COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.408  -4.659  -1.040  1.00  0.00           C  
HETATM    2  O   UNL     1       6.150  -5.518  -1.758  1.00  0.00           O  
HETATM    3  C   UNL     1       5.812  -3.210  -0.948  1.00  0.00           C  
HETATM    4  O   UNL     1       4.271  -0.724   2.225  1.00  0.00           O  
HETATM    5  C   UNL     1       4.806  -2.455  -0.078  1.00  0.00           C  
HETATM    6  O   UNL     1      -4.936   1.967  -0.808  1.00  0.00           O  
HETATM    7  C   UNL     1       5.215  -0.984   0.016  1.00  0.00           C  
HETATM    8  O   UNL     1      -7.046  -2.612  -0.568  1.00  0.00           O  
HETATM    9  C   UNL     1       4.209  -0.228   0.886  1.00  0.00           C  
HETATM   10  O   UNL     1      -3.504  -0.477  -0.317  1.00  0.00           O  
HETATM   11  C   UNL     1       4.542   1.242   0.879  1.00  0.00           C  
HETATM   12  C   UNL     1       3.653   2.122   0.430  1.00  0.00           C  
HETATM   13  C   UNL     1       3.978   3.556   0.423  1.00  0.00           C  
HETATM   14  C   UNL     1       3.133   4.426  -0.119  1.00  0.00           C  
HETATM   15  O   UNL     1       4.415  -5.047  -0.473  1.00  0.00           O  
HETATM   16  C   UNL     1       1.782   3.964  -0.602  1.00  0.00           C  
HETATM   17  C   UNL     1       0.690   4.818   0.044  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.664   4.279  -0.342  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.294   3.430   0.463  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.615   2.903   0.087  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.246   2.054   0.891  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.599   1.515   0.506  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.563  -0.015   0.525  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.897  -0.563   0.013  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.831  -2.093  -0.022  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.651  -2.523  -0.899  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.365  -1.899  -0.351  1.00  0.00           C  
HETATM   28  C   UNL     1      -3.110  -2.412   1.042  1.00  0.00           C  
HETATM   29  C   UNL     1      -2.007  -3.068   1.308  1.00  0.00           C  
HETATM   30  C   UNL     1      -1.753  -3.582   2.701  1.00  0.00           C  
HETATM   31  C   UNL     1       5.270   4.040   1.031  1.00  0.00           C  
HETATM   32  C   UNL     1       1.708   4.106  -2.124  1.00  0.00           C  
HETATM   33  C   UNL     1      -1.302   4.702  -1.639  1.00  0.00           C  
HETATM   34  C   UNL     1      -4.529  -4.048  -0.880  1.00  0.00           C  
HETATM   35  H   UNL     1       5.851  -6.437  -1.787  1.00  0.00           H  
HETATM   36  H   UNL     1       6.804  -3.137  -0.503  1.00  0.00           H  
HETATM   37  H   UNL     1       5.828  -2.773  -1.947  1.00  0.00           H  
HETATM   38  H   UNL     1       5.138  -0.626   2.641  1.00  0.00           H  
HETATM   39  H   UNL     1       3.813  -2.528  -0.523  1.00  0.00           H  
HETATM   40  H   UNL     1       4.789  -2.891   0.921  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.312   1.688  -1.492  1.00  0.00           H  
HETATM   42  H   UNL     1       6.208  -0.910   0.461  1.00  0.00           H  
HETATM   43  H   UNL     1       5.232  -0.547  -0.983  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.837  -2.372  -0.066  1.00  0.00           H  
HETATM   45  H   UNL     1       3.204  -0.375   0.491  1.00  0.00           H  
HETATM   46  H   UNL     1       5.503   1.579   1.238  1.00  0.00           H  
HETATM   47  H   UNL     1       2.692   1.784   0.071  1.00  0.00           H  
HETATM   48  H   UNL     1       3.414   5.465  -0.214  1.00  0.00           H  
HETATM   49  H   UNL     1       1.637   2.919  -0.327  1.00  0.00           H  
HETATM   50  H   UNL     1       0.798   4.787   1.128  1.00  0.00           H  
HETATM   51  H   UNL     1       0.782   5.848  -0.301  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.837   3.126   1.393  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.073   3.207  -0.844  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.789   1.751   1.821  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.347   1.869   1.215  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.394  -0.362   1.544  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.700  -0.248   0.678  1.00  0.00           H  
HETATM   58  H   UNL     1      -6.085  -0.184  -0.992  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.694  -2.476   0.989  1.00  0.00           H  
HETATM   60  H   UNL     1      -4.814  -2.183  -1.921  1.00  0.00           H  
HETATM   61  H   UNL     1      -2.528  -2.166  -0.996  1.00  0.00           H  
HETATM   62  H   UNL     1      -3.837  -2.241   1.822  1.00  0.00           H  
HETATM   63  H   UNL     1      -1.281  -3.240   0.528  1.00  0.00           H  
HETATM   64  H   UNL     1      -0.793  -4.097   2.729  1.00  0.00           H  
HETATM   65  H   UNL     1      -1.737  -2.745   3.400  1.00  0.00           H  
HETATM   66  H   UNL     1      -2.546  -4.275   2.983  1.00  0.00           H  
HETATM   67  H   UNL     1       6.050   4.045   0.269  1.00  0.00           H  
HETATM   68  H   UNL     1       5.134   5.049   1.419  1.00  0.00           H  
HETATM   69  H   UNL     1       5.560   3.374   1.843  1.00  0.00           H  
HETATM   70  H   UNL     1       2.486   3.498  -2.584  1.00  0.00           H  
HETATM   71  H   UNL     1       0.731   3.772  -2.473  1.00  0.00           H  
HETATM   72  H   UNL     1       1.854   5.151  -2.398  1.00  0.00           H  
HETATM   73  H   UNL     1      -1.005   4.015  -2.432  1.00  0.00           H  
HETATM   74  H   UNL     1      -2.386   4.687  -1.533  1.00  0.00           H  
