COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -1.414   4.358   2.211  1.00  0.00           O  
HETATM    2  C   UNL     1      -1.132  -0.572   0.478  1.00  0.00           C  
HETATM    3  C   UNL     1       7.304  -1.156  -0.513  1.00  0.00           C  
HETATM    4  C   UNL     1       3.827   0.596   1.094  1.00  0.00           C  
HETATM    5  O   UNL     1       7.730   0.069   0.088  1.00  0.00           O  
HETATM    6  C   UNL     1       6.570  -0.853  -1.821  1.00  0.00           C  
HETATM    7  C   UNL     1       8.523  -2.033  -0.803  1.00  0.00           C  
HETATM    8  C   UNL     1       6.361  -1.891   0.442  1.00  0.00           C  
HETATM    9  N   UNL     1       5.140  -1.103   0.625  1.00  0.00           N  
HETATM   10  N   UNL     1       5.080   0.230   1.047  1.00  0.00           N  
HETATM   11  C   UNL     1       3.036  -0.504   0.706  1.00  0.00           C  
HETATM   12  C   UNL     1       3.882  -1.538   0.421  1.00  0.00           C  
HETATM   13  C   UNL     1       1.557  -0.535   0.623  1.00  0.00           C  
HETATM   14  N   UNL     1       0.967  -1.652   0.240  1.00  0.00           N  
HETATM   15  C   UNL     1      -0.368  -1.720   0.152  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.021  -2.894  -0.253  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.379  -2.923  -0.330  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.143  -1.792  -0.009  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.623  -1.851  -0.101  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.485  -2.612   0.638  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.124  -3.581   1.734  1.00  0.00           C  
HETATM   22  O   UNL     1      -6.715  -2.323   0.193  1.00  0.00           O  
HETATM   23  N   UNL     1      -6.692  -1.505  -0.697  1.00  0.00           N  
HETATM   24  C   UNL     1      -5.480  -1.125  -0.976  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.064  -0.123  -2.022  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.526  -0.619   0.395  1.00  0.00           C  
HETATM   27  C   UNL     1      -0.445   0.599   0.889  1.00  0.00           C  
HETATM   28  N   UNL     1       0.877   0.566   0.943  1.00  0.00           N  
HETATM   29  N   UNL     1      -1.138   1.744   1.222  1.00  0.00           N  
HETATM   30  C   UNL     1      -1.045   2.015   2.664  1.00  0.00           C  
HETATM   31  C   UNL     1      -1.874   3.257   2.999  1.00  0.00           C  
HETATM   32  C   UNL     1      -1.491   4.129   0.802  1.00  0.00           C  
HETATM   33  C   UNL     1      -0.658   2.895   0.444  1.00  0.00           C  
HETATM   34  C   UNL     1      -0.798   2.602  -1.027  1.00  0.00           C  
HETATM   35  C   UNL     1      -1.919   1.944  -1.497  1.00  0.00           C  
HETATM   36  C   UNL     1      -2.048   1.675  -2.847  1.00  0.00           C  
HETATM   37  C   UNL     1      -1.056   2.064  -3.727  1.00  0.00           C  
HETATM   38  C   UNL     1       0.065   2.723  -3.257  1.00  0.00           C  
HETATM   39  C   UNL     1       0.191   2.996  -1.908  1.00  0.00           C  
HETATM   40  H   UNL     1       3.461   1.570   1.385  1.00  0.00           H  
HETATM   41  H   UNL     1       8.332   0.588  -0.463  1.00  0.00           H  
HETATM   42  H   UNL     1       5.702  -0.228  -1.615  1.00  0.00           H  
HETATM   43  H   UNL     1       7.242  -0.329  -2.502  1.00  0.00           H  
HETATM   44  H   UNL     1       6.245  -1.787  -2.280  1.00  0.00           H  
HETATM   45  H   UNL     1       8.197  -2.967  -1.261  1.00  0.00           H  
HETATM   46  H   UNL     1       9.194  -1.510  -1.483  1.00  0.00           H  
HETATM   47  H   UNL     1       9.045  -2.249   0.129  1.00  0.00           H  
HETATM   48  H   UNL     1       6.106  -2.864   0.023  1.00  0.00           H  
HETATM   49  H   UNL     1       6.853  -2.028   1.405  1.00  0.00           H  
HETATM   50  H   UNL     1       3.595  -2.526   0.090  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.447  -3.774  -0.504  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.876  -3.829  -0.643  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.110  -3.059   2.690  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.862  -4.382   1.768  1.00  0.00           H  
HETATM   55  H   UNL     1      -4.139  -4.003   1.536  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.042   0.873  -1.582  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.072  -0.378  -2.395  1.00  0.00           H  
HETATM   58  H   UNL     1      -5.778  -0.141  -2.846  1.00  0.00           H  
HETATM   59  H   UNL     1      -3.116   0.251   0.642  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.429   1.160   3.220  1.00  0.00           H  
HETATM   61  H   UNL     1      -0.003   2.187   2.936  1.00  0.00           H  
HETATM   62  H   UNL     1      -1.763   3.495   4.057  1.00  0.00           H  
HETATM   63  H   UNL     1      -2.924   3.065   2.778  1.00  0.00           H  
HETATM   64  H   UNL     1      -2.530   3.962   0.516  1.00  0.00           H  
HETATM   65  H   UNL     1      -1.102   4.997   0.270  1.00  0.00           H  
HETATM   66  H   UNL     1       0.390   3.083   0.680  1.00  0.00           H  
HETATM   67  H   UNL     1      -2.695   1.640  -0.809  1.00  0.00           H  
