COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.438   2.386   1.775  1.00  0.00           C  
HETATM    2  C   UNL     1       5.856   1.395  -0.356  1.00  0.00           C  
HETATM    3  C   UNL     1       4.508   0.929   0.130  1.00  0.00           C  
HETATM    4  O   UNL     1      -2.532  -3.104   0.299  1.00  0.00           O  
HETATM    5  O   UNL     1       2.012   0.163   0.980  1.00  0.00           O  
HETATM    6  C   UNL     1      -2.507  -0.460   0.098  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.464  -2.582   0.043  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.256  -3.420  -0.141  1.00  0.00           C  
HETATM    9  C   UNL     1       0.982  -2.840  -0.436  1.00  0.00           C  
HETATM   10  C   UNL     1       2.082  -3.659  -0.599  1.00  0.00           C  
HETATM   11  C   UNL     1       0.830  -5.554  -0.198  1.00  0.00           C  
HETATM   12  C   UNL     1       0.773  -7.055  -0.076  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.321  -4.811  -0.019  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.574   0.122   0.475  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.942   0.204   0.747  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.560   1.433   0.782  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.834   2.593   0.549  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.483   2.529   0.280  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.703   3.793   0.027  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.845   1.298   0.237  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.277   1.519   0.710  1.00  0.00           C  
HETATM   22  C   UNL     1       8.181   1.607   0.285  1.00  0.00           C  
HETATM   23  C   UNL     1       2.118   1.234   0.414  1.00  0.00           C  
HETATM   24  C   UNL     1       3.434   1.689  -0.060  1.00  0.00           C  
HETATM   25  N   UNL     1       6.809   1.389   0.762  1.00  0.00           N  
HETATM   26  N   UNL     1       1.028   2.005   0.222  1.00  0.00           N  
HETATM   27  C   UNL     1      -1.406   1.778  -0.303  1.00  0.00           C  
HETATM   28  C   UNL     1      -0.919   1.501  -1.704  1.00  0.00           C  
HETATM   29  C   UNL     1      -0.374   2.789  -2.314  1.00  0.00           C  
HETATM   30  C   UNL     1       1.030   3.071  -1.979  1.00  0.00           C  
HETATM   31  C   UNL     1       1.187   3.272  -0.454  1.00  0.00           C  
HETATM   32  N   UNL     1      -2.540   0.901  -0.001  1.00  0.00           N  
HETATM   33  N   UNL     1      -3.703  -0.916   0.375  1.00  0.00           N  
HETATM   34  N   UNL     1      -1.379  -1.242  -0.073  1.00  0.00           N  
HETATM   35  N   UNL     1       1.976  -4.967  -0.481  1.00  0.00           N  
HETATM   36  H   UNL     1       6.504   3.385   1.342  1.00  0.00           H  
HETATM   37  H   UNL     1       5.418   2.202   2.110  1.00  0.00           H  
HETATM   38  H   UNL     1       7.119   2.313   2.623  1.00  0.00           H  
HETATM   39  H   UNL     1       6.211   0.725  -1.140  1.00  0.00           H  
HETATM   40  H   UNL     1       5.769   2.406  -0.754  1.00  0.00           H  
HETATM   41  H   UNL     1       4.415  -0.023   0.632  1.00  0.00           H  
HETATM   42  H   UNL     1       1.076  -1.769  -0.534  1.00  0.00           H  
HETATM   43  H   UNL     1       3.043  -3.221  -0.827  1.00  0.00           H  
HETATM   44  H   UNL     1       0.968  -7.343   0.957  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.216  -7.406  -0.370  1.00  0.00           H  
HETATM   46  H   UNL     1       1.525  -7.501  -0.726  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.257  -5.298   0.213  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.514  -0.695   0.929  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.617   1.496   0.993  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.331   3.551   0.579  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.202   4.101   0.945  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.960   3.613  -0.749  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.383   4.581  -0.297  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.208   0.447   0.898  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.517   2.027   1.645  1.00  0.00           H  
HETATM   56  H   UNL     1       8.866   1.598   1.133  1.00  0.00           H  
HETATM   57  H   UNL     1       8.454   0.814  -0.411  1.00  0.00           H  
HETATM   58  H   UNL     1       8.242   2.571  -0.220  1.00  0.00           H  
HETATM   59  H   UNL     1       3.527   2.641  -0.563  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.725   2.818  -0.232  1.00  0.00           H  
HETATM   61  H   UNL     1      -0.129   0.751  -1.673  1.00  0.00           H  
HETATM   62  H   UNL     1      -1.746   1.133  -2.311  1.00  0.00           H  
HETATM   63  H   UNL     1      -0.465   2.724  -3.398  1.00  0.00           H  
HETATM   64  H   UNL     1      -0.986   3.622  -1.968  1.00  0.00           H  
HETATM   65  H   UNL     1       1.651   2.235  -2.300  1.00  0.00           H  
HETATM   66  H   UNL     1       0.429   3.971  -0.100  1.00  0.00           H  
