COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.201   0.497   0.301  1.00  0.00           C  
HETATM    2  N   UNL     1       2.853  -0.143   0.095  1.00  0.00           N  
HETATM    3  C   UNL     1       1.561   0.078   0.278  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.722  -0.683   0.089  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.431  -0.331   0.583  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.143  -0.570   2.199  1.00  0.00           C  
HETATM    7  C   UNL     1      -7.078  -0.451  -0.009  1.00  0.00           C  
HETATM    8  C   UNL     1      -7.910  -2.609  -0.725  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.617   0.772   0.336  1.00  0.00           C  
HETATM   10  C   UNL     1       8.727   1.351   0.538  1.00  0.00           C  
HETATM   11  C   UNL     1       7.197  -0.465  -0.308  1.00  0.00           C  
HETATM   12  C   UNL     1       5.809  -0.682  -0.339  1.00  0.00           C  
HETATM   13  C   UNL     1       5.297  -1.846  -0.909  1.00  0.00           C  
HETATM   14  C   UNL     1       6.150  -2.776  -1.436  1.00  0.00           C  
HETATM   15  C   UNL     1       7.522  -2.568  -1.409  1.00  0.00           C  
HETATM   16  C   UNL     1       8.048  -1.424  -0.850  1.00  0.00           C  
HETATM   17  C   UNL     1       6.224   1.314   0.663  1.00  0.00           C  
HETATM   18  C   UNL     1       3.758   0.745   0.506  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.535  -1.785   0.346  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.892  -4.120   0.627  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.886  -1.607   0.592  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.614  -0.867  -0.158  1.00  0.00           C  
HETATM   23  C   UNL     1      -9.258  -0.624  -1.049  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.688   2.997  -0.515  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.334   4.357  -0.580  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.605   5.219  -1.612  1.00  0.00           C  
HETATM   27  C   UNL     1      -1.265   0.593   0.084  1.00  0.00           C  
HETATM   28  C   UNL     1       1.962   2.105   1.304  1.00  0.00           C  
HETATM   29  C   UNL     1       3.320   1.917   1.135  1.00  0.00           C  
HETATM   30  N   UNL     1       7.411   0.751   0.305  1.00  0.00           N  
HETATM   31  N   UNL     1       0.647  -0.865  -0.161  1.00  0.00           N  
HETATM   32  N   UNL     1      -4.798  -0.152   0.834  1.00  0.00           N  
HETATM   33  N   UNL     1      -7.894  -1.166  -1.000  1.00  0.00           N  
HETATM   34  N   UNL     1      -3.166   2.063   0.332  1.00  0.00           N  
HETATM   35  N   UNL     1       1.120   1.178   0.870  1.00  0.00           N  
HETATM   36  O   UNL     1      -1.000  -3.036   0.355  1.00  0.00           O  
HETATM   37  O   UNL     1      -1.738   2.742  -1.225  1.00  0.00           O  
HETATM   38  H   UNL     1      -4.576   0.024   2.915  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.210  -0.420   2.367  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.900  -1.625   2.328  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.426  -0.698   0.994  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.170   0.623  -0.170  1.00  0.00           H  
HETATM   43  H   UNL     1      -8.330  -2.786   0.265  1.00  0.00           H  
HETATM   44  H   UNL     1      -8.521  -3.114  -1.474  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.893  -2.998  -0.764  1.00  0.00           H  
HETATM   46  H   UNL     1       9.106   1.032   1.508  1.00  0.00           H  
HETATM   47  H   UNL     1       9.416   1.032  -0.244  1.00  0.00           H  
HETATM   48  H   UNL     1       8.638   2.438   0.522  1.00  0.00           H  
HETATM   49  H   UNL     1       4.231  -2.013  -0.933  1.00  0.00           H  
HETATM   50  H   UNL     1       5.753  -3.678  -1.878  1.00  0.00           H  
HETATM   51  H   UNL     1       8.183  -3.311  -1.829  1.00  0.00           H  
HETATM   52  H   UNL     1       9.117  -1.271  -0.833  1.00  0.00           H  
HETATM   53  H   UNL     1       6.113   2.266   1.158  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.339  -3.985   1.612  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.677  -4.142  -0.129  1.00  0.00           H  
HETATM   56  H   UNL     1      -1.339  -5.059   0.604  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.516  -2.461   0.792  1.00  0.00           H  
HETATM   58  H   UNL     1      -5.522  -1.941   0.004  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.266  -0.619  -1.161  1.00  0.00           H  
HETATM   60  H   UNL     1      -9.220   0.431  -1.322  1.00  0.00           H  
HETATM   61  H   UNL     1      -9.840  -1.171  -1.791  1.00  0.00           H  
HETATM   62  H   UNL     1      -9.726  -0.729  -0.070  1.00  0.00           H  
HETATM   63  H   UNL     1      -4.379   4.249  -0.869  1.00  0.00           H  
HETATM   64  H   UNL     1      -3.275   4.834   0.398  1.00  0.00           H  
HETATM   65  H   UNL     1      -3.072   6.202  -1.660  1.00  0.00           H  
HETATM   66  H   UNL     1      -1.559   5.326  -1.323  1.00  0.00           H  
HETATM   67  H   UNL     1      -2.663   4.741  -2.591  1.00  0.00           H  
HETATM   68  H   UNL     1      -0.633   1.448  -0.107  1.00  0.00           H  
HETATM   69  H   UNL     1       1.590   2.997   1.785  1.00  0.00           H  
