COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.922  -0.302   1.297  1.00  0.00           C  
HETATM    2  N   UNL     1       1.447   1.167  -0.142  1.00  0.00           N  
HETATM    3  C   UNL     1       0.200   0.599   0.049  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.839   2.282   1.600  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.419   4.138  -0.025  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.097   4.823  -0.041  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.658   3.771   0.741  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.291  -1.678   0.142  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.536  -2.033   0.917  1.00  0.00           C  
HETATM   10  C   UNL     1       1.340  -0.715  -1.302  1.00  0.00           C  
HETATM   11  C   UNL     1       3.520   0.516  -1.497  1.00  0.00           C  
HETATM   12  C   UNL     1       4.484  -0.235  -0.617  1.00  0.00           C  
HETATM   13  C   UNL     1       4.814  -1.544  -0.915  1.00  0.00           C  
HETATM   14  C   UNL     1       5.689  -2.240  -0.102  1.00  0.00           C  
HETATM   15  C   UNL     1       6.250  -1.617   1.003  1.00  0.00           C  
HETATM   16  C   UNL     1       5.038   0.385   0.488  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.901   1.004   0.804  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.318   3.428   0.748  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.858   5.193  -0.803  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.197   5.536  -0.810  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.056  -0.858   0.118  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.388  -1.268   0.898  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.599  -3.210   0.185  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.510  -3.619  -0.574  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.360  -2.859  -0.597  1.00  0.00           C  
HETATM   26  C   UNL     1      -0.965  -1.270  -0.636  1.00  0.00           C  
HETATM   27  N   UNL     1       2.154   0.318  -1.007  1.00  0.00           N  
HETATM   28  N   UNL     1      -1.996   0.271   0.821  1.00  0.00           N  
HETATM   29  N   UNL     1       0.146  -0.534  -0.658  1.00  0.00           N1+
HETATM   30  O   UNL     1       1.618  -1.650  -2.028  1.00  0.00           O  
HETATM   31  O   UNL     1       7.120  -2.296   1.798  1.00  0.00           O  
HETATM   32  O   UNL     1      -6.731  -3.962   0.206  1.00  0.00           O  
HETATM   33  H   UNL     1       6.353   0.183   2.160  1.00  0.00           H  
HETATM   34  H   UNL     1       1.770   1.997   0.244  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.475   2.192   2.481  1.00  0.00           H  
HETATM   36  H   UNL     1       0.189   2.466   1.912  1.00  0.00           H  
HETATM   37  H   UNL     1       0.627   3.871  -0.019  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.144   5.090  -0.047  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.361   3.214   1.342  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.386  -1.715   1.503  1.00  0.00           H  
HETATM   41  H   UNL     1       3.762   1.579  -1.477  1.00  0.00           H  
HETATM   42  H   UNL     1       3.596   0.146  -2.520  1.00  0.00           H  
HETATM   43  H   UNL     1       4.381  -2.027  -1.778  1.00  0.00           H  
HETATM   44  H   UNL     1       5.946  -3.262  -0.335  1.00  0.00           H  
HETATM   45  H   UNL     1       4.778   1.408   0.718  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.155   5.750  -1.404  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.541   6.358  -1.421  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.339  -0.352   1.468  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.564  -4.534  -1.146  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.513  -3.177  -1.187  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.016  -2.187  -1.205  1.00  0.00           H  
HETATM   52  H   UNL     1       6.698  -2.771   2.527  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.369  -3.731  -0.482  1.00  0.00           H  
CONECT    1   15   15   16   33                                       
CONECT    2    3   27   34                                            
CONECT    3   17    2   29   29                                       
CONECT    4   18   17   35   36                                       
CONECT    5   18   18   19   37                                       
CONECT    6    7    7   20   38                                       
CONECT    7    6    6   18   39                                       
CONECT    8   25   21   22   22                                       
CONECT    9   23   23   22   40                                       
CONECT   10   29   27   30   30                                       
CONECT   11   12   27   41   42                                       
CONECT   12   16   16   13   11                                       
CONECT   13   14   14   12   43                                       
CONECT   14   15   13   13   44                                       
CONECT   15   31    1    1   14                                       
CONECT   16    1   12   12   45                                       
CONECT   17    4   28   28    3                                       
CONECT   18    7    4    5    5                                       
CONECT   19   20   20    5   46                                       
CONECT   20    6   19   19   47                                       
CONECT   21   28    8   26   26                                       
CONECT   22    8    8    9   48                                       
CONECT   23   24   32    9    9                                       
CONECT   24   25   25   23   49                                       
CONECT   25   24   24    8   50                                       
CONECT   26   21   21   29   51                                       
CONECT   27    2   10   11                                            
CONECT   28   17   17   21                                            
CONECT   29    3    3   26   10                                       
CONECT   30   10   10                                                 
CONECT   31   15   52                                                 
CONECT   32   23   53                                                 
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    4                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    7                                                      
CONECT   40    9                                                      
CONECT   41   11                                                      
CONECT   42   11                                                      
CONECT   43   13                                                      
CONECT   44   14                                                      
CONECT   45   16                                                      
CONECT   46   19                                                      
CONECT   47   20                                                      
CONECT   48   22                                                      
CONECT   49   24                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   31                                                      
CONECT   53   32                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
