COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.037   1.326   0.088  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.298  -0.477   0.337  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.294  -0.519   1.674  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.429  -0.628  -0.734  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.036  -0.562  -0.810  1.00  0.00           C  
HETATM    6  C   UNL     1       4.675   0.047  -0.094  1.00  0.00           C  
HETATM    7  C   UNL     1       7.945  -1.598  -0.171  1.00  0.00           C  
HETATM    8  C   UNL     1       5.668  -0.918  -0.093  1.00  0.00           C  
HETATM    9  C   UNL     1       5.331  -2.261  -0.005  1.00  0.00           C  
HETATM   10  C   UNL     1       4.004  -2.641   0.082  1.00  0.00           C  
HETATM   11  C   UNL     1       3.008  -1.685   0.081  1.00  0.00           C  
HETATM   12  C   UNL     1       3.339  -0.334  -0.007  1.00  0.00           C  
HETATM   13  C   UNL     1       2.270   0.695  -0.001  1.00  0.00           C  
HETATM   14  C   UNL     1       0.932   0.323   0.086  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.795  -0.399   0.254  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.921  -0.455   1.577  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.065  -0.606   0.520  1.00  0.00           C  
HETATM   18  C   UNL     1      -7.660  -0.752  -1.057  1.00  0.00           C  
HETATM   19  C   UNL     1      -6.499  -0.723  -1.730  1.00  0.00           C  
HETATM   20  C   UNL     1       1.632   2.914  -0.067  1.00  0.00           C  
HETATM   21  N   UNL     1      -1.382   1.004   0.173  1.00  0.00           N  
HETATM   22  N   UNL     1      -7.420  -0.683   0.289  1.00  0.00           N  
HETATM   23  N   UNL     1       0.348   2.597   0.014  1.00  0.00           N  
HETATM   24  N   UNL     1       1.992   4.249  -0.143  1.00  0.00           N  
HETATM   25  N   UNL     1       2.579   1.990  -0.078  1.00  0.00           N  
HETATM   26  O   UNL     1       6.974  -0.550  -0.178  1.00  0.00           O  
HETATM   27  H   UNL     1      -5.770  -0.501   2.644  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.544  -0.578  -1.771  1.00  0.00           H  
HETATM   29  H   UNL     1       4.937   1.093  -0.158  1.00  0.00           H  
HETATM   30  H   UNL     1       8.944  -1.169  -0.244  1.00  0.00           H  
HETATM   31  H   UNL     1       7.861  -2.166   0.756  1.00  0.00           H  
HETATM   32  H   UNL     1       7.772  -2.260  -1.020  1.00  0.00           H  
HETATM   33  H   UNL     1       6.106  -3.013  -0.004  1.00  0.00           H  
HETATM   34  H   UNL     1       3.746  -3.687   0.149  1.00  0.00           H  
HETATM   35  H   UNL     1       1.972  -1.985   0.148  1.00  0.00           H  
HETATM   36  H   UNL     1       0.650  -0.718   0.150  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.359  -0.856   1.143  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.452  -0.931  -0.633  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.324  -0.388   2.474  1.00  0.00           H  
HETATM   40  H   UNL     1      -8.638  -0.819  -1.510  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.377  -0.762  -2.803  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.050   1.707   0.178  1.00  0.00           H  
HETATM   43  H   UNL     1      -8.104  -0.688   0.977  1.00  0.00           H  
HETATM   44  H   UNL     1       1.308   4.937  -0.136  1.00  0.00           H  
HETATM   45  H   UNL     1       2.928   4.496  -0.203  1.00  0.00           H  
CONECT    1   14   21   23   23                                       
CONECT    2   15    5    5   16                                       
CONECT    3   16   16   17   27                                       
CONECT    4    5   17   17   19                                       
CONECT    5    2    2    4   28                                       
CONECT    6    8   12   12   29                                       
CONECT    7   26   30   31   32                                       
CONECT    8   26    9    9    6                                       
CONECT    9    8    8   10   33                                       
CONECT   10    9   11   11   34                                       
CONECT   11   10   10   12   35                                       
CONECT   12    6    6   11   13                                       
CONECT   13   12   14   14   25                                       
CONECT   14   13   13    1   36                                       
CONECT   15   21    2   37   38                                       
CONECT   16    2    3    3   39                                       
CONECT   17    4    4    3   22                                       
CONECT   18   19   19   22   40                                       
CONECT   19    4   18   18   41                                       
CONECT   20   25   25   23   24                                       
CONECT   21    1   15   42                                            
CONECT   22   17   18   43                                            
CONECT   23    1    1   20                                            
CONECT   24   20   44   45                                            
CONECT   25   13   20   20                                            
CONECT   26    7    8                                                 
CONECT   27    3                                                      
CONECT   28    5                                                      
CONECT   29    6                                                      
CONECT   30    7                                                      
CONECT   31    7                                                      
CONECT   32    7                                                      
CONECT   33    9                                                      
CONECT   34   10                                                      
CONECT   35   11                                                      
CONECT   36   14                                                      
CONECT   37   15                                                      
CONECT   38   15                                                      
CONECT   39   16                                                      
CONECT   40   18                                                      
CONECT   41   19                                                      
CONECT   42   21                                                      
CONECT   43   22                                                      
CONECT   44   24                                                      
CONECT   45   24                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
