COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.835  -2.575  -0.571  1.00  0.00           C  
HETATM    2  C   UNL     1       5.597  -1.244   0.095  1.00  0.00           C  
HETATM    3  O   UNL     1       6.393  -0.347  -0.047  1.00  0.00           O  
HETATM    4  C   UNL     1       4.365  -1.032   0.937  1.00  0.00           C  
HETATM    5  C   UNL     1       4.618   0.077   1.988  1.00  0.00           C  
HETATM    6  C   UNL     1       3.537   1.165   1.746  1.00  0.00           C  
HETATM    7  C   UNL     1       2.415   0.385   1.051  1.00  0.00           C  
HETATM    8  C   UNL     1       3.217  -0.519   0.075  1.00  0.00           C  
HETATM    9  C   UNL     1       3.774   0.326  -1.073  1.00  0.00           C  
HETATM   10  C   UNL     1       2.259  -1.559  -0.473  1.00  0.00           C  
HETATM   11  C   UNL     1       1.194  -0.812  -1.294  1.00  0.00           C  
HETATM   12  C   UNL     1       0.473   0.233  -0.449  1.00  0.00           C  
HETATM   13  C   UNL     1       1.447   1.211   0.226  1.00  0.00           C  
HETATM   14  C   UNL     1       0.655   2.184   1.101  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.328   2.968   0.229  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.293   1.998  -0.455  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.070   1.217   0.608  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.509   1.021  -1.318  1.00  0.00           C  
HETATM   19  C   UNL     1       0.275   1.794  -2.381  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.478   0.054  -2.001  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.258  -0.721  -0.938  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.035   0.247  -0.075  1.00  0.00           C  
HETATM   23  O   UNL     1      -3.760  -0.482   0.917  1.00  0.00           O  
HETATM   24  S   UNL     1      -5.197  -0.797   0.529  1.00  0.00           S  
HETATM   25  O   UNL     1      -5.818  -1.334   1.688  1.00  0.00           O  
HETATM   26  O   UNL     1      -5.687   0.348  -0.156  1.00  0.00           O  
HETATM   27  N   UNL     1      -5.147  -2.021  -0.585  1.00  0.00           N  
HETATM   28  H   UNL     1       5.380  -2.572  -1.561  1.00  0.00           H  
HETATM   29  H   UNL     1       6.907  -2.748  -0.664  1.00  0.00           H  
HETATM   30  H   UNL     1       5.390  -3.367   0.031  1.00  0.00           H  
HETATM   31  H   UNL     1       4.081  -1.962   1.430  1.00  0.00           H  
HETATM   32  H   UNL     1       4.519  -0.331   2.994  1.00  0.00           H  
HETATM   33  H   UNL     1       5.613   0.501   1.853  1.00  0.00           H  
HETATM   34  H   UNL     1       3.189   1.582   2.691  1.00  0.00           H  
HETATM   35  H   UNL     1       3.920   1.951   1.095  1.00  0.00           H  
HETATM   36  H   UNL     1       1.872  -0.224   1.774  1.00  0.00           H  
HETATM   37  H   UNL     1       2.951   0.802  -1.606  1.00  0.00           H  
HETATM   38  H   UNL     1       4.437   1.092  -0.672  1.00  0.00           H  
HETATM   39  H   UNL     1       4.330  -0.313  -1.759  1.00  0.00           H  
HETATM   40  H   UNL     1       2.797  -2.259  -1.112  1.00  0.00           H  
HETATM   41  H   UNL     1       1.786  -2.096   0.349  1.00  0.00           H  
HETATM   42  H   UNL     1       1.694  -0.315  -2.125  1.00  0.00           H  
HETATM   43  H   UNL     1       0.464  -1.518  -1.689  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.083  -0.275   0.339  1.00  0.00           H  
HETATM   45  H   UNL     1       1.998   1.766  -0.535  1.00  0.00           H  
HETATM   46  H   UNL     1       0.104   1.625   1.858  1.00  0.00           H  
HETATM   47  H   UNL     1       1.341   2.876   1.588  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.893   3.664   0.850  1.00  0.00           H  
HETATM   49  H   UNL     1       0.226   3.523  -0.527  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.991   2.557  -1.077  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.372   0.657   1.230  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.633   1.913   1.230  1.00  0.00           H  
HETATM   53  H   UNL     1       0.965   2.483  -1.893  1.00  0.00           H  
HETATM   54  H   UNL     1       0.837   1.094  -2.999  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.418   2.356  -3.006  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.173   0.616  -2.625  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.917  -0.645  -2.622  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.948  -1.411  -1.424  1.00  0.00           H  
HETATM   59  H   UNL     1      -1.563  -1.283  -0.314  1.00  0.00           H  
HETATM   60  H   UNL     1      -3.734   0.807  -0.697  1.00  0.00           H  
HETATM   61  H   UNL     1      -4.294  -2.390  -0.862  1.00  0.00           H  
HETATM   62  H   UNL     1      -5.971  -2.369  -0.961  1.00  0.00           H  
CONECT    1    2   28   29   30                                       
CONECT    2    3    3    4    1                                       
CONECT    3    2    2                                                 
CONECT    4    8    2    5   31                                       
CONECT    5    6    4   32   33                                       
CONECT    6    7    5   34   35                                       
CONECT    7   13    8    6   36                                       
CONECT    8    9   10    7    4                                       
CONECT    9    8   37   38   39                                       
CONECT   10   11    8   40   41                                       
CONECT   11   12   10   42   43                                       
CONECT   12   18   13   11   44                                       
CONECT   13   12   14    7   45                                       
CONECT   14   15   13   46   47                                       
CONECT   15   16   14   48   49                                       
CONECT   16   18   15   17   50                                       
CONECT   17   16   22   51   52                                       
CONECT   18   19   16   20   12                                       
CONECT   19   18   53   54   55                                       
CONECT   20   18   21   56   57                                       
CONECT   21   20   22   58   59                                       
CONECT   22   17   21   23   60                                       
CONECT   23   22   24                                                 
CONECT   24   27   23   25   25                                       
CONECT   24   26   26                                                 
CONECT   25   24   24                                                 
CONECT   26   24   24                                                 
CONECT   27   24   61   62                                            
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    5                                                      
CONECT   34    6                                                      
CONECT   35    6                                                      
CONECT   36    7                                                      
CONECT   37    9                                                      
CONECT   38    9                                                      
CONECT   39    9                                                      
CONECT   40   10                                                      
CONECT   41   10                                                      
CONECT   42   11                                                      
CONECT   43   11                                                      
CONECT   44   12                                                      
CONECT   45   13                                                      
CONECT   46   14                                                      
CONECT   47   14                                                      
CONECT   48   15                                                      
CONECT   49   15                                                      
CONECT   50   16                                                      
CONECT   51   17                                                      
CONECT   52   17                                                      
CONECT   53   19                                                      
CONECT   54   19                                                      
CONECT   55   19                                                      
CONECT   56   20                                                      
CONECT   57   20                                                      
CONECT   58   21                                                      
CONECT   59   21                                                      
CONECT   60   22                                                      
CONECT   61   27                                                      
CONECT   62   27                                                      
MASTER        0    0    0    0    0    0    0    0   62    0   62    0
END
