COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.172   2.039  -0.351  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.562   1.570  -0.295  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.200   2.869   0.203  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.401   0.398   0.147  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.295  -0.079   1.440  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.046  -1.278  -0.335  1.00  0.00           C  
HETATM    7  C   UNL     1       1.320   1.061   1.326  1.00  0.00           C  
HETATM    8  C   UNL     1       2.315  -0.062   1.015  1.00  0.00           C  
HETATM    9  C   UNL     1       3.579   0.539   0.396  1.00  0.00           C  
HETATM   10  C   UNL     1       3.221   1.243  -0.915  1.00  0.00           C  
HETATM   11  C   UNL     1       4.574  -0.559   0.120  1.00  0.00           C  
HETATM   12  C   UNL     1       5.198  -2.591  -0.967  1.00  0.00           C  
HETATM   13  O   UNL     1      -0.363   2.756  -1.314  1.00  0.00           O  
HETATM   14  N   UNL     1      -1.214   1.444   0.263  1.00  0.00           N  
HETATM   15  C   UNL     1      -4.062  -1.154   1.848  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.938  -1.754   0.964  1.00  0.00           C  
HETATM   17  O   UNL     1      -5.906  -1.866  -1.206  1.00  0.00           O  
HETATM   18  C   UNL     1      -6.669  -2.972  -0.719  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.278  -0.195  -0.740  1.00  0.00           C  
HETATM   20  N   UNL     1       1.082   1.834   0.099  1.00  0.00           N  
HETATM   21  C   UNL     1       2.236   2.381  -0.627  1.00  0.00           C  
HETATM   22  C   UNL     1       4.260  -1.602  -0.738  1.00  0.00           C  
HETATM   23  N   UNL     1       6.378  -2.551  -0.379  1.00  0.00           N  
HETATM   24  C   UNL     1       6.712  -1.572   0.438  1.00  0.00           C  
HETATM   25  C   UNL     1       5.826  -0.548   0.715  1.00  0.00           C  
HETATM   26  H   UNL     1      -2.505   1.587  -1.383  1.00  0.00           H  
HETATM   27  H   UNL     1      -4.204   2.963  -0.212  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.257   2.852   1.291  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.594   3.717  -0.116  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.611   0.389   2.133  1.00  0.00           H  
HETATM   31  H   UNL     1       0.381   0.631   1.675  1.00  0.00           H  
HETATM   32  H   UNL     1       1.734   1.714   2.095  1.00  0.00           H  
HETATM   33  H   UNL     1       2.574  -0.583   1.937  1.00  0.00           H  
HETATM   34  H   UNL     1       1.864  -0.764   0.314  1.00  0.00           H  
HETATM   35  H   UNL     1       4.016   1.259   1.087  1.00  0.00           H  
HETATM   36  H   UNL     1       4.125   1.650  -1.368  1.00  0.00           H  
HETATM   37  H   UNL     1       2.761   0.529  -1.598  1.00  0.00           H  
HETATM   38  H   UNL     1       4.959  -3.409  -1.630  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.071   0.932   1.074  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.978  -1.525   2.859  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.537  -2.594   1.283  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.994  -3.764  -0.394  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.281  -2.648   0.123  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.314  -3.347  -1.513  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.364   0.181  -1.749  1.00  0.00           H  
HETATM   46  H   UNL     1       2.725   3.141  -0.017  1.00  0.00           H  
HETATM   47  H   UNL     1       1.902   2.822  -1.566  1.00  0.00           H  
HETATM   48  H   UNL     1       3.295  -1.641  -1.222  1.00  0.00           H  
HETATM   49  H   UNL     1       7.688  -1.573   0.901  1.00  0.00           H  
HETATM   50  H   UNL     1       6.106   0.252   1.385  1.00  0.00           H  
CONECT    1   14   13   13   20                                       
CONECT    2    3    4   14   26                                       
CONECT    3    2   27   28   29                                       
CONECT    4    5    2   19   19                                       
CONECT    5   15   15    4   30                                       
CONECT    6   16   16   19   17                                       
CONECT    7    8   20   31   32                                       
CONECT    8    7    9   33   34                                       
CONECT    9    8   11   10   35                                       
CONECT   10    9   21   36   37                                       
CONECT   11   22    9   25   25                                       
CONECT   12   22   22   23   38                                       
CONECT   13    1    1                                                 
CONECT   14    2    1   39                                            
CONECT   15    5    5   16   40                                       
CONECT   16   15    6    6   41                                       
CONECT   17    6   18                                                 
CONECT   18   17   42   43   44                                       
CONECT   19    4    4    6   45                                       
CONECT   20    7    1   21                                            
CONECT   21   20   10   46   47                                       
CONECT   22   12   12   11   48                                       
CONECT   23   12   24   24                                            
CONECT   24   23   23   25   49                                       
CONECT   25   11   11   24   50                                       
CONECT   26    2                                                      
CONECT   27    3                                                      
CONECT   28    3                                                      
CONECT   29    3                                                      
CONECT   30    5                                                      
CONECT   31    7                                                      
CONECT   32    7                                                      
CONECT   33    8                                                      
CONECT   34    8                                                      
CONECT   35    9                                                      
CONECT   36   10                                                      
CONECT   37   10                                                      
CONECT   38   12                                                      
CONECT   39   14                                                      
CONECT   40   15                                                      
CONECT   41   16                                                      
CONECT   42   18                                                      
CONECT   43   18                                                      
CONECT   44   18                                                      
CONECT   45   19                                                      
CONECT   46   21                                                      
CONECT   47   21                                                      
CONECT   48   22                                                      
CONECT   49   24                                                      
CONECT   50   25                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
