COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -1.454   0.966  -0.821  1.00  0.00           N  
HETATM    2  N   UNL     1       0.694   1.514  -0.080  1.00  0.00           N  
HETATM    3  C   UNL     1      -2.721   0.433  -0.557  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.536   1.113   0.205  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.061   0.979   2.457  1.00  0.00           C  
HETATM    6  C   UNL     1       1.232   1.394   2.203  1.00  0.00           C  
HETATM    7  C   UNL     1       1.597   1.665   0.883  1.00  0.00           C  
HETATM    8  C   UNL     1       3.848   1.152   0.185  1.00  0.00           C  
HETATM    9  C   UNL     1       5.781  -0.677  -0.593  1.00  0.00           C  
HETATM   10  C   UNL     1       7.969  -1.841  -1.383  1.00  0.00           C  
HETATM   11  C   UNL     1       3.528  -0.193   0.147  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.049  -2.678   2.080  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.233  -0.624  -0.032  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.905  -2.217  -0.605  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.977   2.032  -2.448  1.00  0.00           C  
HETATM   16  O   UNL     1      -6.192   0.949  -1.541  1.00  0.00           O  
HETATM   17  C   UNL     1      -5.095   0.431  -0.926  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.840   0.958  -1.188  1.00  0.00           C  
HETATM   19  N   UNL     1      -0.910   0.850   1.449  1.00  0.00           N  
HETATM   20  N   UNL     1       2.884   2.084   0.581  1.00  0.00           N  
HETATM   21  C   UNL     1       3.233   3.503   0.677  1.00  0.00           C  
HETATM   22  C   UNL     1       5.129   1.585  -0.164  1.00  0.00           C  
HETATM   23  C   UNL     1       6.083   0.691  -0.547  1.00  0.00           C  
HETATM   24  C   UNL     1       6.529  -1.829  -0.939  1.00  0.00           C  
HETATM   25  N   UNL     1       5.766  -2.875  -0.811  1.00  0.00           N  
HETATM   26  N   UNL     1       4.491  -2.483  -0.385  1.00  0.00           N  
HETATM   27  C   UNL     1       4.490  -1.118  -0.247  1.00  0.00           C  
HETATM   28  C   UNL     1      -2.857  -0.624   0.333  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.111  -1.152   0.596  1.00  0.00           C  
HETATM   30  O   UNL     1      -4.245  -2.184   1.471  1.00  0.00           O  
HETATM   31  O   UNL     1      -6.465  -1.141   0.227  1.00  0.00           O  
HETATM   32  H   UNL     1      -1.217   1.229  -1.725  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.376   0.762   3.467  1.00  0.00           H  
HETATM   34  H   UNL     1       1.944   1.508   3.008  1.00  0.00           H  
HETATM   35  H   UNL     1       8.617  -1.943  -0.512  1.00  0.00           H  
HETATM   36  H   UNL     1       8.135  -2.680  -2.058  1.00  0.00           H  
HETATM   37  H   UNL     1       8.198  -0.908  -1.898  1.00  0.00           H  
HETATM   38  H   UNL     1       2.537  -0.523   0.422  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.297  -3.498   2.754  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.369  -3.036   1.307  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.571  -1.877   2.642  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.899  -2.535  -0.293  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.938  -1.884  -1.643  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.211  -3.053  -0.515  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.518   2.866  -1.916  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.317   1.707  -3.252  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.931   2.350  -2.867  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.733   1.777  -1.884  1.00  0.00           H  
HETATM   49  H   UNL     1       3.594   3.722   1.682  1.00  0.00           H  
HETATM   50  H   UNL     1       4.014   3.735  -0.048  1.00  0.00           H  
HETATM   51  H   UNL     1       2.352   4.109   0.467  1.00  0.00           H  
HETATM   52  H   UNL     1       5.365   2.638  -0.130  1.00  0.00           H  
HETATM   53  H   UNL     1       7.071   1.035  -0.811  1.00  0.00           H  
HETATM   54  H   UNL     1       3.741  -3.074  -0.215  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.985  -1.034   0.821  1.00  0.00           H  
CONECT    1    3    4   32                                            
CONECT    2    4    4    7                                            
CONECT    3    1   18   18   28                                       
CONECT    4    1    2    2   19                                       
CONECT    5    6   19   19   33                                       
CONECT    6    5    7    7   34                                       
CONECT    7    2    6    6   20                                       
CONECT    8   11   11   20   22                                       
CONECT    9   23   24   27   27                                       
CONECT   10   24   35   36   37                                       
CONECT   11    8    8   27   38                                       
CONECT   12   30   39   40   41                                       
CONECT   13   17   17   29   31                                       
CONECT   14   31   42   43   44                                       
CONECT   15   16   45   46   47                                       
CONECT   16   15   17                                                 
CONECT   17   13   13   16   18                                       
CONECT   18    3    3   17   48                                       
CONECT   19    4    5    5                                            
CONECT   20    7    8   21                                            
CONECT   21   20   49   50   51                                       
CONECT   22    8   23   23   52                                       
CONECT   23    9   22   22   53                                       
CONECT   24    9   10   25   25                                       
CONECT   25   24   24   26                                            
CONECT   26   25   27   54                                            
CONECT   27    9    9   11   26                                       
CONECT   28    3   29   29   55                                       
CONECT   29   13   28   28   30                                       
CONECT   30   12   29                                                 
CONECT   31   13   14                                                 
CONECT   32    1                                                      
CONECT   33    5                                                      
CONECT   34    6                                                      
CONECT   35   10                                                      
CONECT   36   10                                                      
CONECT   37   10                                                      
CONECT   38   11                                                      
CONECT   39   12                                                      
CONECT   40   12                                                      
CONECT   41   12                                                      
CONECT   42   14                                                      
CONECT   43   14                                                      
CONECT   44   14                                                      
CONECT   45   15                                                      
CONECT   46   15                                                      
CONECT   47   15                                                      
CONECT   48   18                                                      
CONECT   49   21                                                      
CONECT   50   21                                                      
CONECT   51   21                                                      
CONECT   52   22                                                      
CONECT   53   23                                                      
CONECT   54   26                                                      
CONECT   55   28                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
