COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.061  -0.002  -0.063  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.064  -1.787  -0.072  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.817   1.360   1.685  1.00  0.00           C  
HETATM    4  C   UNL     1       6.700  -0.203   0.625  1.00  0.00           C  
HETATM    5  C   UNL     1       7.828  -0.417  -1.506  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.256  -3.003  -0.109  1.00  0.00           C  
HETATM    7  C   UNL     1       0.552  -0.670   0.853  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.401   0.079   0.151  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.042   1.285  -0.439  1.00  0.00           C  
HETATM   10  C   UNL     1       1.272   1.738  -0.326  1.00  0.00           C  
HETATM   11  C   UNL     1       2.220   0.975   0.382  1.00  0.00           C  
HETATM   12  C   UNL     1       1.838  -0.231   0.965  1.00  0.00           C  
HETATM   13  C   UNL     1       1.983   2.925  -0.806  1.00  0.00           C  
HETATM   14  C   UNL     1       3.253   2.819  -0.384  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.407  -2.204  -0.177  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.793  -0.414   0.038  1.00  0.00           C  
HETATM   17  C   UNL     1       4.667   1.215   0.939  1.00  0.00           C  
HETATM   18  C   UNL     1       5.390   0.262  -0.014  1.00  0.00           C  
HETATM   19  C   UNL     1       8.530  -1.768   0.377  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.110  -4.034  -0.229  1.00  0.00           C  
HETATM   21  N   UNL     1       3.412   1.660   0.327  1.00  0.00           N  
HETATM   22  N   UNL     1      -4.362  -1.279  -0.168  1.00  0.00           N  
HETATM   23  N   UNL     1      -2.820   0.434   0.038  1.00  0.00           N  
HETATM   24  N   UNL     1       7.394  -1.118  -0.290  1.00  0.00           N  
HETATM   25  N   UNL     1      -3.398  -3.569  -0.271  1.00  0.00           N  
HETATM   26  O   UNL     1      -4.772   2.368  -0.554  1.00  0.00           O  
HETATM   27  O   UNL     1      -6.418   0.535  -0.780  1.00  0.00           O  
HETATM   28  S   UNL     1      -5.372   1.176  -0.064  1.00  0.00           S  
HETATM   29  H   UNL     1      -6.630   2.080   1.779  1.00  0.00           H  
HETATM   30  H   UNL     1      -6.136   0.397   2.082  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.951   1.715   2.244  1.00  0.00           H  
HETATM   32  H   UNL     1       7.333   0.662   0.825  1.00  0.00           H  
HETATM   33  H   UNL     1       6.484  -0.719   1.561  1.00  0.00           H  
HETATM   34  H   UNL     1       8.509   0.391  -1.237  1.00  0.00           H  
HETATM   35  H   UNL     1       8.339  -1.118  -2.167  1.00  0.00           H  
HETATM   36  H   UNL     1       6.958  -0.004  -2.018  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.179  -3.062  -0.052  1.00  0.00           H  
HETATM   38  H   UNL     1       0.264  -1.604   1.312  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.774   1.866  -0.981  1.00  0.00           H  
HETATM   40  H   UNL     1       2.561  -0.817   1.512  1.00  0.00           H  
HETATM   41  H   UNL     1       1.566   3.733  -1.389  1.00  0.00           H  
HETATM   42  H   UNL     1       4.033   3.540  -0.576  1.00  0.00           H  
HETATM   43  H   UNL     1       4.451   0.699   1.875  1.00  0.00           H  
HETATM   44  H   UNL     1       5.300   2.079   1.139  1.00  0.00           H  
HETATM   45  H   UNL     1       5.605   0.778  -0.950  1.00  0.00           H  
HETATM   46  H   UNL     1       4.756  -0.602  -0.213  1.00  0.00           H  
HETATM   47  H   UNL     1       9.236  -1.009   0.714  1.00  0.00           H  
HETATM   48  H   UNL     1       8.171  -2.337   1.234  1.00  0.00           H  
HETATM   49  H   UNL     1       9.026  -2.440  -0.324  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.823  -5.074  -0.284  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.188  -4.126  -0.354  1.00  0.00           H  
CONECT    1   28   22   22   23                                       
CONECT    2   15   15   16    6                                       
CONECT    3   28   29   30   31                                       
CONECT    4   18   24   32   33                                       
CONECT    5   24   34   35   36                                       
CONECT    6    2   20   20   37                                       
CONECT    7    8   12   12   38                                       
CONECT    8   16    9    9    7                                       
CONECT    9    8    8   10   39                                       
CONECT   10    9   13   11   11                                       
CONECT   11   10   10   21   12                                       
CONECT   12    7    7   11   40                                       
CONECT   13   10   14   14   41                                       
CONECT   14   13   13   21   42                                       
CONECT   15   22   25    2    2                                       
CONECT   16   23   23    2    8                                       
CONECT   17   21   18   43   44                                       
CONECT   18   17    4   45   46                                       
CONECT   19   24   47   48   49                                       
CONECT   20   25    6    6   50                                       
CONECT   21   14   11   17                                            
CONECT   22    1    1   15                                            
CONECT   23    1   16   16                                            
CONECT   24    5    4   19                                            
CONECT   25   15   20   51                                            
CONECT   26   28   28                                                 
CONECT   27   28   28                                                 
CONECT   28   26   26    3   27                                       
CONECT   28   27    1                                                 
CONECT   29    3                                                      
CONECT   30    3                                                      
CONECT   31    3                                                      
CONECT   32    4                                                      
CONECT   33    4                                                      
CONECT   34    5                                                      
CONECT   35    5                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38    7                                                      
CONECT   39    9                                                      
CONECT   40   12                                                      
CONECT   41   13                                                      
CONECT   42   14                                                      
CONECT   43   17                                                      
CONECT   44   17                                                      
CONECT   45   18                                                      
CONECT   46   18                                                      
CONECT   47   19                                                      
CONECT   48   19                                                      
CONECT   49   19                                                      
CONECT   50   20                                                      
CONECT   51   25                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
