COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -3.695  -0.297   0.499  1.00  0.00           N  
HETATM    2  C   UNL     1       1.668  -0.996   0.870  1.00  0.00           C  
HETATM    3  C   UNL     1       2.791  -1.629   0.158  1.00  0.00           C  
HETATM    4  C   UNL     1       2.555  -2.384  -0.994  1.00  0.00           C  
HETATM    5  C   UNL     1       3.609  -2.975  -1.657  1.00  0.00           C  
HETATM    6  C   UNL     1       4.905  -2.821  -1.181  1.00  0.00           C  
HETATM    7  C   UNL     1       4.098  -1.473   0.630  1.00  0.00           C  
HETATM    8  C   UNL     1       2.386   1.623  -0.891  1.00  0.00           C  
HETATM    9  C   UNL     1       3.813   3.510  -0.499  1.00  0.00           C  
HETATM   10  C   UNL     1       2.913   2.305   1.369  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.443  -2.430  -0.386  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.109  -1.735  -1.574  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.858   0.299  -0.756  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.665   0.251  -3.010  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.486   2.175  -2.206  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.994   0.028   0.855  1.00  0.00           C  
HETATM   17  C   UNL     1       1.437   0.333   1.013  1.00  0.00           C  
HETATM   18  C   UNL     1       2.259   1.438   0.488  1.00  0.00           C  
HETATM   19  C   UNL     1       3.160   2.655  -1.377  1.00  0.00           C  
HETATM   20  C   UNL     1       3.689   3.330   0.873  1.00  0.00           C  
HETATM   21  C   UNL     1       0.148   0.451   1.831  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.487  -1.491   0.826  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.731  -1.485   0.684  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.525  -0.362  -1.776  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.148   1.514  -3.224  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.340   1.571  -0.973  1.00  0.00           C  
HETATM   27  C   UNL     1       0.518  -1.702   1.594  1.00  0.00           C  
HETATM   28  C   UNL     1       5.145  -2.072  -0.037  1.00  0.00           C  
HETATM   29  O   UNL     1      -2.913   1.718   1.616  1.00  0.00           O  
HETATM   30  O   UNL     1       5.941  -3.406  -1.837  1.00  0.00           O  
HETATM   31  O   UNL     1       4.575   4.525  -0.983  1.00  0.00           O  
HETATM   32  O   UNL     1       0.253  -0.743   2.677  1.00  0.00           O  
HETATM   33  O   UNL     1      -2.799  -0.475   2.754  1.00  0.00           O  
HETATM   34  S   UNL     1      -2.623   0.327   1.595  1.00  0.00           S  
HETATM   35  H   UNL     1       1.547  -2.505  -1.364  1.00  0.00           H  
HETATM   36  H   UNL     1       3.427  -3.558  -2.547  1.00  0.00           H  
HETATM   37  H   UNL     1       4.286  -0.886   1.517  1.00  0.00           H  
HETATM   38  H   UNL     1       1.883   0.956  -1.575  1.00  0.00           H  
HETATM   39  H   UNL     1       2.818   2.166   2.435  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.978  -3.351  -0.155  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.407  -2.662  -0.633  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.951  -2.330  -2.474  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.178  -1.645  -1.385  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.181  -0.262  -3.809  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.084   3.163  -2.375  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.901   0.545  -0.100  1.00  0.00           H  
HETATM   47  H   UNL     1       3.260   2.798  -2.443  1.00  0.00           H  
HETATM   48  H   UNL     1       4.199   3.997   1.552  1.00  0.00           H  
HETATM   49  H   UNL     1       0.001   1.401   2.345  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.060  -1.990   1.696  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.518  -1.205   1.034  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.576  -2.071   1.045  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.507  -1.726  -0.355  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.261   1.986  -4.189  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.824   2.087  -0.177  1.00  0.00           H  
HETATM   56  H   UNL     1       0.711  -2.733   1.891  1.00  0.00           H  
HETATM   57  H   UNL     1       6.154  -1.955   0.329  1.00  0.00           H  
HETATM   58  H   UNL     1       6.336  -2.850  -2.523  1.00  0.00           H  
HETATM   59  H   UNL     1       4.090   5.351  -1.116  1.00  0.00           H  
CONECT    1   13   34   22                                            
CONECT    2   17   17    3   27                                       
CONECT    3    4    2    7    7                                       
CONECT    4    5    5    3   35                                       
CONECT    5    4    4    6   36                                       
CONECT    6    5   30   28   28                                       
CONECT    7    3    3   28   37                                       
CONECT    8   19   18   18   38                                       
CONECT    9   31   19   19   20                                       
CONECT   10   20   20   18   39                                       
CONECT   11   12   22   40   41                                       
CONECT   12   24   11   42   43                                       
CONECT   13   26   26   24    1                                       
CONECT   14   25   24   24   44                                       
CONECT   15   25   25   26   45                                       
CONECT   16   34   21   23   46                                       
CONECT   17   18   21    2    2                                       
CONECT   18    8    8   10   17                                       
CONECT   19    9    9    8   47                                       
CONECT   20    9   10   10   48                                       
CONECT   21   17   16   32   49                                       
CONECT   22    1   11   50   51                                       
CONECT   23   16   27   52   53                                       
CONECT   24   14   14   13   12                                       
CONECT   25   15   15   14   54                                       
CONECT   26   15   13   13   55                                       
CONECT   27    2   23   32   56                                       
CONECT   28    6    6    7   57                                       
CONECT   29   34   34                                                 
CONECT   30    6   58                                                 
CONECT   31    9   59                                                 
CONECT   32   21   27                                                 
CONECT   33   34   34                                                 
CONECT   34   29   29   16    1                                       
CONECT   34   33   33                                                 
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    7                                                      
CONECT   38    8                                                      
CONECT   39   10                                                      
CONECT   40   11                                                      
CONECT   41   11                                                      
CONECT   42   12                                                      
CONECT   43   12                                                      
CONECT   44   14                                                      
CONECT   45   15                                                      
CONECT   46   16                                                      
CONECT   47   19                                                      
CONECT   48   20                                                      
CONECT   49   21                                                      
CONECT   50   22                                                      
CONECT   51   22                                                      
CONECT   52   23                                                      
CONECT   53   23                                                      
CONECT   54   25                                                      
CONECT   55   26                                                      
CONECT   56   27                                                      
CONECT   57   28                                                      
CONECT   58   30                                                      
CONECT   59   31                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
