COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -0.828   2.056  -0.213  1.00  0.00           N  
HETATM    2  C   UNL     1      -2.180   1.809   0.045  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.699   0.537  -0.140  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.048   0.295   0.118  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.866   1.336   0.560  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.340   2.599   0.741  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.002   2.837   0.491  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.970  -2.729  -0.393  1.00  0.00           C  
HETATM    9  N   UNL     1      -4.744  -3.169  -0.306  1.00  0.00           N  
HETATM   10  N   UNL     1      -3.935  -2.187  -0.120  1.00  0.00           N  
HETATM   11  C   UNL     1      -4.609  -1.060  -0.077  1.00  0.00           C  
HETATM   12  N   UNL     1      -5.929  -1.376  -0.257  1.00  0.00           N  
HETATM   13  C   UNL     1       0.093   1.110   0.054  1.00  0.00           C  
HETATM   14  O   UNL     1      -0.257   0.016   0.451  1.00  0.00           O  
HETATM   15  C   UNL     1      -7.063  -0.449  -0.294  1.00  0.00           C  
HETATM   16  C   UNL     1       1.533   1.403  -0.135  1.00  0.00           C  
HETATM   17  C   UNL     1       2.478   0.419   0.138  1.00  0.00           C  
HETATM   18  N   UNL     1       1.909   2.600  -0.569  1.00  0.00           N  
HETATM   19  C   UNL     1       3.828   0.710  -0.046  1.00  0.00           C  
HETATM   20  C   UNL     1      -8.406  -0.995  -0.783  1.00  0.00           C  
HETATM   21  C   UNL     1      -8.200  -0.683   0.701  1.00  0.00           C  
HETATM   22  C   UNL     1       4.175   1.981  -0.497  1.00  0.00           C  
HETATM   23  C   UNL     1       3.177   2.905  -0.751  1.00  0.00           C  
HETATM   24  N   UNL     1       4.811  -0.251   0.217  1.00  0.00           N  
HETATM   25  C   UNL     1       4.604  -1.519   0.658  1.00  0.00           C  
HETATM   26  N   UNL     1       5.761  -2.109   0.784  1.00  0.00           N  
HETATM   27  C   UNL     1       6.736  -1.257   0.435  1.00  0.00           C  
HETATM   28  C   UNL     1       6.166  -0.092   0.072  1.00  0.00           C  
HETATM   29  C   UNL     1       8.213  -1.553   0.442  1.00  0.00           C  
HETATM   30  C   UNL     1       8.848  -2.011  -0.873  1.00  0.00           C  
HETATM   31  C   UNL     1       9.127  -0.605  -0.337  1.00  0.00           C  
HETATM   32  H   UNL     1      -0.553   2.908  -0.588  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.061  -0.264  -0.483  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.911   1.152   0.761  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.976   3.402   1.083  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.595   3.826   0.639  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.855  -3.329  -0.549  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.818   0.583  -0.545  1.00  0.00           H  
HETATM   39  H   UNL     1       2.171  -0.556   0.486  1.00  0.00           H  
HETATM   40  H   UNL     1      -9.045  -0.322  -1.354  1.00  0.00           H  
HETATM   41  H   UNL     1      -8.446  -2.044  -1.076  1.00  0.00           H  
HETATM   42  H   UNL     1      -8.106  -1.527   1.384  1.00  0.00           H  
HETATM   43  H   UNL     1      -8.704   0.195   1.105  1.00  0.00           H  
HETATM   44  H   UNL     1       5.212   2.242  -0.650  1.00  0.00           H  
HETATM   45  H   UNL     1       3.441   3.891  -1.102  1.00  0.00           H  
HETATM   46  H   UNL     1       3.643  -1.964   0.869  1.00  0.00           H  
HETATM   47  H   UNL     1       6.677   0.798  -0.262  1.00  0.00           H  
HETATM   48  H   UNL     1       8.602  -1.982   1.365  1.00  0.00           H  
HETATM   49  H   UNL     1       9.655  -2.741  -0.814  1.00  0.00           H  
HETATM   50  H   UNL     1       8.197  -2.099  -1.743  1.00  0.00           H  
HETATM   51  H   UNL     1       8.660   0.233  -0.855  1.00  0.00           H  
HETATM   52  H   UNL     1      10.118  -0.410   0.074  1.00  0.00           H  
CONECT    1   13    2   32                                            
CONECT    2    1    7    7    3                                       
CONECT    3    2    4    4   33                                       
CONECT    4    3    3    5   11                                       
CONECT    5    6    6    4   34                                       
CONECT    6    7    5    5   35                                       
CONECT    7    2    2    6   36                                       
CONECT    8   12    9    9   37                                       
CONECT    9   10    8    8                                            
CONECT   10   11   11    9                                            
CONECT   11    4   12   10   10                                       
CONECT   12   11   15    8                                            
CONECT   13   14   14   16    1                                       
CONECT   14   13   13                                                 
CONECT   15   20   12   21   38                                       
CONECT   16   17   13   18   18                                       
CONECT   17   19   19   16   39                                       
CONECT   18   16   16   23                                            
CONECT   19   24   17   17   22                                       
CONECT   20   15   21   40   41                                       
CONECT   21   20   15   42   43                                       
CONECT   22   19   23   23   44                                       
CONECT   23   22   22   18   45                                       
CONECT   24   25   28   19                                            
CONECT   25   26   26   24   46                                       
CONECT   26   27   25   25                                            
CONECT   27   29   26   28   28                                       
CONECT   28   27   27   24   47                                       
CONECT   29   31   30   27   48                                       
CONECT   30   31   29   49   50                                       
CONECT   31   30   29   51   52                                       
CONECT   32    1                                                      
CONECT   33    3                                                      
CONECT   34    5                                                      
CONECT   35    6                                                      
CONECT   36    7                                                      
CONECT   37    8                                                      
CONECT   38   15                                                      
CONECT   39   17                                                      
CONECT   40   20                                                      
CONECT   41   20                                                      
CONECT   42   21                                                      
CONECT   43   21                                                      
CONECT   44   22                                                      
CONECT   45   23                                                      
CONECT   46   25                                                      
CONECT   47   28                                                      
CONECT   48   29                                                      
CONECT   49   30                                                      
CONECT   50   30                                                      
CONECT   51   31                                                      
CONECT   52   31                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
