CONECT   43    5                                                      
CONECT   44    5                                                      
CONECT   45    6                                                      
CONECT   46    6                                                      
CONECT   47    7                                                      
CONECT   48    8                                                      
CONECT   49    8                                                      
CONECT   50    9                                                      
CONECT   51    9                                                      
CONECT   52   10                                                      
CONECT   53   11                                                      
CONECT   54   14                                                      
CONECT   55   17                                                      
CONECT   56   18                                                      
CONECT   57   18                                                      
CONECT   58   18                                                      
CONECT   59   19                                                      
CONECT   60   19                                                      
CONECT   61   19                                                      
CONECT   62   22                                                      
CONECT   63   23                                                      
CONECT   64   23                                                      
CONECT   65   23                                                      
CONECT   66   26                                                      
CONECT   67   27                                                      
CONECT   68   28                                                      
CONECT   69   29                                                      
CONECT   70   31                                                      
CONECT   71   31                                                      
CONECT   72   32                                                      
MASTER        0    0    0    0    0    0    0    0   72    0   72    0
END
