COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.158  -1.439  -1.462  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.434  -0.765  -1.975  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.236  -0.231  -0.785  1.00  0.00           C  
HETATM    4  N   UNL     1      -6.419   0.733  -0.036  1.00  0.00           N  
HETATM    5  C   UNL     1      -5.212   0.097   0.506  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.350  -0.428  -0.645  1.00  0.00           C  
HETATM    7  N   UNL     1      -3.155  -1.081  -0.103  1.00  0.00           N  
HETATM    8  C   UNL     1      -2.036  -0.328   0.210  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.931  -0.938   0.825  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.955  -2.410   1.145  1.00  0.00           C  
HETATM   11  N   UNL     1      -2.009   0.963  -0.075  1.00  0.00           N  
HETATM   12  C   UNL     1      -0.936   1.711   0.220  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.653   3.057   0.034  1.00  0.00           C  
HETATM   14  C   UNL     1       0.622   3.292   0.534  1.00  0.00           C  
HETATM   15  N   UNL     1       1.109   2.167   1.004  1.00  0.00           N  
HETATM   16  N   UNL     1       0.160   1.154   0.824  1.00  0.00           N  
HETATM   17  C   UNL     1       0.166  -0.184   1.128  1.00  0.00           C  
HETATM   18  N   UNL     1       1.265  -0.760   1.732  1.00  0.00           N  
HETATM   19  C   UNL     1       2.519  -0.692   1.114  1.00  0.00           C  
HETATM   20  C   UNL     1       3.649  -1.139   1.785  1.00  0.00           C  
HETATM   21  C   UNL     1       4.886  -1.072   1.175  1.00  0.00           C  
HETATM   22  C   UNL     1       2.632  -0.183  -0.173  1.00  0.00           C  
HETATM   23  C   UNL     1       3.870  -0.116  -0.782  1.00  0.00           C  
HETATM   24  C   UNL     1       5.000  -0.558  -0.109  1.00  0.00           C  
HETATM   25  O   UNL     1       6.218  -0.492  -0.709  1.00  0.00           O  
HETATM   26  C   UNL     1       6.261   0.048  -2.031  1.00  0.00           C  
HETATM   27  C   UNL     1       7.705   0.042  -2.538  1.00  0.00           C  
HETATM   28  H   UNL     1      -5.423  -2.289  -0.832  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.563  -1.783  -2.308  1.00  0.00           H  
HETATM   30  H   UNL     1      -6.170   0.060  -2.636  1.00  0.00           H  
HETATM   31  H   UNL     1      -7.035  -1.492  -2.521  1.00  0.00           H  
HETATM   32  H   UNL     1      -8.138   0.262  -1.148  1.00  0.00           H  
HETATM   33  H   UNL     1      -7.512  -1.059  -0.132  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.182   1.529  -0.609  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.643   0.827   1.081  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.497  -0.733   1.153  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.052   0.402  -1.285  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.148  -2.041   0.036  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.869  -2.853   0.750  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.090  -2.895   0.691  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.923  -2.547   2.226  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.305   3.790  -0.418  1.00  0.00           H  
HETATM   43  H   UNL     1       1.130   4.245   0.535  1.00  0.00           H  
HETATM   44  H   UNL     1       1.168  -1.211   2.585  1.00  0.00           H  
HETATM   45  H   UNL     1       3.561  -1.539   2.785  1.00  0.00           H  
HETATM   46  H   UNL     1       5.765  -1.420   1.697  1.00  0.00           H  
HETATM   47  H   UNL     1       1.753   0.161  -0.697  1.00  0.00           H  
HETATM   48  H   UNL     1       3.959   0.280  -1.783  1.00  0.00           H  
HETATM   49  H   UNL     1       5.641  -0.558  -2.692  1.00  0.00           H  
HETATM   50  H   UNL     1       5.885   1.071  -2.018  1.00  0.00           H  
HETATM   51  H   UNL     1       8.325   0.648  -1.877  1.00  0.00           H  
HETATM   52  H   UNL     1       8.080  -0.981  -2.551  1.00  0.00           H  
HETATM   53  H   UNL     1       7.738   0.454  -3.546  1.00  0.00           H  
CONECT    1    2    6   28   29                                       
CONECT    2    1    3   30   31                                       
CONECT    3    2    4   32   33                                       
CONECT    4    3    5   34                                            
CONECT    5    4    6   35   36                                       
CONECT    6    1    5    7   37                                       
CONECT    7    6    8   38                                            
CONECT    8    7    9   11   11                                       
CONECT    9    8   10   17   17                                       
CONECT   10    9   39   40   41                                       
CONECT   11    8    8   12                                            
CONECT   12   11   13   13   16                                       
CONECT   13   12   12   14   42                                       
CONECT   14   13   15   15   43                                       
CONECT   15   14   14   16                                            
CONECT   16   12   15   17                                            
CONECT   17    9    9   16   18                                       
CONECT   18   17   19   44                                            
CONECT   19   18   20   20   22                                       
CONECT   20   19   19   21   45                                       
CONECT   21   20   24   24   46                                       
CONECT   22   19   23   23   47                                       
CONECT   23   22   22   24   48                                       
CONECT   24   21   21   23   25                                       
CONECT   25   24   26                                                 
CONECT   26   25   27   49   50                                       
CONECT   27   26   51   52   53                                       
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    2                                                      
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38    7                                                      
CONECT   39   10                                                      
CONECT   40   10                                                      
CONECT   41   10                                                      
CONECT   42   13                                                      
CONECT   43   14                                                      
CONECT   44   18                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   22                                                      
CONECT   48   23                                                      
CONECT   49   26                                                      
CONECT   50   26                                                      
CONECT   51   27                                                      
CONECT   52   27                                                      
CONECT   53   27                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
