COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       5.982  -1.622   1.161  1.00  0.00           N  
HETATM    2  C   UNL     1       6.190  -0.629   0.337  1.00  0.00           C  
HETATM    3  C   UNL     1       7.508   0.024   0.290  1.00  0.00           C  
HETATM    4  S   UNL     1       7.943   1.367  -0.758  1.00  0.00           S  
HETATM    5  C   UNL     1       9.529   1.405  -0.128  1.00  0.00           C  
HETATM    6  C   UNL     1       9.695   0.463   0.805  1.00  0.00           C  
HETATM    7  C   UNL     1       8.584  -0.311   1.057  1.00  0.00           C  
HETATM    8  N   UNL     1       5.174  -0.193  -0.489  1.00  0.00           N  
HETATM    9  C   UNL     1       3.964  -0.893  -0.539  1.00  0.00           C  
HETATM   10  C   UNL     1       2.762  -0.201  -0.613  1.00  0.00           C  
HETATM   11  C   UNL     1       3.963  -2.282  -0.521  1.00  0.00           C  
HETATM   12  C   UNL     1       2.766  -2.970  -0.571  1.00  0.00           C  
HETATM   13  C   UNL     1       1.571  -2.278  -0.638  1.00  0.00           C  
HETATM   14  C   UNL     1       1.569  -0.895  -0.662  1.00  0.00           C  
HETATM   15  C   UNL     1       0.264  -0.145  -0.735  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.244   0.133   0.680  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.549   0.883   0.607  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.551   2.266   0.578  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.746   2.958   0.511  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.943   2.270   0.472  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.743   0.189   0.563  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.945   0.881   0.501  1.00  0.00           C  
HETATM   23  N   UNL     1      -5.155   0.182   0.463  1.00  0.00           N  
HETATM   24  C   UNL     1      -6.206   0.662  -0.294  1.00  0.00           C  
HETATM   25  N   UNL     1      -6.038   1.709  -1.057  1.00  0.00           N  
HETATM   26  C   UNL     1      -7.516  -0.006  -0.240  1.00  0.00           C  
HETATM   27  S   UNL     1      -7.903  -1.414   0.740  1.00  0.00           S  
HETATM   28  C   UNL     1      -9.510  -1.429   0.167  1.00  0.00           C  
HETATM   29  C   UNL     1      -9.717  -0.434  -0.701  1.00  0.00           C  
HETATM   30  C   UNL     1      -8.625   0.372  -0.936  1.00  0.00           C  
HETATM   31  H   UNL     1       5.091  -1.993   1.258  1.00  0.00           H  
HETATM   32  H   UNL     1      10.296   2.097  -0.443  1.00  0.00           H  
HETATM   33  H   UNL     1      10.630   0.322   1.326  1.00  0.00           H  
HETATM   34  H   UNL     1       8.569  -1.110   1.784  1.00  0.00           H  
HETATM   35  H   UNL     1       5.298   0.599  -1.036  1.00  0.00           H  
HETATM   36  H   UNL     1       2.760   0.879  -0.631  1.00  0.00           H  
HETATM   37  H   UNL     1       4.896  -2.823  -0.468  1.00  0.00           H  
HETATM   38  H   UNL     1       2.764  -4.050  -0.557  1.00  0.00           H  
HETATM   39  H   UNL     1       0.637  -2.818  -0.678  1.00  0.00           H  
HETATM   40  H   UNL     1       0.417   0.799  -1.259  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.470  -0.745  -1.274  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.397  -0.811   1.204  1.00  0.00           H  
HETATM   43  H   UNL     1       0.490   0.733   1.219  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.616   2.806   0.607  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.744   4.038   0.489  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.876   2.811   0.421  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.741  -0.891   0.582  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.256  -0.641   0.967  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.776   2.046  -1.588  1.00  0.00           H  
HETATM   50  H   UNL     1     -10.259  -2.147   0.464  1.00  0.00           H  
HETATM   51  H   UNL     1     -10.672  -0.271  -1.179  1.00  0.00           H  
HETATM   52  H   UNL     1      -8.645   1.217  -1.608  1.00  0.00           H  
CONECT    1    2    2   31                                            
CONECT    2    3    1    1    8                                       
CONECT    3    7    7    4    2                                       
CONECT    4    5    3                                                 
CONECT    5    6    6    4   32                                       
CONECT    6    5    5    7   33                                       
CONECT    7    6    3    3   34                                       
CONECT    8    2    9   35                                            
CONECT    9   11    8   10   10                                       
CONECT   10    9    9   14   36                                       
CONECT   11   12   12    9   37                                       
CONECT   12   11   11   13   38                                       
CONECT   13   12   14   14   39                                       
CONECT   14   13   13   10   15                                       
CONECT   15   14   16   40   41                                       
CONECT   16   15   17   42   43                                       
CONECT   17   16   18   18   21                                       
CONECT   18   17   17   19   44                                       
CONECT   19   18   20   20   45                                       
CONECT   20   19   19   22   46                                       
CONECT   21   17   22   22   47                                       
CONECT   22   21   21   20   23                                       
CONECT   23   22   24   48                                            
CONECT   24   23   26   25   25                                       
CONECT   25   24   24   49                                            
CONECT   26   27   24   30   30                                       
CONECT   27   28   26                                                 
CONECT   28   27   29   29   50                                       
CONECT   29   28   28   30   51                                       
CONECT   30   26   26   29   52                                       
CONECT   31    1                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   15                                                      
CONECT   41   15                                                      
CONECT   42   16                                                      
CONECT   43   16                                                      
CONECT   44   18                                                      
CONECT   45   19                                                      
CONECT   46   20                                                      
CONECT   47   21                                                      
CONECT   48   23                                                      
CONECT   49   25                                                      
CONECT   50   28                                                      
CONECT   51   29                                                      
CONECT   52   30                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
