COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -1.451   0.164  -0.044  1.00  0.00           N  
HETATM    2  C   UNL     1       1.742  -2.504   0.173  1.00  0.00           C  
HETATM    3  C   UNL     1       4.816   1.715   0.171  1.00  0.00           C  
HETATM    4  C   UNL     1       4.829   3.071   0.394  1.00  0.00           C  
HETATM    5  C   UNL     1       3.654   3.806   0.329  1.00  0.00           C  
HETATM    6  C   UNL     1       2.464   3.180   0.045  1.00  0.00           C  
HETATM    7  C   UNL     1       0.933  -0.263  -0.189  1.00  0.00           C  
HETATM    8  C   UNL     1       2.434   1.796  -0.182  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.825  -0.336   0.036  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.606  -0.417  -1.099  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.887   1.950   1.789  1.00  0.00           C  
HETATM   12  C   UNL     1       1.147   1.155  -0.472  1.00  0.00           C  
HETATM   13  C   UNL     1       0.455  -2.938   0.395  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.610  -2.055   0.323  1.00  0.00           C  
HETATM   15  C   UNL     1       3.618   1.054  -0.125  1.00  0.00           C  
HETATM   16  C   UNL     1       2.003  -1.163  -0.127  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.383  -0.722   0.031  1.00  0.00           C  
HETATM   18  N   UNL     1      -5.177   0.345   0.082  1.00  0.00           N  
HETATM   19  C   UNL     1       2.884  -3.484   0.261  1.00  0.00           C  
HETATM   20  O   UNL     1       0.244   1.814  -0.957  1.00  0.00           O  
HETATM   21  C   UNL     1      -3.802   0.836  -0.079  1.00  0.00           C  
HETATM   22  C   UNL     1      -6.933  -1.118  -0.799  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.102   1.452   0.359  1.00  0.00           C  
HETATM   24  O   UNL     1       2.376  -4.780   0.582  1.00  0.00           O  
HETATM   25  S   UNL     1       3.663  -0.675  -0.417  1.00  0.00           S  
HETATM   26  H   UNL     1      -1.286   1.114  -0.154  1.00  0.00           H  
HETATM   27  H   UNL     1       5.738   1.155   0.224  1.00  0.00           H  
HETATM   28  H   UNL     1       5.761   3.568   0.620  1.00  0.00           H  
HETATM   29  H   UNL     1       3.674   4.872   0.503  1.00  0.00           H  
HETATM   30  H   UNL     1       1.551   3.754  -0.003  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.004  -1.039  -0.777  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.973  -0.840   0.991  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.736   0.262  -1.942  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.849  -1.162  -1.345  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.965   1.112   2.482  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.898   2.400   1.872  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.646   2.694   2.032  1.00  0.00           H  
HETATM   38  H   UNL     1       0.273  -3.977   0.626  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.616  -2.407   0.495  1.00  0.00           H  
HETATM   40  H   UNL     1       3.402  -3.524  -0.697  1.00  0.00           H  
HETATM   41  H   UNL     1       3.579  -3.163   1.036  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.584   1.568   0.698  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.696   1.303  -1.059  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.803  -1.796   0.044  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.690  -0.373  -0.553  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.251  -1.683  -1.675  1.00  0.00           H  
HETATM   47  H   UNL     1      -7.129   1.104   0.245  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.915   2.266  -0.342  1.00  0.00           H  
HETATM   49  H   UNL     1       3.057  -5.462   0.655  1.00  0.00           H  
CONECT    1   17    9   26                                            
CONECT    2   16   19   13   13                                       
CONECT    3    4   15   15   27                                       
CONECT    4    5    5    3   28                                       
CONECT    5    4    4    6   29                                       
CONECT    6    5    8    8   30                                       
CONECT    7   12   16   16   17                                       
CONECT    8    6    6   15   12                                       
CONECT    9    1   21   31   32                                       
CONECT   10   18   22   33   34                                       
CONECT   11   23   35   36   37                                       
CONECT   12    8   20   20    7                                       
CONECT   13    2    2   14   38                                       
CONECT   14   17   17   13   39                                       
CONECT   15    3    3    8   25                                       
CONECT   16   25    7    7    2                                       
CONECT   17    7    1   14   14                                       
CONECT   18   21   23   10                                            
CONECT   19    2   24   40   41                                       
CONECT   20   12   12                                                 
CONECT   21    9   18   42   43                                       
CONECT   22   10   44   45   46                                       
CONECT   23   18   11   47   48                                       
CONECT   24   19   49                                                 
CONECT   25   15   16                                                 
CONECT   26    1                                                      
CONECT   27    3                                                      
CONECT   28    4                                                      
CONECT   29    5                                                      
CONECT   30    6                                                      
CONECT   31    9                                                      
CONECT   32    9                                                      
CONECT   33   10                                                      
CONECT   34   10                                                      
CONECT   35   11                                                      
CONECT   36   11                                                      
CONECT   37   11                                                      
CONECT   38   13                                                      
CONECT   39   14                                                      
CONECT   40   19                                                      
CONECT   41   19                                                      
CONECT   42   21                                                      
CONECT   43   21                                                      
CONECT   44   22                                                      
CONECT   45   22                                                      
CONECT   46   22                                                      
CONECT   47   23                                                      
CONECT   48   23                                                      
CONECT   49   24                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
