COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  C   UNL     1      -3.065  -0.876   1.485  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.782  -1.155  -0.581  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.432  -0.466  -0.812  1.00  0.00           C  
HETATM    4  C   UNL     1       0.414  -1.388   1.387  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.936  -2.077   1.617  1.00  0.00           C  
HETATM    6  C   UNL     1       3.172  -0.510  -0.762  1.00  0.00           C  
HETATM    7  C   UNL     1       3.245   0.426  -1.779  1.00  0.00           C  
HETATM    8  C   UNL     1       4.199   1.425  -1.737  1.00  0.00           C  
HETATM    9  C   UNL     1       5.083   1.489  -0.672  1.00  0.00           C  
HETATM   10  C   UNL     1       6.652   1.932   0.823  1.00  0.00           C  
HETATM   11  C   UNL     1       5.010   0.547   0.354  1.00  0.00           C  
HETATM   12  C   UNL     1       4.050  -0.452   0.303  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.151  -0.259   0.697  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.569  -0.850  -0.504  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.569  -0.292  -1.242  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.192   0.877  -0.811  1.00  0.00           C  
HETATM   17  C   UNL     1      -7.446   2.715  -0.501  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.622   2.671   0.557  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.782   1.481   0.394  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.762   0.906   1.149  1.00  0.00           C  
HETATM   21  N   UNL     1      -1.968  -1.352   0.863  1.00  0.00           N  
HETATM   22  N   UNL     1       0.600  -1.191  -0.058  1.00  0.00           N  
HETATM   23  N   UNL     1       6.130   2.351  -0.347  1.00  0.00           N  
HETATM   24  N   UNL     1      -7.203   1.651  -1.327  1.00  0.00           N  
HETATM   25  O   UNL     1      -3.159  -0.951   2.694  1.00  0.00           O  
HETATM   26  O   UNL     1       1.598  -1.932  -2.190  1.00  0.00           O  
HETATM   27  O   UNL     1       2.434  -2.842  -0.017  1.00  0.00           O  
HETATM   28  O   UNL     1       7.583   2.455   1.404  1.00  0.00           O  
HETATM   29  O   UNL     1       5.983   0.849   1.249  1.00  0.00           O  
HETATM   30  S   UNL     1       1.948  -1.776  -0.821  1.00  0.00           S  
HETATM   31  H   UNL     1      -2.584  -0.528  -0.971  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.794  -2.121  -1.087  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.189  -0.484  -1.875  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.483   0.565  -0.464  1.00  0.00           H  
HETATM   35  H   UNL     1       0.423  -0.422   1.892  1.00  0.00           H  
HETATM   36  H   UNL     1       1.216  -2.014   1.779  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.885  -3.109   1.269  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.178  -2.062   2.680  1.00  0.00           H  
HETATM   39  H   UNL     1       2.556   0.375  -2.608  1.00  0.00           H  
HETATM   40  H   UNL     1       4.255   2.153  -2.532  1.00  0.00           H  
HETATM   41  H   UNL     1       3.989  -1.184   1.094  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.093  -1.757  -0.847  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.881  -0.758  -2.166  1.00  0.00           H  
HETATM   44  H   UNL     1      -8.191   3.477  -0.674  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.584   3.378   1.373  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.446   1.363   2.076  1.00  0.00           H  
HETATM   47  H   UNL     1       6.429   3.112  -0.868  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.674   1.471  -2.155  1.00  0.00           H  
CONECT    1   25   25   21   13                                       
CONECT    2    3   21   31   32                                       
CONECT    3    2   22   33   34                                       
CONECT    4   22    5   35   36                                       
CONECT    5   21    4   37   38                                       
CONECT    6    7   30   12   12                                       
CONECT    7    8    8    6   39                                       
CONECT    8    7    7    9   40                                       
CONECT    9    8   23   11   11                                       
CONECT   10   23   29   28   28                                       
CONECT   11    9    9   12   29                                       
CONECT   12    6    6   11   41                                       
CONECT   13    1   20   20   14                                       
CONECT   14   13   15   15   42                                       
CONECT   15   14   14   16   43                                       
CONECT   16   19   19   15   24                                       
CONECT   17   18   18   24   44                                       
CONECT   18   19   17   17   45                                       
CONECT   19   20   18   16   16                                       
CONECT   20   13   13   19   46                                       
CONECT   21    2    1    5                                            
CONECT   22    3   30    4                                            
CONECT   23    9   10   47                                            
CONECT   24   16   17   48                                            
CONECT   25    1    1                                                 
CONECT   26   30   30                                                 
CONECT   27   30   30                                                 
CONECT   28   10   10                                                 
CONECT   29   11   10                                                 
CONECT   30   26   26    6   22                                       
CONECT   30   27   27                                                 
CONECT   31    2                                                      
CONECT   32    2                                                      
CONECT   33    3                                                      
CONECT   34    3                                                      
CONECT   35    4                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    5                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41   12                                                      
CONECT   42   14                                                      
CONECT   43   15                                                      
CONECT   44   17                                                      
CONECT   45   18                                                      
CONECT   46   20                                                      
CONECT   47   23                                                      
CONECT   48   24                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
