COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.137  -1.144   0.090  1.00  0.00           C  
HETATM    2  C   UNL     1       4.459  -0.703   0.047  1.00  0.00           C  
HETATM    3  C   UNL     1       1.940  -0.308   0.292  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.062   0.064  -0.150  1.00  0.00           C  
HETATM    5  N   UNL     1      -5.113   0.905  -0.071  1.00  0.00           N  
HETATM    6  C   UNL     1      -2.685   0.602  -0.159  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.308   0.247  -0.254  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.470   1.980  -0.080  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.184   2.479  -0.089  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.105   1.620  -0.176  1.00  0.00           C  
HETATM   11  C   UNL     1      -6.649  -0.802   0.677  1.00  0.00           C  
HETATM   12  C   UNL     1      -7.933  -1.304   0.758  1.00  0.00           C  
HETATM   13  C   UNL     1       8.102   1.469  -0.591  1.00  0.00           C  
HETATM   14  C   UNL     1       4.924   0.691   0.200  1.00  0.00           C  
HETATM   15  N   UNL     1       6.240   0.973   0.135  1.00  0.00           N  
HETATM   16  O   UNL     1       4.119   1.583   0.384  1.00  0.00           O  
HETATM   17  N   UNL     1       3.162  -2.490  -0.094  1.00  0.00           N  
HETATM   18  N   UNL     1       4.495  -2.885  -0.252  1.00  0.00           N  
HETATM   19  C   UNL     1       5.267  -1.832  -0.169  1.00  0.00           C  
HETATM   20  N   UNL     1       0.788  -0.618  -0.336  1.00  0.00           N  
HETATM   21  O   UNL     1       1.991   0.661   1.024  1.00  0.00           O  
HETATM   22  C   UNL     1      -1.596  -0.265  -0.240  1.00  0.00           C  
HETATM   23  O   UNL     1      -4.247  -1.135  -0.213  1.00  0.00           O  
HETATM   24  C   UNL     1      -6.412   0.394   0.012  1.00  0.00           C  
HETATM   25  C   UNL     1       1.995  -3.375  -0.122  1.00  0.00           C  
HETATM   26  C   UNL     1      -7.469   1.081  -0.572  1.00  0.00           C  
HETATM   27  C   UNL     1      -8.751   0.573  -0.488  1.00  0.00           C  
HETATM   28  C   UNL     1      -8.982  -0.620   0.171  1.00  0.00           C  
HETATM   29  C   UNL     1       7.461   0.170  -0.069  1.00  0.00           C  
HETATM   30  C   UNL     1       7.039   2.210   0.241  1.00  0.00           C  
HETATM   31  H   UNL     1      -4.968   1.864  -0.072  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.311   2.654  -0.013  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.020   3.545  -0.029  1.00  0.00           H  
HETATM   34  H   UNL     1       0.900   2.017  -0.186  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.830  -1.337   1.136  1.00  0.00           H  
HETATM   36  H   UNL     1      -8.118  -2.231   1.279  1.00  0.00           H  
HETATM   37  H   UNL     1       9.122   1.628  -0.241  1.00  0.00           H  
HETATM   38  H   UNL     1       7.994   1.611  -1.666  1.00  0.00           H  
HETATM   39  H   UNL     1       6.343  -1.832  -0.254  1.00  0.00           H  
HETATM   40  H   UNL     1       0.719  -1.442  -0.844  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.756  -1.332  -0.296  1.00  0.00           H  
HETATM   42  H   UNL     1       1.691  -3.543  -1.156  1.00  0.00           H  
HETATM   43  H   UNL     1       2.250  -4.328   0.340  1.00  0.00           H  
HETATM   44  H   UNL     1       1.175  -2.913   0.427  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.288   2.011  -1.090  1.00  0.00           H  
HETATM   46  H   UNL     1      -9.573   1.107  -0.941  1.00  0.00           H  
HETATM   47  H   UNL     1      -9.985  -1.015   0.235  1.00  0.00           H  
HETATM   48  H   UNL     1       7.356  -0.604  -0.830  1.00  0.00           H  
HETATM   49  H   UNL     1       7.905  -0.198   0.856  1.00  0.00           H  
HETATM   50  H   UNL     1       7.359   2.441   1.257  1.00  0.00           H  
HETATM   51  H   UNL     1       6.596   3.064  -0.271  1.00  0.00           H  
CONECT    1   17    2    2    3                                       
CONECT    2   14    1    1   19                                       
CONECT    3    1   20   21   21                                       
CONECT    4    6    5   23   23                                       
CONECT    5    4   24   31                                            
CONECT    6    4   22   22    8                                       
CONECT    7   20   22   10   10                                       
CONECT    8    6    9    9   32                                       
CONECT    9    8    8   10   33                                       
CONECT   10    7    7    9   34                                       
CONECT   11   24   12   12   35                                       
CONECT   12   11   11   28   36                                       
CONECT   13   29   30   37   38                                       
CONECT   14   15   16   16    2                                       
CONECT   15   14   30   29                                            
CONECT   16   14   14                                                 
CONECT   17    1   25   18                                            
CONECT   18   17   19   19                                            
CONECT   19    2   18   18   39                                       
CONECT   20    3    7   40                                            
CONECT   21    3    3                                                 
CONECT   22    6    6    7   41                                       
CONECT   23    4    4                                                 
CONECT   24    5   26   26   11                                       
CONECT   25   17   42   43   44                                       
CONECT   26   24   24   27   45                                       
CONECT   27   26   28   28   46                                       
CONECT   28   27   27   12   47                                       
CONECT   29   15   13   48   49                                       
CONECT   30   15   13   50   51                                       
CONECT   31    5                                                      
CONECT   32    8                                                      
CONECT   33    9                                                      
CONECT   34   10                                                      
CONECT   35   11                                                      
CONECT   36   12                                                      
CONECT   37   13                                                      
CONECT   38   13                                                      
CONECT   39   19                                                      
CONECT   40   20                                                      
CONECT   41   22                                                      
CONECT   42   25                                                      
CONECT   43   25                                                      
CONECT   44   25                                                      
CONECT   45   26                                                      
CONECT   46   27                                                      
CONECT   47   28                                                      
CONECT   48   29                                                      
CONECT   49   29                                                      
CONECT   50   30                                                      
CONECT   51   30                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
