COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.026  -0.023   1.075  1.00  0.00           C  
HETATM    2  C   UNL     1       5.891   1.190   0.667  1.00  0.00           C  
HETATM    3  C   UNL     1       4.862   2.306   0.383  1.00  0.00           C  
HETATM    4  C   UNL     1       3.496   1.636   0.653  1.00  0.00           C  
HETATM    5  C   UNL     1       2.452   2.132  -0.350  1.00  0.00           C  
HETATM    6  O   UNL     1       3.737   0.224   0.472  1.00  0.00           O  
HETATM    7  O   UNL     1       5.062   3.409   1.270  1.00  0.00           O  
HETATM    8  O   UNL     1       1.173   1.591  -0.012  1.00  0.00           O  
HETATM    9  P   UNL     1      -0.162   1.903  -0.856  1.00  0.00           P  
HETATM   10  O   UNL     1      -0.017   1.287  -2.336  1.00  0.00           O  
HETATM   11  O   UNL     1      -0.355   3.367  -0.948  1.00  0.00           O  
HETATM   12  O   UNL     1      -1.430   1.239  -0.120  1.00  0.00           O  
HETATM   13  N   UNL     1       5.605  -1.263   0.550  1.00  0.00           N  
HETATM   14  N   UNL     1       6.247  -2.562  -1.289  1.00  0.00           N  
HETATM   15  C   UNL     1       6.553  -3.379   0.933  1.00  0.00           C  
HETATM   16  C   UNL     1       6.019  -2.237   1.416  1.00  0.00           C  
HETATM   17  C   UNL     1       5.720  -1.434  -0.780  1.00  0.00           C  
HETATM   18  O   UNL     1       5.340  -0.557  -1.532  1.00  0.00           O  
HETATM   19  C   UNL     1       6.672  -3.544  -0.468  1.00  0.00           C  
HETATM   20  O   UNL     1       7.150  -4.566  -0.928  1.00  0.00           O  
HETATM   21  O   UNL     1       6.759   1.568   1.737  1.00  0.00           O  
HETATM   22  P   UNL     1      -3.024   1.423  -0.254  1.00  0.00           P  
HETATM   23  O   UNL     1      -3.417   2.951   0.069  1.00  0.00           O  
HETATM   24  O   UNL     1      -3.445   1.086  -1.632  1.00  0.00           O  
HETATM   25  O   UNL     1      -5.705  -0.110  -0.581  1.00  0.00           O  
HETATM   26  C   UNL     1      -5.302  -1.464  -0.794  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.011  -2.371   0.215  1.00  0.00           C  
HETATM   28  C   UNL     1      -5.679  -1.901   1.635  1.00  0.00           C  
HETATM   29  C   UNL     1      -6.089  -0.433   1.783  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.377   0.400   0.714  1.00  0.00           C  
HETATM   31  O   UNL     1      -7.423  -2.303   0.008  1.00  0.00           O  
HETATM   32  O   UNL     1      -6.394  -2.696   2.582  1.00  0.00           O  
HETATM   33  O   UNL     1      -5.718   0.038   3.080  1.00  0.00           O  
HETATM   34  C   UNL     1      -3.865   0.317   0.927  1.00  0.00           C  
HETATM   35  C   UNL     1      -5.677  -1.890  -2.214  1.00  0.00           C  
HETATM   36  O   UNL     1      -4.927  -1.120  -3.156  1.00  0.00           O  
HETATM   37  H   UNL     1       4.934  -0.076   2.159  1.00  0.00           H  
HETATM   38  H   UNL     1       6.467   0.964  -0.231  1.00  0.00           H  
HETATM   39  H   UNL     1       4.930   2.634  -0.654  1.00  0.00           H  
HETATM   40  H   UNL     1       3.169   1.839   1.673  1.00  0.00           H  
HETATM   41  H   UNL     1       2.406   3.220  -0.318  1.00  0.00           H  
HETATM   42  H   UNL     1       2.730   1.809  -1.353  1.00  0.00           H  
HETATM   43  H   UNL     1       5.929   3.830   1.184  1.00  0.00           H  
HETATM   44  H   UNL     1       0.113   0.329  -2.353  1.00  0.00           H  
HETATM   45  H   UNL     1       6.885  -4.156   1.605  1.00  0.00           H  
HETATM   46  H   UNL     1       5.921  -2.093   2.482  1.00  0.00           H  
HETATM   47  H   UNL     1       7.325   2.326   1.535  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.170   3.241   0.957  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.223  -1.547  -0.662  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.672  -3.399   0.083  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.607  -2.000   1.811  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.168  -0.342   1.658  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.699   1.439   0.788  1.00  0.00           H  
HETATM   54  H   UNL     1      -7.705  -2.583  -0.873  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.188  -3.639   2.539  1.00  0.00           H  
HETATM   56  H   UNL     1      -6.129  -0.448   3.808  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.530  -0.708   0.766  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.624   0.622   1.945  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.450  -2.948  -2.348  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.742  -1.724  -2.375  1.00  0.00           H  
