COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.264  -1.245   0.768  1.00  0.00           C  
HETATM    2  C   UNL     1       0.969  -0.680  -0.453  1.00  0.00           C  
HETATM    3  C   UNL     1       0.946  -1.494  -1.610  1.00  0.00           C  
HETATM    4  N   UNL     1      -4.207  -0.585   0.249  1.00  0.00           N  
HETATM    5  C   UNL     1       3.026   1.622  -0.962  1.00  0.00           C  
HETATM    6  C   UNL     1       3.725   1.702   0.396  1.00  0.00           C  
HETATM    7  C   UNL     1       5.509   0.213  -0.282  1.00  0.00           C  
HETATM    8  C   UNL     1       7.004   0.142  -0.601  1.00  0.00           C  
HETATM    9  C   UNL     1       7.807   0.457   0.664  1.00  0.00           C  
HETATM   10  C   UNL     1       7.405   1.840   1.183  1.00  0.00           C  
HETATM   11  C   UNL     1       5.898   1.861   1.451  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.847   0.689  -0.204  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.035   1.433  -0.109  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.215   0.780   0.114  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.688   3.606  -0.418  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.728  -2.715   0.530  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.336  -2.633   0.331  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.412  -3.727   0.315  1.00  0.00           C  
HETATM   19  N   UNL     1      -1.679  -4.594   0.302  1.00  0.00           N  
HETATM   20  N   UNL     1      -5.231  -1.510   0.478  1.00  0.00           N  
HETATM   21  C   UNL     1      -3.027  -1.270   0.153  1.00  0.00           C  
HETATM   22  N   UNL     1      -5.397   1.484   0.202  1.00  0.00           N  
HETATM   23  C   UNL     1      -5.394   2.941   0.057  1.00  0.00           C  
HETATM   24  C   UNL     1      -6.244   3.751   1.039  1.00  0.00           C  
HETATM   25  N   UNL     1      -1.879  -0.632  -0.068  1.00  0.00           N  
HETATM   26  C   UNL     1      -0.562   1.376  -0.445  1.00  0.00           C  
HETATM   27  N   UNL     1      -0.392   2.698  -0.591  1.00  0.00           N  
HETATM   28  N   UNL     1       0.851   2.965  -0.787  1.00  0.00           N  
HETATM   29  N   UNL     1       1.580   1.768  -0.776  1.00  0.00           N  
HETATM   30  C   UNL     1       0.680   0.765  -0.554  1.00  0.00           C  
HETATM   31  N   UNL     1       1.534  -2.564   0.865  1.00  0.00           N  
HETATM   32  C   UNL     1       1.215  -2.822  -1.489  1.00  0.00           C  
HETATM   33  C   UNL     1       1.523  -3.355  -0.224  1.00  0.00           C  
HETATM   34  O   UNL     1       1.766  -4.545  -0.111  1.00  0.00           O  
HETATM   35  N   UNL     1       5.175   1.555   0.210  1.00  0.00           N  
HETATM   36  H   UNL     1       1.283  -0.628   1.654  1.00  0.00           H  
HETATM   37  H   UNL     1       0.716  -1.067  -2.575  1.00  0.00           H  
HETATM   38  H   UNL     1       3.392   2.421  -1.607  1.00  0.00           H  
HETATM   39  H   UNL     1       3.237   0.657  -1.423  1.00  0.00           H  
HETATM   40  H   UNL     1       3.514   2.667   0.858  1.00  0.00           H  
HETATM   41  H   UNL     1       3.359   0.903   1.041  1.00  0.00           H  
HETATM   42  H   UNL     1       4.934   0.003  -1.184  1.00  0.00           H  
HETATM   43  H   UNL     1       5.266  -0.525   0.483  1.00  0.00           H  
HETATM   44  H   UNL     1       7.255  -0.859  -0.952  1.00  0.00           H  
HETATM   45  H   UNL     1       7.245   0.871  -1.376  1.00  0.00           H  
HETATM   46  H   UNL     1       7.595  -0.294   1.425  1.00  0.00           H  
HETATM   47  H   UNL     1       8.872   0.450   0.431  1.00  0.00           H  
HETATM   48  H   UNL     1       7.942   2.052   2.108  1.00  0.00           H  
HETATM   49  H   UNL     1       7.653   2.595   0.437  1.00  0.00           H  
HETATM   50  H   UNL     1       5.654   1.115   2.208  1.00  0.00           H  
HETATM   51  H   UNL     1       5.606   2.849   1.807  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.016   2.508  -0.211  1.00  0.00           H  
HETATM   53  H   UNL     1      -6.597   4.482  -1.061  1.00  0.00           H  
HETATM   54  H   UNL     1      -7.541   2.959  -0.622  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.287  -3.623   0.695  1.00  0.00           H  
HETATM   56  H   UNL     1      -6.230   1.013   0.361  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.453   3.379  -0.274  1.00  0.00           H  
HETATM   58  H   UNL     1      -5.860   4.721   1.354  1.00  0.00           H  
HETATM   59  H   UNL     1      -6.804   3.199   1.793  1.00  0.00           H  
HETATM   60  H   UNL     1       1.202  -3.461  -2.359  1.00  0.00           H  
HETATM   61  H   UNL     1       1.740  -2.947   1.732  1.00  0.00           H  
CONECT    1   31    2    2   36                                       
CONECT    2    3    1    1   30                                       
CONECT    3   32   32    2   37                                       
CONECT    4   21   20   14                                            
CONECT    5   29    6   38   39                                       
CONECT    6    5   35   40   41                                       
CONECT    7   35    8   42   43                                       
CONECT    8    7    9   44   45                                       
CONECT    9   10    8   46   47                                       
CONECT   10   11    9   48   49                                       
CONECT   11   35   10   50   51                                       
CONECT   12   25   25   26   13                                       
CONECT   13   12   14   14   52                                       
CONECT   14    4   13   13   22                                       
CONECT   15   23   24   53   54                                       
CONECT   16   17   20   20   55                                       
CONECT   17   18   16   21   21                                       
CONECT   18   19   19   19   17                                       
CONECT   19   18   18   18                                            
CONECT   20   16   16    4                                            
CONECT   21   17   17   25    4                                       
CONECT   22   14   23   56                                            
CONECT   23   22   15   24   57                                       
CONECT   24   23   15   58   59                                       
CONECT   25   21   12   12                                            
CONECT   26   30   30   12   27                                       
CONECT   27   26   28   28                                            
CONECT   28   29   27   27                                            
CONECT   29   30    5   28                                            
CONECT   30    2   26   26   29                                       
CONECT   31   33    1   61                                            
CONECT   32   33    3    3   60                                       
CONECT   33   34   34   32   31                                       
CONECT   34   33   33                                                 
CONECT   35    6   11    7                                            
CONECT   36    1                                                      
CONECT   37    3                                                      
CONECT   38    5                                                      
CONECT   39    5                                                      
CONECT   40    6                                                      
CONECT   41    6                                                      
CONECT   42    7                                                      
CONECT   43    7                                                      
CONECT   44    8                                                      
CONECT   45    8                                                      
CONECT   46    9                                                      
CONECT   47    9                                                      
CONECT   48   10                                                      
CONECT   49   10                                                      
CONECT   50   11                                                      
CONECT   51   11                                                      
CONECT   52   13                                                      
CONECT   53   15                                                      
CONECT   54   15                                                      
CONECT   55   16                                                      
CONECT   56   22                                                      
CONECT   57   23                                                      
CONECT   58   24                                                      
CONECT   59   24                                                      
CONECT   60   32                                                      
CONECT   61   31                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
