COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.029   2.779  -0.330  1.00  0.00           C  
HETATM    2  C   UNL     1       2.352   0.133  -0.133  1.00  0.00           C  
HETATM    3  C   UNL     1       1.338   1.105  -0.205  1.00  0.00           C  
HETATM    4  C   UNL     1       1.685   2.456  -0.306  1.00  0.00           C  
HETATM    5  N   UNL     1       2.004  -1.195  -0.032  1.00  0.00           N  
HETATM    6  C   UNL     1       3.057  -2.210   0.049  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.758  -1.162  -0.022  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.877  -2.392  -0.884  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.191  -3.543  -0.343  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.322  -3.661   1.154  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.422  -4.748  -1.217  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.362   1.241   0.148  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.354   2.324  -0.280  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.980   3.650   0.386  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.414   1.064   1.667  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.714  -0.084  -0.540  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.340  -0.650  -0.070  1.00  0.00           C  
HETATM   18  C   UNL     1       0.718  -1.577  -0.007  1.00  0.00           C  
HETATM   19  O   UNL     1       0.457  -2.765   0.078  1.00  0.00           O  
HETATM   20  C   UNL     1       3.419  -2.453   1.516  1.00  0.00           C  
HETATM   21  N   UNL     1       3.625   0.503  -0.156  1.00  0.00           N  
HETATM   22  C   UNL     1       3.975   1.769  -0.255  1.00  0.00           C  
HETATM   23  C   UNL     1       5.438   2.127  -0.287  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.069   0.680  -0.172  1.00  0.00           C  
HETATM   25  O   UNL     1      -1.041   1.613  -0.249  1.00  0.00           O  
HETATM   26  O   UNL     1      -3.906   4.662  -0.014  1.00  0.00           O  
HETATM   27  H   UNL     1       3.340   3.811  -0.412  1.00  0.00           H  
HETATM   28  H   UNL     1       0.927   3.223  -0.363  1.00  0.00           H  
HETATM   29  H   UNL     1       2.701  -3.139  -0.396  1.00  0.00           H  
HETATM   30  H   UNL     1       3.938  -1.863  -0.490  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.018  -1.413   1.006  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.702  -2.325  -1.948  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.326  -3.363   1.455  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.144  -4.694   1.454  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.590  -3.012   1.635  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.518  -4.964  -1.786  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.672  -5.607  -0.594  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.244  -4.547  -1.904  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.321   2.440  -1.363  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.360   2.036   0.025  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.012   3.535   1.469  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.973   3.938   0.081  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.142   2.002   2.151  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.423   0.781   1.965  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.714   0.285   1.966  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.600   0.020  -1.619  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.742  -0.360  -0.304  1.00  0.00           H  
HETATM   48  H   UNL     1       4.202  -3.208   1.577  1.00  0.00           H  
HETATM   49  H   UNL     1       3.774  -1.523   1.961  1.00  0.00           H  
HETATM   50  H   UNL     1       2.537  -2.799   2.055  1.00  0.00           H  
HETATM   51  H   UNL     1       5.794   2.293   0.730  1.00  0.00           H  
HETATM   52  H   UNL     1       6.002   1.312  -0.740  1.00  0.00           H  
HETATM   53  H   UNL     1       5.577   3.036  -0.873  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.729   5.531   0.370  1.00  0.00           H  
CONECT    1    4   22   22   27                                       
CONECT    2    3    5   21   21                                       
CONECT    3   24    4    4    2                                       
CONECT    4    3    3    1   28                                       
CONECT    5   18    2    6                                            
CONECT    6    5   20   29   30                                       
CONECT    7   16    8   17   31                                       
CONECT    8    9    9    7   32                                       
CONECT    9   10   11    8    8                                       
CONECT   10    9   33   34   35                                       
CONECT   11    9   36   37   38                                       
CONECT   12   16   15   13   25                                       
CONECT   13   14   12   39   40                                       
CONECT   14   26   13   41   42                                       
CONECT   15   12   43   44   45                                       
CONECT   16   12    7   46   47                                       
CONECT   17    7   24   24   18                                       
CONECT   18   17   19   19    5                                       
CONECT   19   18   18                                                 
CONECT   20    6   48   49   50                                       
CONECT   21    2    2   22                                            
CONECT   22    1    1   21   23                                       
CONECT   23   22   51   52   53                                       
CONECT   24   25   17   17    3                                       
CONECT   25   12   24                                                 
CONECT   26   14   54                                                 
CONECT   27    1                                                      
CONECT   28    4                                                      
CONECT   29    6                                                      
CONECT   30    6                                                      
CONECT   31    7                                                      
CONECT   32    8                                                      
CONECT   33   10                                                      
CONECT   34   10                                                      
CONECT   35   10                                                      
CONECT   36   11                                                      
CONECT   37   11                                                      
CONECT   38   11                                                      
CONECT   39   13                                                      
CONECT   40   13                                                      
CONECT   41   14                                                      
CONECT   42   14                                                      
CONECT   43   15                                                      
CONECT   44   15                                                      
CONECT   45   15                                                      
CONECT   46   16                                                      
CONECT   47   16                                                      
CONECT   48   20                                                      
CONECT   49   20                                                      
CONECT   50   20                                                      
CONECT   51   23                                                      
CONECT   52   23                                                      
CONECT   53   23                                                      
CONECT   54   26                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
