COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.127   0.737  -0.052  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.098  -0.060  -0.926  1.00  0.00           C  
HETATM    3  N   UNL     1      -3.884  -1.495  -0.686  1.00  0.00           N  
HETATM    4  C   UNL     1      -2.585  -2.071  -1.070  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.502  -1.110  -0.613  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.738   0.129  -0.167  1.00  0.00           C  
HETATM    7  S   UNL     1       0.216  -1.466  -0.597  1.00  0.00           S  
HETATM    8  C   UNL     1       0.612   0.074   0.011  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.516   0.826   0.195  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.846  -2.258  -0.132  1.00  0.00           C  
HETATM   11  O   UNL     1      -5.911  -1.763   0.178  1.00  0.00           O  
HETATM   12  O   UNL     1      -4.627  -3.571   0.078  1.00  0.00           O  
HETATM   13  C   UNL     1      -5.638  -4.282   0.640  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.487  -5.569   0.872  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.494   2.198   0.706  1.00  0.00           C  
HETATM   16  N   UNL     1       1.900   0.507   0.283  1.00  0.00           N  
HETATM   17  C   UNL     1       2.947  -0.314   0.066  1.00  0.00           C  
HETATM   18  C   UNL     1       4.348   0.157   0.362  1.00  0.00           C  
HETATM   19  C   UNL     1       5.326  -0.942   0.036  1.00  0.00           C  
HETATM   20  S   UNL     1       5.869  -2.182   1.158  1.00  0.00           S  
HETATM   21  C   UNL     1       6.892  -2.898  -0.081  1.00  0.00           C  
HETATM   22  C   UNL     1       6.776  -2.202  -1.213  1.00  0.00           C  
HETATM   23  C   UNL     1       5.909  -1.126  -1.150  1.00  0.00           C  
HETATM   24  O   UNL     1       2.761  -1.431  -0.367  1.00  0.00           O  
HETATM   25  O   UNL     1      -0.391   3.235  -0.149  1.00  0.00           O  
HETATM   26  O   UNL     1      -0.568   2.402   1.903  1.00  0.00           O  
HETATM   27  C   UNL     1      -0.375   4.567   0.428  1.00  0.00           C  
HETATM   28  C   UNL     1       0.437   5.520  -0.467  1.00  0.00           C  
HETATM   29  C   UNL     1      -0.532   6.632  -0.919  1.00  0.00           C  
HETATM   30  C   UNL     1      -1.636   6.639   0.168  1.00  0.00           C  
HETATM   31  C   UNL     1      -1.809   5.133   0.490  1.00  0.00           C  
HETATM   32  H   UNL     1      -3.100   1.773  -0.388  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.457   0.699   0.987  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.123   0.205  -0.668  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.914   0.167  -1.976  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.451  -3.037  -0.584  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.541  -2.193  -2.152  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.565  -3.792   0.897  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.560  -6.059   0.615  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.291  -6.135   1.319  1.00  0.00           H  
HETATM   41  H   UNL     1       2.049   1.401   0.629  1.00  0.00           H  
HETATM   42  H   UNL     1       4.572   1.035  -0.244  1.00  0.00           H  
HETATM   43  H   UNL     1       4.429   0.414   1.418  1.00  0.00           H  
HETATM   44  H   UNL     1       7.518  -3.768   0.055  1.00  0.00           H  
HETATM   45  H   UNL     1       7.316  -2.462  -2.112  1.00  0.00           H  
HETATM   46  H   UNL     1       5.722  -0.480  -1.995  1.00  0.00           H  
HETATM   47  H   UNL     1       0.057   4.535   1.428  1.00  0.00           H  
HETATM   48  H   UNL     1       1.263   5.951   0.099  1.00  0.00           H  
HETATM   49  H   UNL     1       0.819   4.982  -1.335  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.020   7.595  -0.949  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.958   6.395  -1.893  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.306   7.187   1.051  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.561   7.062  -0.224  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.441   4.654  -0.257  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.228   5.002   1.488  1.00  0.00           H  
CONECT    1    6    2   32   33                                       
CONECT    2    1    3   34   35                                       
CONECT    3    2    4   10                                            
CONECT    4    3    5   36   37                                       
CONECT    5    4    6    6    7                                       
CONECT    6    1    5    5    9                                       
CONECT    7    5    8                                                 
CONECT    8    7   16    9    9                                       
CONECT    9    6    8    8   15                                       
CONECT   10    3   12   11   11                                       
CONECT   11   10   10                                                 
CONECT   12   10   13                                                 
CONECT   13   12   14   14   38                                       
CONECT   14   13   13   39   40                                       
CONECT   15    9   26   26   25                                       
CONECT   16    8   17   41                                            
CONECT   17   16   18   24   24                                       
CONECT   18   17   19   42   43                                       
CONECT   19   18   20   23   23                                       
CONECT   20   19   21                                                 
CONECT   21   20   22   22   44                                       
CONECT   22   21   21   23   45                                       
CONECT   23   19   19   22   46                                       
CONECT   24   17   17                                                 
CONECT   25   15   27                                                 
CONECT   26   15   15                                                 
CONECT   27   25   28   31   47                                       
CONECT   28   27   29   48   49                                       
CONECT   29   28   30   50   51                                       
CONECT   30   29   31   52   53                                       
CONECT   31   27   30   54   55                                       
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    2                                                      
CONECT   36    4                                                      
CONECT   37    4                                                      
CONECT   38   13                                                      
CONECT   39   14                                                      
CONECT   40   14                                                      
CONECT   41   16                                                      
CONECT   42   18                                                      
CONECT   43   18                                                      
CONECT   44   21                                                      
CONECT   45   22                                                      
CONECT   46   23                                                      
CONECT   47   27                                                      
CONECT   48   28                                                      
CONECT   49   28                                                      
CONECT   50   29                                                      
CONECT   51   29                                                      
CONECT   52   30                                                      
CONECT   53   30                                                      
CONECT   54   31                                                      
CONECT   55   31                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
