COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.898  -0.303   0.141  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.213  -0.536  -1.044  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.864  -0.835  -1.014  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.197  -0.901   0.196  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.876  -0.670   1.378  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.224  -0.371   1.354  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.726  -1.228   0.225  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.927   0.047   0.141  1.00  0.00           C  
HETATM    9  N   UNL     1       0.420   0.000   0.150  1.00  0.00           N  
HETATM   10  C   UNL     1       1.163   1.184   0.072  1.00  0.00           C  
HETATM   11  N   UNL     1       0.677   2.394  -0.014  1.00  0.00           N  
HETATM   12  N   UNL     1       1.719   3.325  -0.073  1.00  0.00           N  
HETATM   13  C   UNL     1       2.920   2.661  -0.022  1.00  0.00           C  
HETATM   14  C   UNL     1       4.249   3.078  -0.043  1.00  0.00           C  
HETATM   15  C   UNL     1       5.256   2.158   0.025  1.00  0.00           C  
HETATM   16  C   UNL     1       4.971   0.795   0.117  1.00  0.00           C  
HETATM   17  C   UNL     1       3.662   0.356   0.140  1.00  0.00           C  
HETATM   18  C   UNL     1       2.622   1.289   0.077  1.00  0.00           C  
HETATM   19  N   UNL     1       6.018  -0.132   0.185  1.00  0.00           N  
HETATM   20  C   UNL     1       7.380   0.128   0.676  1.00  0.00           C  
HETATM   21  O   UNL     1      -1.495   1.115   0.064  1.00  0.00           O  
HETATM   22  C   UNL     1       8.384  -0.805  -0.029  1.00  0.00           C  
HETATM   23  S   UNL     1       5.948  -1.737  -0.268  1.00  0.00           S  
HETATM   24  C   UNL     1       7.701  -2.203   0.010  1.00  0.00           C  
HETATM   25  O   UNL     1       5.093  -2.355   0.683  1.00  0.00           O  
HETATM   26  O   UNL     1       5.636  -1.718  -1.654  1.00  0.00           O  
HETATM   27  C   UNL     1      -7.767   0.023  -1.264  1.00  0.00           C  
HETATM   28  N   UNL     1      -7.260   0.005   0.114  1.00  0.00           N  
HETATM   29  C   UNL     1      -8.027  -0.927   0.950  1.00  0.00           C  
HETATM   30  C   UNL     1      -9.488  -0.475   1.012  1.00  0.00           C  
HETATM   31  C   UNL     1     -10.066  -0.436  -0.405  1.00  0.00           C  
HETATM   32  C   UNL     1      -9.220   0.504  -1.268  1.00  0.00           C  
HETATM   33  H   UNL     1      -1.487  -1.746   1.154  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.479  -1.868  -0.621  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.352  -0.723   2.320  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.754  -0.189   2.278  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.733  -0.485  -1.989  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.331  -1.017  -1.935  1.00  0.00           H  
HETATM   39  H   UNL     1      -7.975  -1.928   0.520  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.608  -0.942   1.956  1.00  0.00           H  
HETATM   41  H   UNL     1     -10.060  -1.175   1.620  1.00  0.00           H  
HETATM   42  H   UNL     1      -9.542   0.520   1.454  1.00  0.00           H  
HETATM   43  H   UNL     1     -10.048  -1.438  -0.833  1.00  0.00           H  
HETATM   44  H   UNL     1     -11.093  -0.073  -0.370  1.00  0.00           H  
HETATM   45  H   UNL     1      -9.270   1.514  -0.862  1.00  0.00           H  
HETATM   46  H   UNL     1      -9.601   0.503  -2.289  1.00  0.00           H  
HETATM   47  H   UNL     1      -7.160   0.699  -1.866  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.716  -0.982  -1.684  1.00  0.00           H  
HETATM   49  H   UNL     1       0.875  -0.855   0.212  1.00  0.00           H  
HETATM   50  H   UNL     1       1.610   4.286  -0.140  1.00  0.00           H  
HETATM   51  H   UNL     1       4.484   4.129  -0.115  1.00  0.00           H  
HETATM   52  H   UNL     1       6.284   2.489   0.007  1.00  0.00           H  
HETATM   53  H   UNL     1       3.443  -0.699   0.211  1.00  0.00           H  
HETATM   54  H   UNL     1       7.646   1.165   0.472  1.00  0.00           H  
HETATM   55  H   UNL     1       7.416  -0.049   1.751  1.00  0.00           H  
HETATM   56  H   UNL     1       8.542  -0.486  -1.059  1.00  0.00           H  
HETATM   57  H   UNL     1       9.329  -0.827   0.514  1.00  0.00           H  
HETATM   58  H   UNL     1       8.072  -2.844  -0.790  1.00  0.00           H  
HETATM   59  H   UNL     1       7.830  -2.677   0.983  1.00  0.00           H  
CONECT    1    6    6    2   28                                       
CONECT    2    1    3    3   37                                       
CONECT    3    2    2    4   38                                       
CONECT    4    3    7    5    5                                       
CONECT    5    4    4    6   35                                       
CONECT    6    1    1    5   36                                       
CONECT    7    4    8   33   34                                       
CONECT    8    7   21   21    9                                       
CONECT    9    8   10   49                                            
CONECT   10    9   11   11   18                                       
CONECT   11   10   10   12                                            
CONECT   12   11   13   50                                            
CONECT   13   12   14   18   18                                       
CONECT   14   13   15   15   51                                       
CONECT   15   14   14   16   52                                       
CONECT   16   15   17   17   19                                       
CONECT   17   16   16   18   53                                       
CONECT   18   10   13   13   17                                       
CONECT   19   16   20   23                                            
CONECT   20   19   22   54   55                                       
CONECT   21    8    8                                                 
CONECT   22   20   24   56   57                                       
CONECT   23   19   24   25   25                                       
CONECT   23   26   26                                                 
CONECT   24   22   23   58   59                                       
CONECT   25   23   23                                                 
CONECT   26   23   23                                                 
CONECT   27   32   28   47   48                                       
CONECT   28    1   27   29                                            
CONECT   29   28   30   39   40                                       
CONECT   30   29   31   41   42                                       
CONECT   31   30   32   43   44                                       
CONECT   32   27   31   45   46                                       
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35    5                                                      
CONECT   36    6                                                      
CONECT   37    2                                                      
CONECT   38    3                                                      
CONECT   39   29                                                      
CONECT   40   29                                                      
CONECT   41   30                                                      
CONECT   42   30                                                      
CONECT   43   31                                                      
CONECT   44   31                                                      
CONECT   45   32                                                      
CONECT   46   32                                                      
CONECT   47   27                                                      
CONECT   48   27                                                      
CONECT   49    9                                                      
CONECT   50   12                                                      
CONECT   51   14                                                      
CONECT   52   15                                                      
CONECT   53   17                                                      
CONECT   54   20                                                      
CONECT   55   20                                                      
CONECT   56   22                                                      
CONECT   57   22                                                      
CONECT   58   24                                                      
CONECT   59   24                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