HETATM   61  H   UNL     1      -5.114  -1.338  -4.080  1.00  0.00           H  
HETATM   62  H   UNL     1       6.322  -2.670  -2.250  1.00  0.00           H  
CONECT    1   13    6    2   37                                       
CONECT    2    1   21    3   38                                       
CONECT    3    2    4    7   39                                       
CONECT    4    3    6    5   40                                       
CONECT    5    4    8   41   42                                       
CONECT    6    1    4                                                 
CONECT    7    3   43                                                 
CONECT    8    5    9                                                 
CONECT    9    8   11   11   12                                       
CONECT    9   10                                                      
CONECT   10    9   44                                                 
CONECT   11    9    9                                                 
CONECT   12    9   22                                                 
CONECT   13    1   17   16                                            
CONECT   14   17   19   62                                            
CONECT   15   19   16   16   45                                       
CONECT   16   13   15   15   46                                       
CONECT   17   13   14   18   18                                       
CONECT   18   17   17                                                 
CONECT   19   14   15   20   20                                       
CONECT   20   19   19                                                 
CONECT   21    2   47                                                 
CONECT   22   12   24   24   23                                       
CONECT   22   34                                                      
CONECT   23   22   48                                                 
CONECT   24   22   22                                                 
CONECT   25   30   26                                                 
CONECT   26   25   35   27   49                                       
CONECT   27   26   31   28   50                                       
CONECT   28   27   29   32   51                                       
CONECT   29   28   30   33   52                                       
CONECT   30   25   29   34   53                                       
CONECT   31   27   54                                                 
CONECT   32   28   55                                                 
CONECT   33   29   56                                                 
CONECT   34   22   30   57   58                                       
CONECT   35   26   36   59   60                                       
CONECT   36   35   61                                                 
CONECT   37    1                                                      
CONECT   38    2                                                      
CONECT   39    3                                                      
CONECT   40    4                                                      
CONECT   41    5                                                      
CONECT   42    5                                                      
CONECT   43    7                                                      
CONECT   44   10                                                      
CONECT   45   15                                                      
CONECT   46   16                                                      
CONECT   47   21                                                      
CONECT   48   23                                                      
CONECT   49   26                                                      
CONECT   50   27                                                      
CONECT   51   28                                                      
CONECT   52   29                                                      
CONECT   53   30                                                      
CONECT   54   31                                                      
CONECT   55   32                                                      
CONECT   56   33                                                      
CONECT   57   34                                                      
CONECT   58   34                                                      
CONECT   59   35                                                      
CONECT   60   35                                                      
CONECT   61   36                                                      
CONECT   62   14                                                      
MASTER        0    0    0    0    0    0    0    0   62    0   62    0
END
