COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       3.944  -0.733  -2.577  1.00  0.00           O  
HETATM    2  C   UNL     1      -7.044  -0.850  -0.495  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.388  -1.874   0.403  1.00  0.00           C  
HETATM    4  C   UNL     1      -8.615  -2.533   0.219  1.00  0.00           C  
HETATM    5  N   UNL     1      -9.390  -2.158  -0.794  1.00  0.00           N  
HETATM    6  C   UNL     1      -5.451  -1.110   1.007  1.00  0.00           C  
HETATM    7  N   UNL     1      -7.884  -0.543  -1.478  1.00  0.00           N  
HETATM    8  O   UNL     1       5.587  -2.135  -1.022  1.00  0.00           O  
HETATM    9  C   UNL     1      -9.023  -1.189  -1.612  1.00  0.00           C  
HETATM   10  N   UNL     1      -9.008  -3.551   1.071  1.00  0.00           N  
HETATM   11  O   UNL     1       6.292  -1.289  -3.329  1.00  0.00           O  
HETATM   12  O   UNL     1       6.056   0.451  -1.471  1.00  0.00           O  
HETATM   13  C   UNL     1      -5.041   0.681  -0.722  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.495   2.066  -0.193  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.235   2.933  -0.432  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.087   1.911  -0.539  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.032   2.200   0.530  1.00  0.00           C  
HETATM   18  N   UNL     1      -6.373  -1.982   1.294  1.00  0.00           N  
HETATM   19  N   UNL     1      -5.815  -0.391  -0.092  1.00  0.00           N  
HETATM   20  O   UNL     1       3.546  -1.387   0.481  1.00  0.00           O  
HETATM   21  O   UNL     1       6.223   0.465   1.042  1.00  0.00           O  
HETATM   22  O   UNL     1       3.363   0.249   2.469  1.00  0.00           O  
HETATM   23  O   UNL     1       5.936   2.688  -0.106  1.00  0.00           O  
HETATM   24  O   UNL     1      -0.054   0.914   2.809  1.00  0.00           O  
HETATM   25  O   UNL     1      -6.605   2.559  -0.944  1.00  0.00           O  
HETATM   26  O   UNL     1       0.949   2.697   1.330  1.00  0.00           O  
HETATM   27  O   UNL     1      -4.362   3.675  -1.647  1.00  0.00           O  
HETATM   28  O   UNL     1       1.466   0.294   0.756  1.00  0.00           O  
HETATM   29  O   UNL     1       3.974   0.979   0.070  1.00  0.00           O  
HETATM   30  O   UNL     1      -3.654   0.608  -0.326  1.00  0.00           O  
HETATM   31  O   UNL     1       4.794  -3.620   0.990  1.00  0.00           O  
HETATM   32  O   UNL     1      -0.925   1.311   0.361  1.00  0.00           O  
HETATM   33  O   UNL     1       5.888  -1.384   1.363  1.00  0.00           O  
HETATM   34  P   UNL     1       5.550   1.125  -0.099  1.00  0.00           P  
HETATM   35  P   UNL     1       4.964  -2.109   0.463  1.00  0.00           P  
HETATM   36  P   UNL     1       5.481  -0.936  -2.143  1.00  0.00           P  
HETATM   37  P   UNL     1       3.034   0.060   1.039  1.00  0.00           P  
HETATM   38  P   UNL     1       0.372   1.334   1.314  1.00  0.00           P  
HETATM   39  H   UNL     1       3.540  -1.518  -2.972  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.530  -0.979   1.556  1.00  0.00           H  
HETATM   41  H   UNL     1      -9.683  -0.915  -2.422  1.00  0.00           H  
HETATM   42  H   UNL     1      -8.434  -3.816   1.806  1.00  0.00           H  
HETATM   43  H   UNL     1      -9.857  -3.998   0.933  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.136   0.635  -1.807  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.737   2.016   0.869  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.070   3.606   0.409  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.637   1.962  -1.530  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.689   3.230   0.433  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.467   2.054   1.519  1.00  0.00           H  
HETATM   50  H   UNL     1       6.885   2.859  -0.179  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.441   0.030   2.874  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.926   3.424  -0.651  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.106   4.293  -1.654  1.00  0.00           H  
HETATM   54  H   UNL     1       5.618  -4.126   1.008  1.00  0.00           H  
CONECT    1   36   39                                                 
CONECT    2   19    7    7    3                                       
CONECT    3    2   18    4    4                                       
CONECT    4    3    3    5   10                                       
CONECT    5    9    9    4                                            
CONECT    6   19   18   18   40                                       
CONECT    7    2    2    9                                            
CONECT    8   36   35                                                 
CONECT    9    7    5    5   41                                       
CONECT   10    4   42   43                                            
CONECT   11   36   36                                                 
CONECT   12   36   34                                                 
CONECT   13   30   14   19   44                                       
CONECT   14   15   25   13   45                                       
CONECT   15   16   27   14   46                                       
CONECT   16   17   30   15   47                                       
CONECT   17   32   16   48   49                                       
CONECT   18    6    6    3                                            
CONECT   19   13    6    2                                            
CONECT   20   37   35                                                 
CONECT   21   34   34                                                 
CONECT   22   37   37                                                 
CONECT   23   34   50                                                 
CONECT   24   38   51                                                 
CONECT   25   14   52                                                 
CONECT   26   38   38                                                 
CONECT   27   15   53                                                 
CONECT   28   37   38                                                 
CONECT   29   37   34                                                 
CONECT   30   16   13                                                 
CONECT   31   35   54                                                 
CONECT   32   38   17                                                 
CONECT   33   35   35                                                 
CONECT   34   12   21   21   29                                       
CONECT   34   23                                                      
CONECT   35   33   33   20    8                                       
CONECT   35   31                                                      
CONECT   36   11   11   12    1                                       
CONECT   36    8                                                      
CONECT   37   22   22   20   28                                       
CONECT   37   29                                                      
CONECT   38   28   26   26   24                                       
CONECT   38   32                                                      
CONECT   39    1                                                      
CONECT   40    6                                                      
CONECT   41    9                                                      
CONECT   42   10                                                      
CONECT   43   10                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   16                                                      
CONECT   48   17                                                      
CONECT   49   17                                                      
CONECT   50   23                                                      
CONECT   51   24                                                      
CONECT   52   25                                                      
CONECT   53   27                                                      
CONECT   54   31                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