HETATM   68  H   UNL     1      -2.924   1.160  -3.214  1.00  0.00           H  
HETATM   69  H   UNL     1      -1.156   1.853  -4.781  1.00  0.00           H  
HETATM   70  H   UNL     1       0.840   3.026  -3.945  1.00  0.00           H  
HETATM   71  H   UNL     1       1.066   3.514  -1.542  1.00  0.00           H  
CONECT    1   32   31                                                 
CONECT    2   27   26   26   15                                       
CONECT    3    5    6    8    7                                       
CONECT    4   11   10   10   40                                       
CONECT    5    3   41                                                 
CONECT    6    3   42   43   44                                       
CONECT    7    3   45   46   47                                       
CONECT    8    3    9   48   49                                       
CONECT    9    8   12   10                                            
CONECT   10    9    4    4                                            
CONECT   11   12   12   13    4                                       
CONECT   12    9   11   11   50                                       
CONECT   13   28   11   14   14                                       
CONECT   14   13   13   15                                            
CONECT   15    2   14   16   16                                       
CONECT   16   15   15   17   51                                       
CONECT   17   18   18   16   52                                       
CONECT   18   26   19   17   17                                       
CONECT   19   24   18   20   20                                       
CONECT   20   19   19   22   21                                       
CONECT   21   20   53   54   55                                       
CONECT   22   23   20                                                 
CONECT   23   24   24   22                                            
CONECT   24   25   23   23   19                                       
CONECT   25   24   56   57   58                                       
CONECT   26    2    2   18   59                                       
CONECT   27   29   28   28    2                                       
CONECT   28   27   27   13                                            
CONECT   29   33   30   27                                            
CONECT   30   31   29   60   61                                       
CONECT   31    1   30   62   63                                       
CONECT   32    1   33   64   65                                       
CONECT   33   32   34   29   66                                       
CONECT   34   35   33   39   39                                       
CONECT   35   36   36   34   67                                       
CONECT   36   35   35   37   68                                       
CONECT   37   36   38   38   69                                       
CONECT   38   37   37   39   70                                       
CONECT   39   34   34   38   71                                       
CONECT   40    4                                                      
CONECT   41    5                                                      
CONECT   42    6                                                      
CONECT   43    6                                                      
CONECT   44    6                                                      
CONECT   45    7                                                      
CONECT   46    7                                                      
CONECT   47    7                                                      
CONECT   48    8                                                      
CONECT   49    8                                                      
CONECT   50   12                                                      
CONECT   51   16                                                      
CONECT   52   17                                                      
CONECT   53   21                                                      
CONECT   54   21                                                      
CONECT   55   21                                                      
CONECT   56   25                                                      
CONECT   57   25                                                      
CONECT   58   25                                                      
CONECT   59   26                                                      
CONECT   60   30                                                      
CONECT   61   30                                                      
CONECT   62   31                                                      
CONECT   63   31                                                      
CONECT   64   32                                                      
CONECT   65   32                                                      
CONECT   66   33                                                      
CONECT   67   35                                                      
CONECT   68   36                                                      
CONECT   69   37                                                      
CONECT   70   38                                                      
CONECT   71   39                                                      
MASTER        0    0    0    0    0    0    0    0   71    0   71    0
END