HETATM   70  H   UNL     1       4.027   2.656   1.480  1.00  0.00           H  
HETATM   71  H   UNL     1       0.952  -1.650  -0.641  1.00  0.00           H  
HETATM   72  H   UNL     1      -3.890   2.284   0.939  1.00  0.00           H  
CONECT    1   18   17   17   12                                       
CONECT    2    3   18   18                                            
CONECT    3   31   35   35    2                                       
CONECT    4   27   19   19   31                                       
CONECT    5    9   32   21   21                                       
CONECT    6   32   38   39   40                                       
CONECT    7   22   33   41   42                                       
CONECT    8   33   43   44   45                                       
CONECT    9   34   27   27    5                                       
CONECT   10   30   46   47   48                                       
CONECT   11   30   12   12   16                                       
CONECT   12    1   11   11   13                                       
CONECT   13   12   14   14   49                                       
CONECT   14   13   13   15   50                                       
CONECT   15   16   16   14   51                                       
CONECT   16   11   15   15   52                                       
CONECT   17    1    1   30   53                                       
CONECT   18    2    2   29    1                                       
CONECT   19    4    4   21   36                                       
CONECT   20   36   54   55   56                                       
CONECT   21    5    5   19   57                                       
CONECT   22   32    7   58   59                                       
CONECT   23   33   60   61   62                                       
CONECT   24   25   37   37   34                                       
CONECT   25   26   24   63   64                                       
CONECT   26   25   65   66   67                                       
CONECT   27    9    9    4   68                                       
CONECT   28   35   29   29   69                                       
CONECT   29   28   28   18   70                                       
CONECT   30   17   10   11                                            
CONECT   31    4    3   71                                            
CONECT   32    6    5   22                                            
CONECT   33    7   23    8                                            
CONECT   34   24    9   72                                            
CONECT   35    3    3   28                                            
CONECT   36   19   20                                                 
CONECT   37   24   24                                                 
CONECT   38    6                                                      
CONECT   39    6                                                      
CONECT   40    6                                                      
CONECT   41    7                                                      
CONECT   42    7                                                      
CONECT   43    8                                                      
CONECT   44    8                                                      
CONECT   45    8                                                      
CONECT   46   10                                                      
CONECT   47   10                                                      
CONECT   48   10                                                      
CONECT   49   13                                                      
CONECT   50   14                                                      
CONECT   51   15                                                      
CONECT   52   16                                                      
CONECT   53   17                                                      
CONECT   54   20                                                      
CONECT   55   20                                                      
CONECT   56   20                                                      
CONECT   57   21                                                      
CONECT   58   22                                                      
CONECT   59   22                                                      
CONECT   60   23                                                      
CONECT   61   23                                                      
CONECT   62   23                                                      
CONECT   63   25                                                      
CONECT   64   25                                                      
CONECT   65   26                                                      
CONECT   66   26                                                      
CONECT   67   26                                                      
CONECT   68   27                                                      
CONECT   69   28                                                      
CONECT   70   29                                                      
CONECT   71   31                                                      
CONECT   72   34                                                      
MASTER        0    0    0    0    0    0    0    0   72    0   72    0
END
