COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       5.623  -0.221   0.497  1.00  0.00           N  
HETATM    2  C   UNL     1       3.351   0.247  -0.288  1.00  0.00           C  
HETATM    3  C   UNL     1       3.290   1.422   0.463  1.00  0.00           C  
HETATM    4  C   UNL     1       2.152   2.201   0.427  1.00  0.00           C  
HETATM    5  C   UNL     1       1.073   1.819  -0.350  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.167   2.675  -0.384  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.161   3.532  -1.652  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.042  -0.364   0.187  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.392   3.098   0.909  1.00  0.00           C  
HETATM   10  C   UNL     1      -6.925  -1.993   0.327  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.250  -4.066  -0.437  1.00  0.00           C  
HETATM   12  C   UNL     1      -6.586  -4.310  -0.175  1.00  0.00           C  
HETATM   13  C   UNL     1      -7.421  -3.275   0.206  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.746  -2.786  -0.329  1.00  0.00           C  
HETATM   15  C   UNL     1       2.259  -0.133  -1.070  1.00  0.00           C  
HETATM   16  C   UNL     1       1.127   0.655  -1.096  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.713   0.034  -0.051  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.581  -1.741   0.059  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.690   1.393   0.195  1.00  0.00           C  
HETATM   20  C   UNL     1       4.570  -0.590  -0.259  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.526   2.288   0.088  1.00  0.00           C  
HETATM   22  C   UNL     1       7.638  -1.057  -1.169  1.00  0.00           C  
HETATM   23  N   UNL     1      -5.718   0.706   0.548  1.00  0.00           N  
HETATM   24  N   UNL     1      -4.960   1.743   0.557  1.00  0.00           N  
HETATM   25  N   UNL     1      -1.354   1.816  -0.381  1.00  0.00           N  
HETATM   26  O   UNL     1       4.622  -1.610  -0.918  1.00  0.00           O  
HETATM   27  O   UNL     1      -2.622   3.454   0.421  1.00  0.00           O  
HETATM   28  O   UNL     1       7.856  -0.482   1.428  1.00  0.00           O  
HETATM   29  O   UNL     1       6.516  -2.464   0.801  1.00  0.00           O  
HETATM   30  S   UNL     1       6.991  -1.154   0.523  1.00  0.00           S  
HETATM   31  H   UNL     1       5.581   0.593   1.022  1.00  0.00           H  
HETATM   32  H   UNL     1       4.132   1.720   1.070  1.00  0.00           H  
HETATM   33  H   UNL     1       2.103   3.110   1.008  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.185   3.323   0.492  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.143   2.883  -2.528  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.058   4.151  -1.676  1.00  0.00           H  
HETATM   37  H   UNL     1       0.722   4.171  -1.654  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.636   3.649   0.001  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.273   3.044   1.549  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.589   3.609   1.440  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.578  -1.186   0.624  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.601  -4.879  -0.726  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.977  -5.313  -0.260  1.00  0.00           H  
HETATM   44  H   UNL     1      -8.464  -3.471   0.410  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.702  -2.597  -0.534  1.00  0.00           H  
HETATM   46  H   UNL     1       2.300  -1.041  -1.653  1.00  0.00           H  
HETATM   47  H   UNL     1       0.281   0.363  -1.701  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.888  -0.591  -0.360  1.00  0.00           H  
HETATM   49  H   UNL     1       8.550  -1.650  -1.243  1.00  0.00           H  
HETATM   50  H   UNL     1       6.894  -1.444  -1.865  1.00  0.00           H  
HETATM   51  H   UNL     1       7.859  -0.018  -1.414  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.296   0.908  -0.716  1.00  0.00           H  
CONECT    1   30   20   31                                            
CONECT    2   20    3    3   15                                       
CONECT    3    2    2    4   32                                       
CONECT    4    3    5    5   33                                       
CONECT    5    4    4   16    6                                       
CONECT    6    5   25    7   34                                       
CONECT    7    6   35   36   37                                       
CONECT    8   23   23   17   18                                       
CONECT    9   24   38   39   40                                       
CONECT   10   18   18   13   41                                       
CONECT   11   14   14   12   42                                       
CONECT   12   13   13   11   43                                       
CONECT   13   10   12   12   44                                       
CONECT   14   18   11   11   45                                       
CONECT   15    2   16   16   46                                       
CONECT   16   15   15    5   47                                       
CONECT   17   19   19    8   48                                       
CONECT   18    8   10   10   14                                       
CONECT   19   21   24   17   17                                       
CONECT   20    1   26   26    2                                       
CONECT   21   27   27   25   19                                       
CONECT   22   30   49   50   51                                       
CONECT   23   24    8    8                                            
CONECT   24    9   19   23                                            
CONECT   25    6   21   52                                            
CONECT   26   20   20                                                 
CONECT   27   21   21                                                 
CONECT   28   30   30                                                 
CONECT   29   30   30                                                 
CONECT   30   28   28   22   29                                       
CONECT   30   29    1                                                 
CONECT   31    1                                                      
CONECT   32    3                                                      
CONECT   33    4                                                      
CONECT   34    6                                                      
CONECT   35    7                                                      
CONECT   36    7                                                      
CONECT   37    7                                                      
CONECT   38    9                                                      
CONECT   39    9                                                      
CONECT   40    9                                                      
CONECT   41   10                                                      
CONECT   42   11                                                      
CONECT   43   12                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   16                                                      
CONECT   48   17                                                      
CONECT   49   22                                                      
CONECT   50   22                                                      
CONECT   51   22                                                      
CONECT   52   25                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
