COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.729  -2.961  -0.594  1.00  0.00           C  
HETATM    2  S   UNL     1      -2.863  -2.104   0.533  1.00  0.00           S  
HETATM    3  C   UNL     1      -0.375  -2.301  -0.541  1.00  0.00           C  
HETATM    4  C   UNL     1       0.663  -2.971  -0.105  1.00  0.00           C  
HETATM    5  C   UNL     1       0.481  -4.353   0.469  1.00  0.00           C  
HETATM    6  C   UNL     1       2.039  -2.360  -0.177  1.00  0.00           C  
HETATM    7  C   UNL     1       2.370  -1.690   1.158  1.00  0.00           C  
HETATM    8  C   UNL     1       3.745  -1.079   1.086  1.00  0.00           C  
HETATM    9  C   UNL     1       3.901   0.209   1.273  1.00  0.00           C  
HETATM   10  C   UNL     1       5.286   0.799   1.337  1.00  0.00           C  
HETATM   11  C   UNL     1       2.694   1.099   1.425  1.00  0.00           C  
HETATM   12  C   UNL     1       5.681   1.322  -0.045  1.00  0.00           C  
HETATM   13  C   UNL     1       7.067   1.913   0.019  1.00  0.00           C  
HETATM   14  C   UNL     1       7.999   1.486  -0.797  1.00  0.00           C  
HETATM   15  C   UNL     1       7.686   0.405  -1.799  1.00  0.00           C  
HETATM   16  C   UNL     1       9.384   2.076  -0.733  1.00  0.00           C  
HETATM   17  P   UNL     1      -3.310  -0.313  -0.511  1.00  0.00           P  
HETATM   18  O   UNL     1      -2.061   0.445  -0.746  1.00  0.00           O  
HETATM   19  O   UNL     1      -3.994  -0.672  -1.923  1.00  0.00           O  
HETATM   20  O   UNL     1      -4.324   0.580   0.365  1.00  0.00           O  
HETATM   21  P   UNL     1      -5.029   2.011   0.147  1.00  0.00           P  
HETATM   22  O   UNL     1      -3.947   3.182   0.370  1.00  0.00           O  
HETATM   23  O   UNL     1      -5.565   2.091  -1.230  1.00  0.00           O  
HETATM   24  O   UNL     1      -6.232   2.183   1.202  1.00  0.00           O  
HETATM   25  H   UNL     1      -1.637  -4.004  -0.293  1.00  0.00           H  
HETATM   26  H   UNL     1      -2.119  -2.909  -1.611  1.00  0.00           H  
HETATM   27  H   UNL     1      -0.260  -1.276  -0.862  1.00  0.00           H  
HETATM   28  H   UNL     1       0.484  -5.085  -0.339  1.00  0.00           H  
HETATM   29  H   UNL     1       1.297  -4.570   1.158  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.468  -4.403   1.002  1.00  0.00           H  
HETATM   31  H   UNL     1       2.772  -3.139  -0.384  1.00  0.00           H  
HETATM   32  H   UNL     1       2.065  -1.616  -0.973  1.00  0.00           H  
HETATM   33  H   UNL     1       1.636  -0.910   1.365  1.00  0.00           H  
HETATM   34  H   UNL     1       2.344  -2.434   1.954  1.00  0.00           H  
HETATM   35  H   UNL     1       4.603  -1.702   0.880  1.00  0.00           H  
HETATM   36  H   UNL     1       5.298   1.620   2.054  1.00  0.00           H  
HETATM   37  H   UNL     1       5.994   0.032   1.651  1.00  0.00           H  
HETATM   38  H   UNL     1       2.372   1.100   2.466  1.00  0.00           H  
HETATM   39  H   UNL     1       2.952   2.114   1.123  1.00  0.00           H  
HETATM   40  H   UNL     1       1.887   0.727   0.795  1.00  0.00           H  
HETATM   41  H   UNL     1       5.669   0.501  -0.762  1.00  0.00           H  
HETATM   42  H   UNL     1       4.974   2.090  -0.359  1.00  0.00           H  
HETATM   43  H   UNL     1       7.291   2.687   0.737  1.00  0.00           H  
HETATM   44  H   UNL     1       6.890   0.744  -2.463  1.00  0.00           H  
HETATM   45  H   UNL     1       8.578   0.184  -2.385  1.00  0.00           H  
HETATM   46  H   UNL     1       7.363  -0.494  -1.275  1.00  0.00           H  
HETATM   47  H   UNL     1       9.991   1.503  -0.032  1.00  0.00           H  
HETATM   48  H   UNL     1       9.840   2.040  -1.722  1.00  0.00           H  
HETATM   49  H   UNL     1       9.322   3.112  -0.399  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.819  -1.170  -1.845  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.553   3.190   1.253  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.703   3.024   1.128  1.00  0.00           H  
CONECT    1    2    3   25   26                                       
CONECT    2    1   17                                                 
CONECT    3    1    4    4   27                                       
CONECT    4    3    3    5    6                                       
CONECT    5    4   28   29   30                                       
CONECT    6    4    7   31   32                                       
CONECT    7    6    8   33   34                                       
CONECT    8    7    9    9   35                                       
CONECT    9    8    8   10   11                                       
CONECT   10    9   12   36   37                                       
CONECT   11    9   38   39   40                                       
CONECT   12   10   13   41   42                                       
CONECT   13   12   14   14   43                                       
CONECT   14   13   13   15   16                                       
CONECT   15   14   44   45   46                                       
CONECT   16   14   47   48   49                                       
CONECT   17    2   18   18   19                                       
CONECT   17   20                                                      
CONECT   18   17   17                                                 
CONECT   19   17   50                                                 
CONECT   20   17   21                                                 
CONECT   21   20   22   23   23                                       
CONECT   21   24                                                      
CONECT   22   21   51                                                 
CONECT   23   21   21                                                 
CONECT   24   21   52                                                 
CONECT   25    1                                                      
CONECT   26    1                                                      
CONECT   27    3                                                      
CONECT   28    5                                                      
CONECT   29    5                                                      
CONECT   30    5                                                      
CONECT   31    6                                                      
CONECT   32    6                                                      
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36   10                                                      
CONECT   37   10                                                      
CONECT   38   11                                                      
CONECT   39   11                                                      
CONECT   40   11                                                      
CONECT   41   12                                                      
CONECT   42   12                                                      
CONECT   43   13                                                      
CONECT   44   15                                                      
CONECT   45   15                                                      
CONECT   46   15                                                      
CONECT   47   16                                                      
CONECT   48   16                                                      
CONECT   49   16                                                      
CONECT   50   19                                                      
CONECT   51   22                                                      
CONECT   52   24                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
