COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.287  -0.317  -1.087  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.428  -0.559  -0.190  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.935  -1.555   1.425  1.00  0.00           C  
HETATM    4  C   UNL     1       5.045  -0.315  -0.247  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.210  -0.399  -1.064  1.00  0.00           C  
HETATM    6  C   UNL     1       7.542  -0.234  -0.270  1.00  0.00           C  
HETATM    7  C   UNL     1       2.548  -0.397  -0.224  1.00  0.00           C  
HETATM    8  C   UNL     1       3.784  -0.235  -1.110  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.018  -1.886   0.224  1.00  0.00           C  
HETATM   10  C   UNL     1       6.281  -0.154  -1.134  1.00  0.00           C  
HETATM   11  C   UNL     1       0.051  -0.479  -0.200  1.00  0.00           C  
HETATM   12  C   UNL     1      -6.536   0.868   0.923  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.591   0.084   0.423  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.827  -0.642  -0.843  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.902   0.057  -2.048  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.123  -0.627  -3.226  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.270  -2.002  -3.214  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.198  -2.701  -2.022  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.971  -2.030  -0.838  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.277  -0.067   1.145  1.00  0.00           C  
HETATM   21  C   UNL     1       8.778  -0.072  -1.157  1.00  0.00           C  
HETATM   22  C   UNL     1      10.020  -0.150  -0.307  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.120   0.444   0.321  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.806   1.873   0.113  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.336   2.649   1.173  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.044   3.982   0.972  1.00  0.00           C  
HETATM   27  C   UNL     1      -2.218   4.551  -0.277  1.00  0.00           C  
HETATM   28  C   UNL     1      -2.685   3.787  -1.332  1.00  0.00           C  
HETATM   29  C   UNL     1      -2.973   2.451  -1.146  1.00  0.00           C  
HETATM   30  C   UNL     1      -3.083  -1.549   2.704  1.00  0.00           C  
HETATM   31  C   UNL     1      -3.296  -0.194   3.392  1.00  0.00           C  
HETATM   32  C   UNL     1      -4.303   0.601   2.528  1.00  0.00           C  
HETATM   33  N   UNL     1      11.060  -0.987  -0.479  1.00  0.00           N  
HETATM   34  N   UNL     1      11.911  -0.733   0.457  1.00  0.00           N  
HETATM   35  N   UNL     1      11.448   0.216   1.193  1.00  0.00           N  
HETATM   36  N   UNL     1      10.299   0.586   0.741  1.00  0.00           N  
HETATM   37  O   UNL     1      -3.503  -2.605   3.571  1.00  0.00           O  
HETATM   38  H   UNL     1       1.251   0.650  -1.588  1.00  0.00           H  
HETATM   39  H   UNL     1       1.306  -1.112  -1.832  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.813  -2.197   1.486  1.00  0.00           H  
HETATM   41  H   UNL     1       5.026   0.479   0.498  1.00  0.00           H  
HETATM   42  H   UNL     1       5.081  -1.283   0.254  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.191  -1.194  -1.809  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.246   0.568  -1.565  1.00  0.00           H  
HETATM   45  H   UNL     1       7.523   0.561   0.475  1.00  0.00           H  
HETATM   46  H   UNL     1       7.578  -1.201   0.231  1.00  0.00           H  
HETATM   47  H   UNL     1       2.529   0.398   0.522  1.00  0.00           H  
HETATM   48  H   UNL     1       2.584  -1.365   0.277  1.00  0.00           H  
HETATM   49  H   UNL     1       3.748   0.732  -1.612  1.00  0.00           H  
HETATM   50  H   UNL     1       3.803  -1.030  -1.856  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.601  -2.313  -0.592  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.229  -2.574   0.528  1.00  0.00           H  
HETATM   53  H   UNL     1       6.300  -0.948  -1.879  1.00  0.00           H  
HETATM   54  H   UNL     1       6.245   0.814  -1.635  1.00  0.00           H  
HETATM   55  H   UNL     1       0.087  -1.446   0.301  1.00  0.00           H  
HETATM   56  H   UNL     1       0.032   0.316   0.545  1.00  0.00           H  
HETATM   57  H   UNL     1      -7.449   1.034   0.371  1.00  0.00           H  
HETATM   58  H   UNL     1      -6.392   1.342   1.883  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.788   1.131  -2.059  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.181  -0.087  -4.160  1.00  0.00           H  
HETATM   61  H   UNL     1      -6.443  -2.533  -4.139  1.00  0.00           H  
HETATM   62  H   UNL     1      -6.314  -3.775  -2.019  1.00  0.00           H  
HETATM   63  H   UNL     1      -5.914  -2.577   0.092  1.00  0.00           H  
HETATM   64  H   UNL     1       8.797  -0.867  -1.903  1.00  0.00           H  
HETATM   65  H   UNL     1       8.742   0.896  -1.658  1.00  0.00           H  
HETATM   66  H   UNL     1      -2.200   2.207   2.149  1.00  0.00           H  
HETATM   67  H   UNL     1      -1.680   4.584   1.792  1.00  0.00           H  
HETATM   68  H   UNL     1      -1.989   5.595  -0.430  1.00  0.00           H  
HETATM   69  H   UNL     1      -2.819   4.237  -2.305  1.00  0.00           H  
HETATM   70  H   UNL     1      -3.332   1.855  -1.972  1.00  0.00           H  
HETATM   71  H   UNL     1      -2.031  -1.673   2.449  1.00  0.00           H  
HETATM   72  H   UNL     1      -3.716  -0.345   4.387  1.00  0.00           H  
HETATM   73  H   UNL     1      -2.347   0.337   3.467  1.00  0.00           H  