HETATM   67  H   UNL     1      -0.527  -0.826  -0.278  1.00  0.00           H  
HETATM   68  H   UNL     1       1.350   3.975  -2.497  1.00  0.00           H  
HETATM   69  H   UNL     1       2.178   3.675  -0.242  1.00  0.00           H  
CONECT    1   25   36   37   38                                       
CONECT    2   25    3   39   40                                       
CONECT    3    2   24   24   41                                       
CONECT    4    7    7                                                 
CONECT    5   23   23                                                 
CONECT    6   32   34   33   33                                       
CONECT    7   34    8    4    4                                       
CONECT    8   13    7    9    9                                       
CONECT    9    8    8   10   42                                       
CONECT   10   35   35    9   43                                       
CONECT   11   12   13   13   35                                       
CONECT   12   11   44   45   46                                       
CONECT   13   11   11    8   47                                       
CONECT   14   20   20   15   33                                       
CONECT   15   16   16   14   48                                       
CONECT   16   17   15   15   49                                       
CONECT   17   18   18   16   50                                       
CONECT   18   19   17   17   20                                       
CONECT   19   18   51   52   53                                       
CONECT   20   18   32   14   14                                       
CONECT   21   27   26   54   55                                       
CONECT   22   25   56   57   58                                       
CONECT   23   24   26    5    5                                       
CONECT   24    3    3   23   59                                       
CONECT   25    1   22    2                                            
CONECT   26   31   23   21                                            
CONECT   27   28   32   21   60                                       
CONECT   28   29   27   61   62                                       
CONECT   29   30   28   63   64                                       
CONECT   30   29   31   65   68                                       
CONECT   31   30   26   66   69                                       
CONECT   32   27   20    6                                            
CONECT   33    6    6   14                                            
CONECT   34    6    7   67                                            
CONECT   35   11   10   10                                            
CONECT   36    1                                                      
CONECT   37    1                                                      
CONECT   38    1                                                      
CONECT   39    2                                                      
CONECT   40    2                                                      
CONECT   41    3                                                      
CONECT   42    9                                                      
CONECT   43   10                                                      
CONECT   44   12                                                      
CONECT   45   12                                                      
CONECT   46   12                                                      
CONECT   47   13                                                      
CONECT   48   15                                                      
CONECT   49   16                                                      
CONECT   50   17                                                      
CONECT   51   19                                                      
CONECT   52   19                                                      
CONECT   53   19                                                      
CONECT   54   21                                                      
CONECT   55   21                                                      
CONECT   56   22                                                      
CONECT   57   22                                                      
CONECT   58   22                                                      
CONECT   59   24                                                      
CONECT   60   27                                                      
CONECT   61   28                                                      
CONECT   62   28                                                      
CONECT   63   29                                                      
CONECT   64   29                                                      
CONECT   65   30                                                      
CONECT   66   31                                                      
CONECT   67   34                                                      
CONECT   68   30                                                      
CONECT   69   31                                                      
MASTER        0    0    0    0    0    0    0    0   69    0   69    0
END
