COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.842   0.418   0.057  1.00  0.00           C  
HETATM    2  O   UNL     1      -8.273  -2.451   1.620  1.00  0.00           O  
HETATM    3  O   UNL     1      -8.152  -2.969  -0.822  1.00  0.00           O  
HETATM    4  S   UNL     1      -8.231  -2.049   0.258  1.00  0.00           S  
HETATM    5  N   UNL     1      -9.588  -1.137  -0.002  1.00  0.00           N  
HETATM    6  C   UNL     1      -6.842  -0.976   0.100  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.356  -0.307   1.208  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.267   0.535   1.083  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.236  -0.807  -1.131  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.147   0.036  -1.255  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.665   0.709  -0.149  1.00  0.00           C  
HETATM   12 SE   UNL     1      -3.121   1.904  -0.326  1.00  0.00          Se  
HETATM   13  C   UNL     1      -1.644   0.660   0.011  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.314   1.411  -0.082  1.00  0.00           C  
HETATM   15  O   UNL     1      -0.239   2.379   0.966  1.00  0.00           O  
HETATM   16  H   UNL     1       0.827  -0.020   1.055  1.00  0.00           H  
HETATM   17  H   UNL     1       0.735  -0.371  -0.688  1.00  0.00           H  
HETATM   18  H   UNL     1     -10.465  -1.548   0.041  1.00  0.00           H  
HETATM   19  H   UNL     1      -9.505  -0.190  -0.199  1.00  0.00           H  
HETATM   20  H   UNL     1      -6.826  -0.442   2.170  1.00  0.00           H  
HETATM   21  H   UNL     1      -4.887   1.058   1.948  1.00  0.00           H  
HETATM   22  H   UNL     1      -6.613  -1.333  -1.995  1.00  0.00           H  
HETATM   23  H   UNL     1      -4.674   0.168  -2.217  1.00  0.00           H  
HETATM   24  H   UNL     1      -1.751   0.231   1.007  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.664  -0.137  -0.732  1.00  0.00           H  
HETATM   26  H   UNL     1      -0.247   1.914  -1.046  1.00  0.00           H  
HETATM   27  H   UNL     1      -0.292   2.001   1.855  1.00  0.00           H  
HETATM   28 TE   UNL     1       2.733   1.458  -0.252  1.00  0.00          Te  
HETATM   29  C   UNL     1       4.380   0.043  -0.055  1.00  0.00           C  
HETATM   30  C   UNL     1       4.839  -0.640  -1.165  1.00  0.00           C  
HETATM   31  C   UNL     1       5.886  -1.541  -1.043  1.00  0.00           C  
HETATM   32  C   UNL     1       6.475  -1.755   0.197  1.00  0.00           C  
HETATM   33  C   UNL     1       6.011  -1.066   1.311  1.00  0.00           C  
HETATM   34  C   UNL     1       4.967  -0.163   1.180  1.00  0.00           C  
HETATM   35  O   UNL     1       6.337  -2.213  -2.136  1.00  0.00           O  
HETATM   36  O   UNL     1       7.503  -2.639   0.321  1.00  0.00           O  
HETATM   37  O   UNL     1       6.584  -1.273   2.527  1.00  0.00           O  
HETATM   38  H   UNL     1       4.381  -0.472  -2.129  1.00  0.00           H  
HETATM   39  H   UNL     1       4.606   0.373   2.045  1.00  0.00           H  
HETATM   40  C   UNL     1       5.684  -1.943  -3.379  1.00  0.00           C  
HETATM   41  C   UNL     1       8.825  -2.125   0.147  1.00  0.00           C  
HETATM   42  C   UNL     1       6.056  -0.530   3.628  1.00  0.00           C  
HETATM   43  H   UNL     1       5.789  -0.885  -3.622  1.00  0.00           H  
HETATM   44  H   UNL     1       6.139  -2.543  -4.166  1.00  0.00           H  
HETATM   45  H   UNL     1       4.627  -2.193  -3.296  1.00  0.00           H  
HETATM   46  H   UNL     1       8.921  -1.701  -0.853  1.00  0.00           H  
HETATM   47  H   UNL     1       9.014  -1.350   0.890  1.00  0.00           H  
HETATM   48  H   UNL     1       9.548  -2.931   0.271  1.00  0.00           H  
HETATM   49  H   UNL     1       5.000  -0.771   3.756  1.00  0.00           H  
HETATM   50  H   UNL     1       6.600  -0.789   4.536  1.00  0.00           H  
HETATM   51  H   UNL     1       6.163   0.536   3.431  1.00  0.00           H  
CONECT    1   14   16   17   28                                       
CONECT    2    4    4                                                 
CONECT    3    4    4                                                 
CONECT    4    6    3    3    5                                       
CONECT    4    2    2                                                 
CONECT    5    4   18   19                                            
CONECT    6    7    7    9    4                                       
CONECT    7    8    6    6   20                                       
CONECT    8   11   11    7   21                                       
CONECT    9   10   10    6   22                                       
CONECT   10   11    9    9   23                                       
CONECT   11   12    8    8   10                                       
CONECT   12   13   11                                                 
CONECT   13   14   12   24   25                                       
CONECT   14    1   15   13   26                                       
CONECT   15   14   27                                                 
CONECT   16    1                                                      
CONECT   17    1                                                      
CONECT   18    5                                                      
CONECT   19    5                                                      
CONECT   20    7                                                      
CONECT   21    8                                                      
CONECT   22    9                                                      
CONECT   23   10                                                      
CONECT   24   13                                                      
CONECT   25   13                                                      
CONECT   26   14                                                      
CONECT   27   15                                                      
CONECT   28    1   29                                                 
CONECT   29   28   30   34   34                                       
CONECT   30   29   31   31   38                                       
CONECT   31   30   30   32   35                                       
CONECT   32   31   33   33   36                                       
CONECT   33   32   32   34   37                                       
CONECT   34   33   29   29   39                                       
CONECT   35   31   40                                                 
CONECT   36   32   41                                                 
CONECT   37   33   42                                                 
CONECT   38   30                                                      
CONECT   39   34                                                      
CONECT   40   35   43   44   45                                       
CONECT   41   36   46   47   48                                       
CONECT   42   37   49   50   51                                       
CONECT   43   40                                                      
CONECT   44   40                                                      
CONECT   45   40                                                      
CONECT   46   41                                                      
CONECT   47   41                                                      
CONECT   48   41                                                      
CONECT   49   42                                                      
CONECT   50   42                                                      
CONECT   51   42                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
