COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.451  -0.313   0.404  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.415  -3.001  -2.579  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.289  -1.722  -0.759  1.00  0.00           C  
HETATM    4  C   UNL     1       0.153   0.157   0.222  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.060   1.513  -0.058  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.386  -2.579  -0.619  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.165  -2.500   0.550  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.507   5.081  -1.115  1.00  0.00           C  
HETATM    9  C   UNL     1       6.131  -1.072  -1.053  1.00  0.00           C  
HETATM   10  C   UNL     1       4.702  -0.530  -1.121  1.00  0.00           C  
HETATM   11  C   UNL     1       1.022   2.375  -0.150  1.00  0.00           C  
HETATM   12  C   UNL     1       2.306   1.895   0.032  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.698  -2.012  -2.004  1.00  0.00           C  
HETATM   14  C   UNL     1       2.519   0.557   0.309  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.802  -0.763   1.417  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.997  -0.772   0.322  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.739   4.611   0.322  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.076   3.676  -0.691  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.699  -1.566   2.718  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.577   3.413  -0.534  1.00  0.00           C  
HETATM   21  N   UNL     1      -2.439  -3.355  -1.754  1.00  0.00           N  
HETATM   22  N   UNL     1      -2.862  -1.616   1.517  1.00  0.00           N  
HETATM   23  N   UNL     1      -1.357   1.995  -0.242  1.00  0.00           N  
HETATM   24  O   UNL     1      -4.126  -3.240   0.688  1.00  0.00           O  
HETATM   25  O   UNL     1       4.004  -1.184   1.370  1.00  0.00           O  
HETATM   26  O   UNL     1       4.887   1.096   0.987  1.00  0.00           O  
HETATM   27  S   UNL     1       4.161  -0.041   0.540  1.00  0.00           S  
HETATM   28  H   UNL     1       1.622  -1.357   0.624  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.210  -3.440  -3.544  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.379   5.165  -1.764  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.723   5.819  -1.284  1.00  0.00           H  
HETATM   32  H   UNL     1       6.795  -0.298  -0.667  1.00  0.00           H  
HETATM   33  H   UNL     1       6.160  -1.938  -0.391  1.00  0.00           H  
HETATM   34  H   UNL     1       6.457  -1.365  -2.050  1.00  0.00           H  
HETATM   35  H   UNL     1       0.862   3.421  -0.365  1.00  0.00           H  
HETATM   36  H   UNL     1       3.147   2.569  -0.041  1.00  0.00           H  
HETATM   37  H   UNL     1       0.172  -1.531  -2.424  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.599  -0.071   2.221  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.107   5.040   1.100  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.764   4.387   0.619  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.665   2.836  -1.060  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.495  -2.306   2.637  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.089  -1.783   3.595  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.135  -0.572   2.816  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.064   3.678  -1.459  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.186   4.018   0.284  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.099  -4.043  -1.937  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.113   1.390  -0.178  1.00  0.00           H  
HETATM   49  H   UNL     1       4.674   0.337  -1.782  1.00  0.00           H  
HETATM   50  H   UNL     1       4.038  -1.303  -1.507  1.00  0.00           H  
CONECT    1    4    4   14   28                                       
CONECT    2   13   13   21   29                                       
CONECT    3    6    6   13   16                                       
CONECT    4    1    1    5   16                                       
CONECT    5    4   11   11   23                                       
CONECT    6    3    3    7   21                                       
CONECT    7    6   22   24   24                                       
CONECT    8   17   18   30   31                                       
CONECT    9   10   32   33   34                                       
CONECT   10    9   27   49   50                                       
CONECT   11    5    5   12   35                                       
CONECT   12   11   14   14   36                                       
CONECT   13    2    2    3   37                                       
CONECT   14    1   12   12   27                                       
CONECT   15   16   16   22   38                                       
CONECT   16    3    4   15   15                                       
CONECT   17    8   18   39   40                                       
CONECT   18    8   17   20   41                                       
CONECT   19   22   42   43   44                                       
CONECT   20   18   23   45   46                                       
CONECT   21    2    6   47                                            
CONECT   22    7   15   19                                            
CONECT   23    5   20   48                                            
CONECT   24    7    7                                                 
CONECT   25   27   27                                                 
CONECT   26   27   27                                                 
CONECT   27   10   14   25   25                                       
CONECT   27   26   26                                                 
CONECT   28    1                                                      
CONECT   29    2                                                      
CONECT   30    8                                                      
CONECT   31    8                                                      
CONECT   32    9                                                      
CONECT   33    9                                                      
CONECT   34    9                                                      
CONECT   35   11                                                      
CONECT   36   12                                                      
CONECT   37   13                                                      
CONECT   38   15                                                      
CONECT   39   17                                                      
CONECT   40   17                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   19                                                      
CONECT   44   19                                                      
CONECT   45   20                                                      
CONECT   46   20                                                      
CONECT   47   21                                                      
CONECT   48   23                                                      
CONECT   49   10                                                      
CONECT   50   10                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
