COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.579  -0.262  -1.267  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.779   0.232  -0.789  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.599  -1.782  -1.084  1.00  0.00           C  
HETATM    4  C   UNL     1       0.803  -1.479  -1.032  1.00  0.00           C  
HETATM    5  C   UNL     1       1.255  -2.671  -0.173  1.00  0.00           C  
HETATM    6  C   UNL     1       2.756  -2.913  -0.457  1.00  0.00           C  
HETATM    7  C   UNL     1       2.450  -1.405   1.269  1.00  0.00           C  
HETATM    8  C   UNL     1       2.137  -0.081   0.554  1.00  0.00           C  
HETATM    9  C   UNL     1       1.858  -0.372  -0.924  1.00  0.00           C  
HETATM   10  C   UNL     1       0.653   2.292   0.581  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.411   3.151   0.825  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.431   4.405   0.246  1.00  0.00           C  
HETATM   13  O   UNL     1       3.063  -0.798  -1.562  1.00  0.00           O  
HETATM   14  N   UNL     1      -0.491  -0.982  -0.545  1.00  0.00           N  
HETATM   15  C   UNL     1      -2.907  -1.244  -0.564  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.434  -1.732   0.617  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.634  -1.238   1.095  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.303  -0.252   0.395  1.00  0.00           C  
HETATM   19  O   UNL     1       3.452  -2.102   0.507  1.00  0.00           O  
HETATM   20  O   UNL     1       1.263  -2.225   1.206  1.00  0.00           O  
HETATM   21  S   UNL     1       0.679   0.689   1.311  1.00  0.00           S  
HETATM   22  C   UNL     1       1.694   2.697  -0.246  1.00  0.00           C  
HETATM   23  C   UNL     1       1.668   3.952  -0.821  1.00  0.00           C  
HETATM   24  C   UNL     1       0.607   4.805  -0.576  1.00  0.00           C  
HETATM   25  H   UNL     1      -3.169   0.117  -2.192  1.00  0.00           H  
HETATM   26  H   UNL     1      -5.306   0.996  -1.341  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.591  -1.727  -2.173  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.483  -2.820  -0.772  1.00  0.00           H  
HETATM   29  H   UNL     1       0.707  -1.793  -2.072  1.00  0.00           H  
HETATM   30  H   UNL     1       0.638  -3.556  -0.327  1.00  0.00           H  
HETATM   31  H   UNL     1       3.003  -3.966  -0.316  1.00  0.00           H  
HETATM   32  H   UNL     1       3.006  -2.599  -1.470  1.00  0.00           H  
HETATM   33  H   UNL     1       2.771  -1.248   2.299  1.00  0.00           H  
HETATM   34  H   UNL     1       2.991   0.591   0.640  1.00  0.00           H  
HETATM   35  H   UNL     1       1.488   0.532  -1.409  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.222   2.839   1.467  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.258   5.073   0.435  1.00  0.00           H  
HETATM   38  H   UNL     1       3.777  -0.146  -1.530  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.609  -0.005  -0.766  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.911  -2.502   1.164  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.045  -1.620   2.017  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.240   0.133   0.768  1.00  0.00           H  
HETATM   43  H   UNL     1       2.523   2.032  -0.438  1.00  0.00           H  
HETATM   44  H   UNL     1       2.476   4.268  -1.464  1.00  0.00           H  
HETATM   45  H   UNL     1       0.588   5.786  -1.028  1.00  0.00           H  
CONECT    1   15   15    2   25                                       
CONECT    2   18   18    1   26                                       
CONECT    3   15   14   27   28                                       
CONECT    4    9   14    5   29                                       
CONECT    5    4   20    6   30                                       
CONECT    6    5   19   31   32                                       
CONECT    7    8   19   20   33                                       
CONECT    8   21    9    7   34                                       
CONECT    9   13    8    4   35                                       
CONECT   10   21   11   11   22                                       
CONECT   11   10   10   12   36                                       
CONECT   12   11   24   24   37                                       
CONECT   13    9   38                                                 
CONECT   14    3    4   39                                            
CONECT   15   16    3    1    1                                       
CONECT   16   17   17   15   40                                       
CONECT   17   16   16   18   41                                       
CONECT   18   17    2    2   42                                       
CONECT   19    7    6                                                 
CONECT   20    7    5                                                 
CONECT   21   10    8                                                 
CONECT   22   10   23   23   43                                       
CONECT   23   22   22   24   44                                       
CONECT   24   12   12   23   45                                       
CONECT   25    1                                                      
CONECT   26    2                                                      
CONECT   27    3                                                      
CONECT   28    3                                                      
CONECT   29    4                                                      
CONECT   30    5                                                      
CONECT   31    6                                                      
CONECT   32    6                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35    9                                                      
CONECT   36   11                                                      
CONECT   37   12                                                      
CONECT   38   13                                                      
CONECT   39   14                                                      
CONECT   40   16                                                      
CONECT   41   17                                                      
CONECT   42   18                                                      
CONECT   43   22                                                      
CONECT   44   23                                                      
CONECT   45   24                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
