COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  O   UNL     1     -18.385   0.336  68.850  1.00  0.00           O  
HETATM    2  C   UNL     1     -18.167  -0.447  69.744  1.00  0.00           C  
HETATM    3  C   UNL     1     -19.393  -1.012  70.418  1.00  0.00           C  
HETATM    4  C   UNL     1     -19.985  -0.187  71.550  1.00  0.00           C  
HETATM    5  C   UNL     1     -21.175  -0.910  72.183  1.00  0.00           C  
HETATM    6  C   UNL     1     -21.682  -2.108  71.381  1.00  0.00           C  
HETATM    7  C   UNL     1     -22.804  -2.802  72.143  1.00  0.00           C  
HETATM    8  C   UNL     1     -20.564  -3.111  71.080  1.00  0.00           C  
HETATM    9  C   UNL     1     -19.203  -2.460  70.846  1.00  0.00           C  
HETATM   10  N   UNL     1     -16.913  -0.822  70.060  1.00  0.00           N  
HETATM   11  C   UNL     1     -15.797  -0.262  69.278  1.00  0.00           C  
HETATM   12  C   UNL     1     -14.489  -0.322  70.068  1.00  0.00           C  
HETATM   13  C   UNL     1     -14.399   0.889  71.000  1.00  0.00           C  
HETATM   14  S   UNL     1     -12.837   1.009  71.833  1.00  0.00           S  
HETATM   15  C   UNL     1     -13.051  -0.182  73.118  1.00  0.00           C  
HETATM   16  C   UNL     1     -15.710  -1.029  67.966  1.00  0.00           C  
HETATM   17  O   UNL     1     -15.196  -0.536  66.972  1.00  0.00           O  
HETATM   18  N   UNL     1     -16.261  -2.248  68.023  1.00  0.00           N  
HETATM   19  C   UNL     1     -16.417  -3.215  67.014  1.00  0.00           C  
HETATM   20  C   UNL     1     -15.833  -3.171  65.745  1.00  0.00           C  
HETATM   21  C   UNL     1     -16.101  -4.195  64.815  1.00  0.00           C  
HETATM   22  N   UNL     1     -16.938  -5.187  65.129  1.00  0.00           N  
HETATM   23  C   UNL     1     -17.495  -5.242  66.350  1.00  0.00           C  
HETATM   24  C   UNL     1     -17.258  -4.259  67.309  1.00  0.00           C  
HETATM   25  H   UNL     1     -20.149  -0.964  69.620  1.00  0.00           H  
HETATM   26  H   UNL     1     -16.743  -1.465  70.807  1.00  0.00           H  
HETATM   27  H   UNL     1     -19.214  -0.025  72.317  1.00  0.00           H  
HETATM   28  H   UNL     1     -20.331   0.775  71.143  1.00  0.00           H  
HETATM   29  H   UNL     1     -18.668  -3.007  70.056  1.00  0.00           H  
HETATM   30  H   UNL     1     -18.620  -2.491  71.778  1.00  0.00           H  
HETATM   31  H   UNL     1     -20.862  -1.274  73.173  1.00  0.00           H  
HETATM   32  H   UNL     1     -22.001  -0.185  72.227  1.00  0.00           H  
HETATM   33  H   UNL     1     -22.059  -1.729  70.420  1.00  0.00           H  
HETATM   34  H   UNL     1     -22.492  -2.969  73.184  1.00  0.00           H  
HETATM   35  H   UNL     1     -23.704  -2.169  72.127  1.00  0.00           H  
HETATM   36  H   UNL     1     -23.027  -3.769  71.668  1.00  0.00           H  
HETATM   37  H   UNL     1     -20.474  -3.791  71.940  1.00  0.00           H  
HETATM   38  H   UNL     1     -20.838  -3.632  70.151  1.00  0.00           H  
HETATM   39  H   UNL     1     -15.976   0.802  69.064  1.00  0.00           H  
HETATM   40  H   UNL     1     -14.463  -1.246  70.664  1.00  0.00           H  
HETATM   41  H   UNL     1     -13.639  -0.311  69.370  1.00  0.00           H  
HETATM   42  H   UNL     1     -14.541   1.799  70.399  1.00  0.00           H  
HETATM   43  H   UNL     1     -15.176   0.772  71.770  1.00  0.00           H  
HETATM   44  H   UNL     1     -13.095  -1.190  72.680  1.00  0.00           H  
HETATM   45  H   UNL     1     -12.204  -0.123  73.817  1.00  0.00           H  
HETATM   46  H   UNL     1     -13.987   0.025  73.657  1.00  0.00           H  
HETATM   47  H   UNL     1     -16.616  -2.511  68.920  1.00  0.00           H  
HETATM   48  H   UNL     1     -15.178  -2.355  65.478  1.00  0.00           H  
HETATM   49  H   UNL     1     -17.733  -4.318  68.277  1.00  0.00           H  
HETATM   50  H   UNL     1     -15.628  -4.177  63.844  1.00  0.00           H  
HETATM   51  H   UNL     1     -18.144  -6.070  66.595  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3   10                                       
CONECT    3    2    4    9   25                                       
CONECT    4    3    5   27   28                                       
CONECT    5    4    6   31   32                                       
CONECT    6    5    7    8   33                                       
CONECT    7    6   34   35   36                                       
CONECT    8    6    9   37   38                                       
CONECT    9    3    8   29   30                                       
CONECT   10    2   11   26                                            
CONECT   11   10   12   16   39                                       
CONECT   12   11   13   40   41                                       
CONECT   13   12   14   42   43                                       
CONECT   14   13   15                                                 
CONECT   15   14   44   45   46                                       
CONECT   16   11   17   17   18                                       
CONECT   17   16   16                                                 
CONECT   18   16   19   47                                            
CONECT   19   18   20   24   24                                       
CONECT   20   19   21   21   48                                       
CONECT   21   20   20   22   50                                       
CONECT   22   21   23   23                                            
CONECT   23   22   22   24   51                                       
CONECT   24   19   19   23   49                                       
CONECT   25    3                                                      
CONECT   26   10                                                      
CONECT   27    4                                                      
CONECT   28    4                                                      
CONECT   29    9                                                      
CONECT   30    9                                                      
CONECT   31    5                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    7                                                      
CONECT   35    7                                                      
CONECT   36    7                                                      
CONECT   37    8                                                      
CONECT   38    8                                                      
CONECT   39   11                                                      
CONECT   40   12                                                      
CONECT   41   12                                                      
CONECT   42   13                                                      
CONECT   43   13                                                      
CONECT   44   15                                                      
CONECT   45   15                                                      
CONECT   46   15                                                      
CONECT   47   18                                                      
CONECT   48   20                                                      
CONECT   49   24                                                      
CONECT   50   21                                                      
CONECT   51   23                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
