COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       3.524  -0.082   0.235  1.00  0.00           N  
HETATM    2  N   UNL     1       4.702   0.587   0.588  1.00  0.00           N  
HETATM    3  C   UNL     1       4.467   1.867   0.677  1.00  0.00           C  
HETATM    4  C   UNL     1       3.109   2.089   0.382  1.00  0.00           C  
HETATM    5  C   UNL     1       2.252   3.272   0.313  1.00  0.00           C  
HETATM    6  O   UNL     1       2.692   4.385   0.542  1.00  0.00           O  
HETATM    7  N   UNL     1       0.952   3.085  -0.015  1.00  0.00           N  
HETATM    8  C   UNL     1       0.483   1.837  -0.266  1.00  0.00           C  
HETATM    9  N   UNL     1       1.230   0.774  -0.209  1.00  0.00           N  
HETATM   10  C   UNL     1       2.533   0.839   0.105  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.971   1.675  -0.627  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.831   1.488   0.641  1.00  0.00           C  
HETATM   13  N   UNL     1      -2.857   0.476   0.329  1.00  0.00           N  
HETATM   14  C   UNL     1      -2.684   0.050  -1.076  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.199   0.353  -1.406  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.207   1.008   0.556  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.210  -0.113   0.466  1.00  0.00           C  
HETATM   18  N   UNL     1      -5.523  -0.783   1.557  1.00  0.00           N  
HETATM   19  C   UNL     1      -6.399  -1.773   1.517  1.00  0.00           C  
HETATM   20  C   UNL     1      -6.990  -2.102   0.307  1.00  0.00           C  
HETATM   21  C   UNL     1      -6.636  -1.375  -0.818  1.00  0.00           C  
HETATM   22  N   UNL     1      -5.755  -0.395  -0.700  1.00  0.00           N  
HETATM   23  C   UNL     1       3.385  -1.526   0.033  1.00  0.00           C  
HETATM   24  C   UNL     1       3.751  -2.261   1.326  1.00  0.00           C  
HETATM   25  C   UNL     1       3.678  -3.771   1.083  1.00  0.00           C  
HETATM   26  O   UNL     1       4.556  -4.122   0.011  1.00  0.00           O  
HETATM   27  C   UNL     1       4.234  -3.501  -1.235  1.00  0.00           C  
HETATM   28  C   UNL     1       4.327  -1.980  -1.086  1.00  0.00           C  
HETATM   29  C   UNL     1      -1.002   0.555  -2.910  1.00  0.00           C  
HETATM   30  H   UNL     1       5.190   2.627   0.934  1.00  0.00           H  
HETATM   31  H   UNL     1       0.353   3.846  -0.070  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.321   2.529  -1.207  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.206   1.142   1.465  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.307   2.432   0.909  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.886  -1.017  -1.176  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.340   0.624  -1.730  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.547  -0.436  -1.031  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.257   1.462   1.545  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.433   1.759  -0.201  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.651  -2.318   2.415  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.709  -2.905   0.243  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.075  -1.604  -1.778  1.00  0.00           H  
HETATM   43  H   UNL     1       2.355  -1.758  -0.240  1.00  0.00           H  
HETATM   44  H   UNL     1       4.762  -1.989   1.626  1.00  0.00           H  
HETATM   45  H   UNL     1       3.050  -1.984   2.114  1.00  0.00           H  
HETATM   46  H   UNL     1       3.980  -4.300   1.987  1.00  0.00           H  
HETATM   47  H   UNL     1       2.657  -4.049   0.822  1.00  0.00           H  
HETATM   48  H   UNL     1       4.935  -3.835  -2.000  1.00  0.00           H  
HETATM   49  H   UNL     1       3.220  -3.775  -1.526  1.00  0.00           H  
HETATM   50  H   UNL     1       4.038  -1.504  -2.023  1.00  0.00           H  
HETATM   51  H   UNL     1       5.350  -1.700  -0.835  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.633   1.376  -3.252  1.00  0.00           H  
HETATM   53  H   UNL     1       0.043   0.791  -3.111  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.276  -0.358  -3.438  1.00  0.00           H  
CONECT    1   23   10    2                                            
CONECT    2    1    3    3                                            
CONECT    3    2    2    4   30                                       
CONECT    4    3   10   10    5                                       
CONECT    5    4    7    6    6                                       
CONECT    6    5    5                                                 
CONECT    7    5    8   31                                            
CONECT    8    7   11    9    9                                       
CONECT    9    8    8   10                                            
CONECT   10    1    4    4    9                                       
CONECT   11    8   12   15   32                                       
CONECT   12   11   13   33   34                                       
CONECT   13   12   16   14                                            
CONECT   14   13   15   35   36                                       
CONECT   15   11   14   29   37                                       
CONECT   16   13   17   38   39                                       
CONECT   17   16   18   18   22                                       
CONECT   18   17   17   19                                            
CONECT   19   18   20   20   40                                       
CONECT   20   19   19   21   41                                       
CONECT   21   20   22   22   42                                       
CONECT   22   17   21   21                                            
CONECT   23    1   24   28   43                                       
CONECT   24   23   25   44   45                                       
CONECT   25   24   26   46   47                                       
CONECT   26   25   27                                                 
CONECT   27   26   28   48   49                                       
CONECT   28   23   27   50   51                                       
CONECT   29   15   52   53   54                                       
CONECT   30    3                                                      
CONECT   31    7                                                      
CONECT   32   11                                                      
CONECT   33   12                                                      
CONECT   34   12                                                      
CONECT   35   14                                                      
CONECT   36   14                                                      
CONECT   37   15                                                      
CONECT   38   16                                                      
CONECT   39   16                                                      
CONECT   40   19                                                      
CONECT   41   20                                                      
CONECT   42   21                                                      
CONECT   43   23                                                      
CONECT   44   24                                                      
CONECT   45   24                                                      
CONECT   46   25                                                      
CONECT   47   25                                                      
CONECT   48   27                                                      
CONECT   49   27                                                      
CONECT   50   28                                                      
CONECT   51   28                                                      
CONECT   52   29                                                      
CONECT   53   29                                                      
CONECT   54   29                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
