COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       0.705   1.927   0.148  1.00  0.00           N  
HETATM    2  O   UNL     1      -0.630   3.914  -1.259  1.00  0.00           O  
HETATM    3  O   UNL     1      -5.021   0.420   1.894  1.00  0.00           O  
HETATM    4  C   UNL     1       5.832  -2.172  -0.940  1.00  0.00           C  
HETATM    5  C   UNL     1       5.170  -3.294  -0.151  1.00  0.00           C  
HETATM    6  C   UNL     1       4.219  -2.689   0.895  1.00  0.00           C  
HETATM    7  C   UNL     1       3.113  -1.864   0.232  1.00  0.00           C  
HETATM    8  C   UNL     1       3.568  -0.431   0.120  1.00  0.00           C  
HETATM    9  C   UNL     1       2.809   0.693   0.106  1.00  0.00           C  
HETATM   10  C   UNL     1       1.343   0.740   0.170  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.694   1.969   0.120  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.349   2.973  -0.591  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.368   4.913  -1.966  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.733   3.010  -0.615  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.463   2.052   0.066  1.00  0.00           C  
HETATM   16  N   UNL     1      -4.013  -1.414   0.586  1.00  0.00           N  
HETATM   17  N   UNL     1       3.649   1.786   0.023  1.00  0.00           N  
HETATM   18  C   UNL     1       4.926   1.366  -0.024  1.00  0.00           C  
HETATM   19  O   UNL     1       7.049  -0.800   0.571  1.00  0.00           O  
HETATM   20  C   UNL     1       6.146   2.247  -0.107  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.814   1.056   0.771  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.064  -2.534   0.495  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.701  -2.745  -0.979  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.625  -3.283  -3.151  1.00  0.00           C  
HETATM   25  C   UNL     1       4.924  -0.006   0.018  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.758  -1.695  -1.718  1.00  0.00           C  
HETATM   27  C   UNL     1      -5.206  -1.441  -0.274  1.00  0.00           C  
HETATM   28  C   UNL     1      -1.433   1.009   0.795  1.00  0.00           C  
HETATM   29  C   UNL     1       6.024  -0.967  -0.055  1.00  0.00           C  
HETATM   30  N   UNL     1      -3.932  -2.908  -1.765  1.00  0.00           N  
HETATM   31  O   UNL     1       0.704  -0.293   0.242  1.00  0.00           O  
HETATM   32  O   UNL     1      -2.904  -0.665   2.660  1.00  0.00           O  
HETATM   33  S   UNL     1      -3.750  -0.161   1.636  1.00  0.00           S  
HETATM   34  H   UNL     1       1.215   2.752   0.156  1.00  0.00           H  
HETATM   35  H   UNL     1       6.802  -2.510  -1.306  1.00  0.00           H  
HETATM   36  H   UNL     1       5.200  -1.904  -1.786  1.00  0.00           H  
HETATM   37  H   UNL     1       4.606  -3.932  -0.830  1.00  0.00           H  
HETATM   38  H   UNL     1       5.935  -3.885   0.352  1.00  0.00           H  
HETATM   39  H   UNL     1       3.765  -3.494   1.473  1.00  0.00           H  
HETATM   40  H   UNL     1       4.789  -2.047   1.566  1.00  0.00           H  
HETATM   41  H   UNL     1       2.909  -2.260  -0.763  1.00  0.00           H  
HETATM   42  H   UNL     1       2.208  -1.913   0.837  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.995   5.465  -1.266  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.676   5.600  -2.454  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.997   4.436  -2.718  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.243   3.787  -1.165  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.542   2.083   0.046  1.00  0.00           H  
HETATM   48  H   UNL     1       3.363   2.713   0.002  1.00  0.00           H  
HETATM   49  H   UNL     1       6.488   2.490   0.899  1.00  0.00           H  
HETATM   50  H   UNL     1       6.937   1.722  -0.643  1.00  0.00           H  
HETATM   51  H   UNL     1       5.895   3.165  -0.638  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.164  -2.299   1.063  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.525  -3.438   0.891  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.148  -1.880  -1.345  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.085  -3.639  -1.077  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.082  -2.471  -3.636  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.012  -4.184  -3.157  1.00  0.00           H  
HETATM   58  H   UNL     1      -4.553  -3.472  -3.690  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.635  -1.827  -2.352  1.00  0.00           H  
HETATM   60  H   UNL     1      -4.177  -0.844  -2.074  1.00  0.00           H  
HETATM   61  H   UNL     1      -5.873  -2.240   0.049  1.00  0.00           H  
HETATM   62  H   UNL     1      -5.722  -0.483  -0.214  1.00  0.00           H  
HETATM   63  H   UNL     1      -0.928   0.226   1.343  1.00  0.00           H  
CONECT    1   11   10   34                                            
CONECT    2   13   12                                                 
CONECT    3   33   33                                                 
CONECT    4    5   29   35   36                                       
CONECT    5    6    4   37   38                                       
CONECT    6    5    7   39   40                                       
CONECT    7    6    8   41   42                                       
CONECT    8    7   25    9    9                                       
CONECT    9    8    8   10   17                                       
CONECT   10    1    9   31   31                                       
CONECT   11   12    1   28   28                                       
CONECT   12    2   14   14   11                                       
CONECT   13    2   43   44   45                                       
CONECT   14   12   12   15   46                                       
CONECT   15   14   21   21   47                                       
CONECT   16   27   33   22                                            
CONECT   17    9   18   48                                            
CONECT   18   25   25   17   20                                       
CONECT   19   29   29                                                 
CONECT   20   18   49   50   51                                       
CONECT   21   15   15   28   33                                       
CONECT   22   16   23   52   53                                       
CONECT   23   22   30   54   55                                       
CONECT   24   30   56   57   58                                       
CONECT   25    8   29   18   18                                       
CONECT   26   27   30   59   60                                       
CONECT   27   16   26   61   62                                       
CONECT   28   11   11   21   63                                       
CONECT   29    4   25   19   19                                       
CONECT   30   26   23   24                                            
CONECT   31   10   10                                                 
CONECT   32   33   33                                                 
CONECT   33   21   32   32   16                                       
CONECT   33    3    3                                                 
CONECT   34    1                                                      
CONECT   35    4                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    5                                                      
CONECT   39    6                                                      
CONECT   40    6                                                      
CONECT   41    7                                                      
CONECT   42    7                                                      
CONECT   43   13                                                      
CONECT   44   13                                                      
CONECT   45   13                                                      
CONECT   46   14                                                      
CONECT   47   15                                                      
CONECT   48   17                                                      
CONECT   49   20                                                      
CONECT   50   20                                                      
CONECT   51   20                                                      
CONECT   52   22                                                      
CONECT   53   22                                                      
CONECT   54   23                                                      
CONECT   55   23                                                      
CONECT   56   24                                                      
CONECT   57   24                                                      
CONECT   58   24                                                      
CONECT   59   26                                                      
CONECT   60   26                                                      
CONECT   61   27                                                      
CONECT   62   27                                                      
CONECT   63   28                                                      
MASTER        0    0    0    0    0    0    0    0   63    0   63    0
END
