COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  S   UNL     1       1.972  -0.931  -0.583  1.00  0.00           S  
HETATM    2  C   UNL     1       0.383  -0.135  -0.730  1.00  0.00           C  
HETATM    3  C   UNL     1       0.022   0.047   0.590  1.00  0.00           C  
HETATM    4  C   UNL     1       0.904  -0.402   1.556  1.00  0.00           C  
HETATM    5  C   UNL     1       2.083  -0.991   1.144  1.00  0.00           C  
HETATM    6  C   UNL     1       0.594  -0.251   2.998  1.00  0.00           C  
HETATM    7  C   UNL     1       1.599   0.110   3.893  1.00  0.00           C  
HETATM    8  C   UNL     1       1.311   0.250   5.233  1.00  0.00           C  
HETATM    9  C   UNL     1       0.013   0.030   5.694  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.992  -0.330   4.798  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.705  -0.465   3.458  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.296   0.181   7.136  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.492   0.772   7.556  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.741   0.891   8.907  1.00  0.00           C  
HETATM   15  N   UNL     1      -0.869   0.458   9.797  1.00  0.00           N  
HETATM   16  C   UNL     1       0.270  -0.105   9.444  1.00  0.00           C  
HETATM   17  C   UNL     1       0.596  -0.269   8.113  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.350   0.235  -1.944  1.00  0.00           C  
HETATM   19  O   UNL     1      -1.435   0.779  -1.857  1.00  0.00           O  
HETATM   20  N   UNL     1       0.177  -0.024  -3.157  1.00  0.00           N  
HETATM   21  C   UNL     1      -0.602   0.243  -4.368  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.502  -0.956  -4.671  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.409  -0.624  -5.827  1.00  0.00           C  
HETATM   24  O   UNL     1      -2.419   0.493  -6.286  1.00  0.00           O  
HETATM   25  O   UNL     1      -3.206  -1.570  -6.348  1.00  0.00           O  
HETATM   26  C   UNL     1       0.332   0.475  -5.526  1.00  0.00           C  
HETATM   27  C   UNL     1       0.306   1.679  -6.205  1.00  0.00           C  
HETATM   28  C   UNL     1       1.164   1.892  -7.268  1.00  0.00           C  
HETATM   29  C   UNL     1       2.048   0.901  -7.652  1.00  0.00           C  
HETATM   30  C   UNL     1       2.075  -0.302  -6.973  1.00  0.00           C  
HETATM   31  C   UNL     1       1.220  -0.513  -5.907  1.00  0.00           C  
HETATM   32  H   UNL     1      -0.913   0.515   0.858  1.00  0.00           H  
HETATM   33  H   UNL     1       2.880  -1.393   1.752  1.00  0.00           H  
HETATM   34  H   UNL     1       2.604   0.280   3.537  1.00  0.00           H  
HETATM   35  H   UNL     1       2.090   0.530   5.927  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.997  -0.501   5.155  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.484  -0.745   2.764  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.210   1.129   6.832  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.661   1.346   9.241  1.00  0.00           H  
HETATM   40  H   UNL     1       0.955  -0.445  10.206  1.00  0.00           H  
HETATM   41  H   UNL     1       1.530  -0.731   7.831  1.00  0.00           H  
HETATM   42  H   UNL     1       1.073  -0.389  -3.228  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.218   1.129  -4.215  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.103  -1.190  -3.792  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.884  -1.817  -4.929  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.789  -1.357  -7.090  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.383   2.453  -5.905  1.00  0.00           H  
HETATM   48  H   UNL     1       1.143   2.833  -7.798  1.00  0.00           H  
HETATM   49  H   UNL     1       2.718   1.067  -8.483  1.00  0.00           H  
HETATM   50  H   UNL     1       2.765  -1.076  -7.273  1.00  0.00           H  
HETATM   51  H   UNL     1       1.240  -1.453  -5.376  1.00  0.00           H  
CONECT    1    2    5                                                 
CONECT    2    1    3    3   18                                       
CONECT    3    2    2    4   32                                       
CONECT    4    3    5    5    6                                       
CONECT    5    1    4    4   33                                       
CONECT    6    4    7    7   11                                       
CONECT    7    6    6    8   34                                       
CONECT    8    7    9    9   35                                       
CONECT    9    8    8   10   12                                       
CONECT   10    9   11   11   36                                       
CONECT   11    6   10   10   37                                       
CONECT   12    9   13   13   17                                       
CONECT   13   12   12   14   38                                       
CONECT   14   13   15   15   39                                       
CONECT   15   14   14   16                                            
CONECT   16   15   17   17   40                                       
CONECT   17   12   16   16   41                                       
CONECT   18    2   19   19   20                                       
CONECT   19   18   18                                                 
CONECT   20   18   21   42                                            
CONECT   21   20   22   26   43                                       
CONECT   22   21   23   44   45                                       
CONECT   23   22   24   24   25                                       
CONECT   24   23   23                                                 
CONECT   25   23   46                                                 
CONECT   26   21   27   27   31                                       
CONECT   27   26   26   28   47                                       
CONECT   28   27   29   29   48                                       
CONECT   29   28   28   30   49                                       
CONECT   30   29   31   31   50                                       
CONECT   31   26   30   30   51                                       
CONECT   32    3                                                      
CONECT   33    5                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   13                                                      
CONECT   39   14                                                      
CONECT   40   16                                                      
CONECT   41   17                                                      
CONECT   42   20                                                      
CONECT   43   21                                                      
CONECT   44   22                                                      
CONECT   45   22                                                      
CONECT   46   25                                                      
CONECT   47   27                                                      
CONECT   48   28                                                      
CONECT   49   29                                                      
CONECT   50   30                                                      
CONECT   51   31                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
