COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.574   4.016  -0.382  1.00  0.00           C  
HETATM    2  C   UNL     1       1.215   1.922  -0.336  1.00  0.00           C  
HETATM    3  C   UNL     1       0.371   0.793  -0.333  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.049   0.933  -0.696  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.268  -0.006  -1.055  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.103   0.255   0.181  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.876   1.098   1.256  1.00  0.00           C  
HETATM    8  C   UNL     1       2.562   1.796   0.006  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.039  -2.507  -1.094  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.809  -1.330  -1.635  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.265  -1.345  -1.125  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.250  -0.515   0.141  1.00  0.00           C  
HETATM   13  C   UNL     1      -6.170  -0.438   1.179  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.939   0.408   2.252  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.791   1.175   2.288  1.00  0.00           C  
HETATM   16  C   UNL     1       3.052   0.512   0.353  1.00  0.00           C  
HETATM   17  C   UNL     1       5.049  -0.772   0.361  1.00  0.00           C  
HETATM   18  C   UNL     1       7.080  -2.112   0.248  1.00  0.00           C  
HETATM   19  C   UNL     1       8.063  -2.691   1.267  1.00  0.00           C  
HETATM   20  C   UNL     1       8.587  -2.006   0.004  1.00  0.00           C  
HETATM   21  C   UNL     1       2.213  -0.587   0.350  1.00  0.00           C  
HETATM   22  C   UNL     1       0.881  -0.458   0.013  1.00  0.00           C  
HETATM   23  N   UNL     1      -1.856  -0.146  -0.693  1.00  0.00           N  
HETATM   24  N   UNL     1       3.226   2.967  -0.046  1.00  0.00           N  
HETATM   25  N   UNL     1       4.392   0.355   0.700  1.00  0.00           N  
HETATM   26  N   UNL     1       6.367  -0.887   0.616  1.00  0.00           N  
HETATM   27  O   UNL     1      -3.450  -3.105  -0.129  1.00  0.00           O  
HETATM   28  O   UNL     1      -7.299  -1.194   1.141  1.00  0.00           O  
HETATM   29  O   UNL     1       4.451  -1.685  -0.176  1.00  0.00           O  
HETATM   30  O   UNL     1      -1.494   2.024  -0.999  1.00  0.00           O  
HETATM   31  O   UNL     1      -1.895  -2.889  -1.684  1.00  0.00           O  
HETATM   32  S   UNL     1       0.891   3.615  -0.700  1.00  0.00           S  
HETATM   33  H   UNL     1       2.996   5.007  -0.454  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.396   0.803  -1.774  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.980   1.700   1.286  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.777  -1.316  -2.725  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.930  -0.897  -1.863  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.578  -2.366  -0.905  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.655   0.467   3.059  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.608   1.834   3.124  1.00  0.00           H  
HETATM   41  H   UNL     1       6.519  -2.816  -0.367  1.00  0.00           H  
HETATM   42  H   UNL     1       8.179  -2.160   2.212  1.00  0.00           H  
HETATM   43  H   UNL     1       8.149  -3.776   1.324  1.00  0.00           H  
HETATM   44  H   UNL     1       9.017  -2.640  -0.771  1.00  0.00           H  
HETATM   45  H   UNL     1       9.047  -1.024   0.117  1.00  0.00           H  
HETATM   46  H   UNL     1       2.604  -1.558   0.617  1.00  0.00           H  
HETATM   47  H   UNL     1       0.236  -1.323   0.016  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.501  -1.016  -0.452  1.00  0.00           H  
HETATM   49  H   UNL     1       4.853   1.058   1.185  1.00  0.00           H  
HETATM   50  H   UNL     1       6.843  -0.158   1.044  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.204  -2.064   1.553  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.436  -3.649  -1.300  1.00  0.00           H  
CONECT    1   32   24   24   33                                       
CONECT    2    3    3   32    8                                       
CONECT    3    2    2    4   22                                       
CONECT    4   23    3   30   30                                       
CONECT    5    6   23   10   34                                       
CONECT    6    7    7    5   12                                       
CONECT    7   15    6    6   35                                       
CONECT    8   24   16   16    2                                       
CONECT    9   27   27   10   31                                       
CONECT   10   11    9    5   36                                       
CONECT   11   10   12   37   38                                       
CONECT   12   11   13   13    6                                       
CONECT   13   12   12   28   14                                       
CONECT   14   13   15   15   39                                       
CONECT   15   14   14    7   40                                       
CONECT   16    8    8   25   21                                       
CONECT   17   25   26   29   29                                       
CONECT   18   26   19   20   41                                       
CONECT   19   18   20   42   43                                       
CONECT   20   19   18   44   45                                       
CONECT   21   16   22   22   46                                       
CONECT   22   21   21    3   47                                       
CONECT   23    5    4   48                                            
CONECT   24    1    1    8                                            
CONECT   25   17   16   49                                            
CONECT   26   18   17   50                                            
CONECT   27    9    9                                                 
CONECT   28   13   51                                                 
CONECT   29   17   17                                                 
CONECT   30    4    4                                                 
CONECT   31    9   52                                                 
CONECT   32    2    1                                                 
CONECT   33    1                                                      
CONECT   34    5                                                      
CONECT   35    7                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   11                                                      
CONECT   39   14                                                      
CONECT   40   15                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   19                                                      
CONECT   44   20                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   22                                                      
CONECT   48   23                                                      
CONECT   49   25                                                      
CONECT   50   26                                                      
CONECT   51   28                                                      
CONECT   52   31                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
