COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -6.587   0.243   0.284  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.134   1.157  -0.298  1.00  0.00           C  
HETATM    3  C   UNL     1       0.103   1.659   0.105  1.00  0.00           C  
HETATM    4  C   UNL     1       1.045   2.018  -0.848  1.00  0.00           C  
HETATM    5  C   UNL     1       0.754   1.875  -2.200  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.473   1.378  -2.599  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.416   1.018  -1.658  1.00  0.00           C  
HETATM    8  C   UNL     1       3.275   0.216   0.680  1.00  0.00           C  
HETATM    9  C   UNL     1       2.300  -0.689   1.056  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.566  -0.624   0.627  1.00  0.00           C  
HETATM   11  C   UNL     1       2.503  -2.043   0.863  1.00  0.00           C  
HETATM   12  C   UNL     1       3.680  -2.491   0.293  1.00  0.00           C  
HETATM   13  C   UNL     1       4.655  -1.586  -0.084  1.00  0.00           C  
HETATM   14  C   UNL     1       4.452  -0.232   0.111  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.692  -1.970   0.323  1.00  0.00           C  
HETATM   16  C   UNL     1       1.778   2.266  -3.234  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.846  -2.398  -0.316  1.00  0.00           C  
HETATM   18  C   UNL     1       3.902  -3.967   0.083  1.00  0.00           C  
HETATM   19  C   UNL     1       4.129  -4.451  -1.350  1.00  0.00           C  
HETATM   20  C   UNL     1       5.295  -4.417  -0.361  1.00  0.00           C  
HETATM   21  C   UNL     1      -7.825  -1.473  -0.628  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.331  -0.110   1.321  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.141   0.767   0.712  1.00  0.00           C  
HETATM   24  N   UNL     1       2.285   2.522  -0.450  1.00  0.00           N  
HETATM   25  N   UNL     1      -7.671  -0.199  -0.324  1.00  0.00           N  
HETATM   26  N   UNL     1      -3.333   0.276   0.320  1.00  0.00           N  
HETATM   27  O   UNL     1      -1.893   0.889   1.896  1.00  0.00           O  
HETATM   28  O   UNL     1       2.058   2.062   1.964  1.00  0.00           O  
HETATM   29  O   UNL     1       4.302   2.539   0.972  1.00  0.00           O  
HETATM   30  S   UNL     1       3.014   1.942   0.919  1.00  0.00           S  
HETATM   31  H   UNL     1      -6.499   1.293   0.521  1.00  0.00           H  
HETATM   32  H   UNL     1       0.327   1.770   1.156  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.693   1.270  -3.651  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.371   0.625  -1.974  1.00  0.00           H  
HETATM   35  H   UNL     1       1.381  -0.339   1.501  1.00  0.00           H  
HETATM   36  H   UNL     1       1.742  -2.750   1.157  1.00  0.00           H  
HETATM   37  H   UNL     1       5.574  -1.936  -0.528  1.00  0.00           H  
HETATM   38  H   UNL     1       5.214   0.475  -0.183  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.910  -2.670   0.579  1.00  0.00           H  
HETATM   40  H   UNL     1       2.407   1.406  -3.465  1.00  0.00           H  
HETATM   41  H   UNL     1       1.272   2.599  -4.140  1.00  0.00           H  
HETATM   42  H   UNL     1       2.397   3.074  -2.845  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.978  -3.440  -0.568  1.00  0.00           H  
HETATM   44  H   UNL     1       3.351  -4.625   0.755  1.00  0.00           H  
HETATM   45  H   UNL     1       3.728  -5.427  -1.622  1.00  0.00           H  
HETATM   46  H   UNL     1       4.118  -3.702  -2.142  1.00  0.00           H  
HETATM   47  H   UNL     1       6.052  -3.645  -0.501  1.00  0.00           H  
HETATM   48  H   UNL     1       5.661  -5.370   0.019  1.00  0.00           H  
HETATM   49  H   UNL     1      -8.726  -1.798  -1.126  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.590   0.756   1.929  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.921  -0.893   1.959  1.00  0.00           H  
HETATM   52  H   UNL     1       2.720   3.212  -0.975  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.531   0.179  -0.625  1.00  0.00           H  
CONECT    1   10   25   25   31                                       
CONECT    2    3    3    7   23                                       
CONECT    3    4    2    2   32                                       
CONECT    4   24    5    5    3                                       
CONECT    5   16    4    4    6                                       
CONECT    6    5    7    7   33                                       
CONECT    7    6    6    2   34                                       
CONECT    8   30    9    9   14                                       
CONECT    9    8    8   11   35                                       
CONECT   10   22   15   15    1                                       
CONECT   11    9   12   12   36                                       
CONECT   12   11   11   13   18                                       
CONECT   13   14   14   12   37                                       
CONECT   14    8   13   13   38                                       
CONECT   15   10   10   17   39                                       
CONECT   16    5   40   41   42                                       
CONECT   17   15   21   21   43                                       
CONECT   18   12   20   19   44                                       
CONECT   19   20   18   45   46                                       
CONECT   20   18   19   47   48                                       
CONECT   21   17   17   25   49                                       
CONECT   22   26   10   50   51                                       
CONECT   23    2   27   27   26                                       
CONECT   24    4   30   52                                            
CONECT   25    1    1   21                                            
CONECT   26   23   22   53                                            
CONECT   27   23   23                                                 
CONECT   28   30   30                                                 
CONECT   29   30   30                                                 
CONECT   30   24   28   28   29                                       
CONECT   30   29    8                                                 
CONECT   31    1                                                      
CONECT   32    3                                                      
CONECT   33    6                                                      
CONECT   34    7                                                      
CONECT   35    9                                                      
CONECT   36   11                                                      
CONECT   37   13                                                      
CONECT   38   14                                                      
CONECT   39   15                                                      
CONECT   40   16                                                      
CONECT   41   16                                                      
CONECT   42   16                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   19                                                      
CONECT   46   19                                                      
CONECT   47   20                                                      
CONECT   48   20                                                      
CONECT   49   21                                                      
CONECT   50   22                                                      
CONECT   51   22                                                      
CONECT   52   24                                                      
CONECT   53   26                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