HETATM   74  H   UNL     1      -3.972   1.637   2.451  1.00  0.00           H  
HETATM   75  H   UNL     1      -5.308   0.558   2.947  1.00  0.00           H  
HETATM   76  H   UNL     1      11.152  -1.656  -1.175  1.00  0.00           H  
HETATM   77  H   UNL     1      -3.004  -2.656   4.398  1.00  0.00           H  
CONECT    1    7   11   38   39                                       
CONECT    2    9   23   23    5                                       
CONECT    3   20    9   30   40                                       
CONECT    4   10    8   41   42                                       
CONECT    5   11    2   43   44                                       
CONECT    6   21   10   45   46                                       
CONECT    7    8    1   47   48                                       
CONECT    8    4    7   49   50                                       
CONECT    9    3    2   51   52                                       
CONECT   10    6    4   53   54                                       
CONECT   11    1    5   55   56                                       
CONECT   12   13   13   57   58                                       
CONECT   13   14   12   12   20                                       
CONECT   14   15   15   19   13                                       
CONECT   15   16   14   14   59                                       
CONECT   16   17   17   15   60                                       
CONECT   17   16   16   18   61                                       
CONECT   18   17   19   19   62                                       
CONECT   19   18   18   14   63                                       
CONECT   20   13    3   23   32                                       
CONECT   21   22    6   64   65                                       
CONECT   22   36   36   21   33                                       
CONECT   23   20    2    2   24                                       
CONECT   24   25   23   29   29                                       
CONECT   25   26   26   24   66                                       
CONECT   26   25   25   27   67                                       
CONECT   27   26   28   28   68                                       
CONECT   28   27   27   29   69                                       
CONECT   29   24   24   28   70                                       
CONECT   30    3   37   31   71                                       
CONECT   31   30   32   72   73                                       
CONECT   32   20   31   74   75                                       
CONECT   33   22   34   76                                            
CONECT   34   35   35   33                                            
CONECT   35   36   34   34                                            
CONECT   36   35   22   22                                            
CONECT   37   30   77                                                 
CONECT   38    1                                                      
CONECT   39    1                                                      
CONECT   40    3                                                      
CONECT   41    4                                                      
CONECT   42    4                                                      
CONECT   43    5                                                      
CONECT   44    5                                                      
CONECT   45    6                                                      
CONECT   46    6                                                      
CONECT   47    7                                                      
CONECT   48    7                                                      
CONECT   49    8                                                      
CONECT   50    8                                                      
CONECT   51    9                                                      
CONECT   52    9                                                      
CONECT   53   10                                                      
CONECT   54   10                                                      
CONECT   55   11                                                      
CONECT   56   11                                                      
CONECT   57   12                                                      
CONECT   58   12                                                      
CONECT   59   15                                                      
CONECT   60   16                                                      
CONECT   61   17                                                      
CONECT   62   18                                                      
CONECT   63   19                                                      
CONECT   64   21                                                      
CONECT   65   21                                                      
CONECT   66   25                                                      
CONECT   67   26                                                      
CONECT   68   27                                                      
CONECT   69   28                                                      
CONECT   70   29                                                      
CONECT   71   30                                                      
CONECT   72   31                                                      
CONECT   73   31                                                      
CONECT   74   32                                                      
CONECT   75   32                                                      
CONECT   76   33                                                      
CONECT   77   37                                                      
MASTER        0    0    0    0    0    0    0    0   77    0   77    0
END
