COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.950  -2.337   0.472  1.00  0.00           C  
HETATM    2  C   UNL     1       5.101  -1.021   0.007  1.00  0.00           C  
HETATM    3  C   UNL     1       3.876  -0.437   0.008  1.00  0.00           C  
HETATM    4  N   UNL     1      -6.293   1.865   0.207  1.00  0.00           N  
HETATM    5  C   UNL     1      -0.249   0.187   0.460  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.182   1.601   0.177  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.711   2.841   0.536  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.062   3.039   0.579  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.929   1.998   0.262  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.401   0.744  -0.102  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.023   0.550  -0.142  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.583  -0.089  -0.362  1.00  0.00           C  
HETATM   13  C   UNL     1      -7.242   2.939   0.512  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.594  -1.502  -0.779  1.00  0.00           C  
HETATM   15  C   UNL     1       7.516   1.225  -1.784  1.00  0.00           C  
HETATM   16  C   UNL     1       8.346   2.319  -1.079  1.00  0.00           C  
HETATM   17  C   UNL     1       6.514   1.938   0.334  1.00  0.00           C  
HETATM   18  O   UNL     1      -4.545  -2.096  -0.941  1.00  0.00           O  
HETATM   19  N   UNL     1      -6.766  -2.136  -0.980  1.00  0.00           N  
HETATM   20  C   UNL     1      -6.777  -3.541  -1.394  1.00  0.00           C  
HETATM   21  N   UNL     1      -6.631   0.680  -0.153  1.00  0.00           N  
HETATM   22  N   UNL     1      -0.795   1.419   0.140  1.00  0.00           N  
HETATM   23  N   UNL     1      -1.044  -0.777   0.901  1.00  0.00           N  
HETATM   24  C   UNL     1      -0.559  -1.968   1.216  1.00  0.00           C  
HETATM   25  C   UNL     1       0.798  -2.202   1.083  1.00  0.00           C  
HETATM   26  N   UNL     1       1.054   0.000   0.314  1.00  0.00           N  
HETATM   27  C   UNL     1       1.609  -1.168   0.617  1.00  0.00           C  
HETATM   28  N   UNL     1       2.982  -1.361   0.462  1.00  0.00           N  
HETATM   29  N   UNL     1       3.687  -2.538   0.742  1.00  0.00           N  
HETATM   30  C   UNL     1       6.057  -3.348   0.627  1.00  0.00           C  
HETATM   31  N   UNL     1       6.307  -0.414  -0.389  1.00  0.00           N  
HETATM   32  C   UNL     1       6.311   0.975  -0.855  1.00  0.00           C  
HETATM   33  N   UNL     1       7.372   3.024  -0.206  1.00  0.00           N  
HETATM   34  H   UNL     1       3.651   0.576  -0.294  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.045   3.653   0.784  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.457   4.004   0.860  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.616  -0.410  -0.421  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.465   3.496  -0.397  1.00  0.00           H  
HETATM   39  H   UNL     1      -8.161   2.509   0.911  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.805   3.610   1.252  1.00  0.00           H  
HETATM   41  H   UNL     1       7.177   1.577  -2.758  1.00  0.00           H  
HETATM   42  H   UNL     1       8.105   0.314  -1.894  1.00  0.00           H  
HETATM   43  H   UNL     1       9.137   1.868  -0.479  1.00  0.00           H  
HETATM   44  H   UNL     1       8.769   3.007  -1.811  1.00  0.00           H  
HETATM   45  H   UNL     1       5.556   2.340   0.665  1.00  0.00           H  
HETATM   46  H   UNL     1       7.017   1.429   1.156  1.00  0.00           H  
HETATM   47  H   UNL     1      -7.602  -1.662  -0.850  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.255  -3.643  -2.346  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.276  -4.147  -0.638  1.00  0.00           H  
HETATM   50  H   UNL     1      -7.807  -3.879  -1.506  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.215   2.156  -0.110  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.214  -2.747   1.575  1.00  0.00           H  
HETATM   53  H   UNL     1       1.219  -3.164   1.334  1.00  0.00           H  
HETATM   54  H   UNL     1       6.167  -3.911  -0.301  1.00  0.00           H  
HETATM   55  H   UNL     1       6.990  -2.834   0.853  1.00  0.00           H  
HETATM   56  H   UNL     1       5.813  -4.032   1.439  1.00  0.00           H  
HETATM   57  H   UNL     1       7.136  -0.916  -0.354  1.00  0.00           H  
HETATM   58  H   UNL     1       5.379   1.202  -1.374  1.00  0.00           H  
HETATM   59  H   UNL     1       7.843   3.516   0.538  1.00  0.00           H  
CONECT    1   30    2   29   29                                       
CONECT    2   31    1    3    3                                       
CONECT    3    2    2   28   34                                       
CONECT    4   21   13    9                                            
CONECT    5   26   22   23   23                                       
CONECT    6   11   11    7   22                                       
CONECT    7    8    8    6   35                                       
CONECT    8    9    7    7   36                                       
CONECT    9    4   10   10    8                                       
CONECT   10   12    9    9   11                                       
CONECT   11   10    6    6   37                                       
CONECT   12   14   21   21   10                                       
CONECT   13    4   38   39   40                                       
CONECT   14   19   18   18   12                                       
CONECT   15   32   16   41   42                                       
CONECT   16   15   33   43   44                                       
CONECT   17   32   33   45   46                                       
CONECT   18   14   14                                                 
CONECT   19   20   14   47                                            
CONECT   20   19   48   49   50                                       
CONECT   21   12   12    4                                            
CONECT   22    6    5   51                                            
CONECT   23    5    5   24                                            
CONECT   24   25   25   23   52                                       
CONECT   25   27   24   24   53                                       
CONECT   26   27   27    5                                            
CONECT   27   28   26   26   25                                       
CONECT   28    3   29   27                                            
CONECT   29    1    1   28                                            
CONECT   30    1   54   55   56                                       
CONECT   31   32    2   57                                            
CONECT   32   15   31   17   58                                       
CONECT   33   16   17   59                                            
CONECT   34    3                                                      
CONECT   35    7                                                      
CONECT   36    8                                                      
CONECT   37   11                                                      
CONECT   38   13                                                      
CONECT   39   13                                                      
CONECT   40   13                                                      
CONECT   41   15                                                      
CONECT   42   15                                                      
CONECT   43   16                                                      
CONECT   44   16                                                      
CONECT   45   17                                                      
CONECT   46   17                                                      
CONECT   47   19                                                      
CONECT   48   20                                                      
CONECT   49   20                                                      
CONECT   50   20                                                      
CONECT   51   22                                                      
CONECT   52   24                                                      
CONECT   53   25                                                      
CONECT   54   30                                                      
CONECT   55   30                                                      
CONECT   56   30                                                      
CONECT   57   31                                                      
CONECT   58   32                                                      
CONECT   59   33                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