HETATM   75  H   UNL     1      -0.976   5.711  -1.892  1.00  0.00           H  
HETATM   76  H   UNL     1      -5.447  -4.491  -1.265  1.00  0.00           H  
HETATM   77  H   UNL     1      -3.688  -4.353  -1.504  1.00  0.00           H  
HETATM   78  H   UNL     1      -4.363  -4.387   0.143  1.00  0.00           H  
CONECT    1   15   15    2    3                                       
CONECT    2    1   35                                                 
CONECT    3    1    5   36   37                                       
CONECT    4    9   38                                                 
CONECT    5    3    7   39   40                                       
CONECT    6   22   41                                                 
CONECT    7    5    9   42   43                                       
CONECT    8   25   44                                                 
CONECT    9    4    7   11   45                                       
CONECT   10   23   27                                                 
CONECT   11    9   12   12   46                                       
CONECT   12   11   11   13   47                                       
CONECT   13   12   31   14   14                                       
CONECT   14   13   13   16   48                                       
CONECT   15    1    1                                                 
CONECT   16   14   17   32   49                                       
CONECT   17   16   18   50   51                                       
CONECT   18   17   33   19   19                                       
CONECT   19   18   18   20   52                                       
CONECT   20   19   21   21   53                                       
CONECT   21   20   20   22   54                                       
CONECT   22    6   21   23   55                                       
CONECT   23   10   22   24   56                                       
CONECT   24   23   25   57   58                                       
CONECT   25    8   24   26   59                                       
CONECT   26   25   27   34   60                                       
CONECT   27   10   26   28   61                                       
CONECT   28   27   29   29   62                                       
CONECT   29   28   28   30   63                                       
CONECT   30   29   64   65   66                                       
CONECT   31   13   67   68   69                                       
CONECT   32   16   70   71   72                                       
CONECT   33   18   73   74   75                                       
CONECT   34   26   76   77   78                                       
CONECT   35    2                                                      
CONECT   36    3                                                      
CONECT   37    3                                                      
CONECT   38    4                                                      
CONECT   39    5                                                      
CONECT   40    5                                                      
CONECT   41    6                                                      
CONECT   42    7                                                      
CONECT   43    7                                                      
CONECT   44    8                                                      
CONECT   45    9                                                      
CONECT   46   11                                                      
CONECT   47   12                                                      
CONECT   48   14                                                      
CONECT   49   16                                                      
CONECT   50   17                                                      
CONECT   51   17                                                      
CONECT   52   19                                                      
CONECT   53   20                                                      
CONECT   54   21                                                      
CONECT   55   22                                                      
CONECT   56   23                                                      
CONECT   57   24                                                      
CONECT   58   24                                                      
CONECT   59   25                                                      
CONECT   60   26                                                      
CONECT   61   27                                                      
CONECT   62   28                                                      
CONECT   63   29                                                      
CONECT   64   30                                                      
CONECT   65   30                                                      
CONECT   66   30                                                      
CONECT   67   31                                                      
CONECT   68   31                                                      
CONECT   69   31                                                      
CONECT   70   32                                                      
CONECT   71   32                                                      
CONECT   72   32                                                      
CONECT   73   33                                                      
CONECT   74   33                                                      
CONECT   75   33                                                      
CONECT   76   34                                                      
CONECT   77   34                                                      
CONECT   78   34                                                      
MASTER        0    0    0    0    0    0    0    0   78    0   78    0
END
