COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1 RU   UNL     1      -7.044  13.108 -38.871  1.00  0.00          Ru  
HETATM    2  C   UNL     1      -6.542  13.596 -36.796  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.386  13.630 -37.546  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.510  14.639 -38.489  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.755  15.222 -38.350  1.00  0.00           C  
HETATM    6  C   UNL     1      -7.395  14.580 -37.296  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.731  11.245 -40.027  1.00  0.00           C  
HETATM    8  C   UNL     1      -7.710  11.020 -39.072  1.00  0.00           C  
HETATM    9  C   UNL     1      -8.780  11.872 -39.310  1.00  0.00           C  
HETATM   10  C   UNL     1      -8.467  12.607 -40.457  1.00  0.00           C  
HETATM   11  C   UNL     1      -7.194  12.249 -40.866  1.00  0.00           C  
HETATM   12  C   UNL     1      -9.985  11.986 -38.435  1.00  0.00           C  
HETATM   13  C   UNL     1     -11.040  12.996 -38.845  1.00  0.00           C  
HETATM   14  C   UNL     1     -12.059  13.200 -37.728  1.00  0.00           C  
HETATM   15  C   UNL     1     -11.442  13.999 -36.591  1.00  0.00           C  
HETATM   16  O   UNL     1     -10.031  11.365 -37.379  1.00  0.00           O  
HETATM   17  O   UNL     1     -10.882  15.070 -36.829  1.00  0.00           O  
HETATM   18  N   UNL     1     -11.597  13.498 -35.357  1.00  0.00           N  
HETATM   19  CA  UNL     1     -11.096  14.189 -34.193  1.00  0.00           C  
HETATM   20  C   UNL     1      -9.600  14.121 -34.166  1.00  0.00           C  
HETATM   21  N   UNL     1     -13.064  13.906 -32.840  1.00  0.00           N  
HETATM   22  C   UNL     1     -11.651  13.591 -32.914  1.00  0.00           C  
HETATM   23  O   UNL     1      -8.987  13.082 -34.380  1.00  0.00           O  
HETATM   24  S   UNL     1     -10.882  14.289 -31.437  1.00  0.00           S  
HETATM   25  C   UNL     1     -12.353  15.096 -30.877  1.00  0.00           C  
HETATM   26  CA  UNL     1     -13.327  15.111 -32.072  1.00  0.00           C  
HETATM   27  C   UNL     1     -12.049  16.515 -30.385  1.00  0.00           C  
HETATM   28  C   UNL     1     -12.962  14.254 -29.742  1.00  0.00           C  
HETATM   29  C   UNL     1     -14.737  15.223 -31.646  1.00  0.00           C  
HETATM   30  O   UNL     1     -15.453  14.231 -31.656  1.00  0.00           O  
HETATM   31  OXT UNL     1     -15.207  16.406 -31.275  1.00  0.00           O  
HETATM   32  OXT UNL     1      -8.916  15.215 -33.859  1.00  0.00           O  
HETATM   33  H   UNL     1     -10.552  13.956 -39.068  1.00  0.00           H  
HETATM   34  H   UNL     1     -11.559  12.631 -39.744  1.00  0.00           H  
HETATM   35  H   UNL     1     -12.928  13.745 -38.125  1.00  0.00           H  
HETATM   36  H   UNL     1     -12.383  12.220 -37.349  1.00  0.00           H  
HETATM   37  H   UNL     1     -12.071  12.625 -35.240  1.00  0.00           H  
HETATM   38  HA  UNL     1     -11.398  15.246 -34.240  1.00  0.00           H  
HETATM   39  H   UNL     1     -13.413  14.035 -33.768  1.00  0.00           H  
HETATM   40  H   UNL     1     -11.477  12.505 -32.888  1.00  0.00           H  
HETATM   41  HA  UNL     1     -13.080  15.986 -32.692  1.00  0.00           H  
HETATM   42  H   UNL     1     -12.979  16.992 -30.044  1.00  0.00           H  
HETATM   43  H   UNL     1     -11.333  16.468 -29.551  1.00  0.00           H  
HETATM   44  H   UNL     1     -11.616  17.103 -31.207  1.00  0.00           H  
HETATM   45  H   UNL     1     -13.880  14.738 -29.378  1.00  0.00           H  
HETATM   46  H   UNL     1     -13.203  13.249 -30.119  1.00  0.00           H  
HETATM   47  H   UNL     1     -12.238  14.172 -28.917  1.00  0.00           H  
HETATM   48  HXT UNL     1     -16.125  16.324 -31.043  1.00  0.00           H  
HETATM   49  HXT UNL     1      -7.987  15.016 -33.850  1.00  0.00           H  
CONECT    1    2    3    4    5                                       
CONECT    1    6    7    8    9                                       
CONECT    1   10   11                                                 
CONECT    2    1    3    6                                            
CONECT    3    1    2    4                                            
CONECT    4    1    3    5                                            
CONECT    5    1    4    6                                            
CONECT    6    1    2    5                                            
CONECT    7    1    8   11                                            
CONECT    8    1    7    9                                            
CONECT    9    1    8   10   12                                       
CONECT   10    1    9   11                                            
CONECT   11    1    7   10                                            
CONECT   12    9   13   16   16                                       
CONECT   13   12   14   33   34                                       
CONECT   14   13   15   35   36                                       
CONECT   15   14   17   17   18                                       
CONECT   16   12   12                                                 
CONECT   17   15   15                                                 
CONECT   18   15   19   37                                            
CONECT   19   18   20   22   38                                       
CONECT   20   19   23   23   32                                       
CONECT   21   22   26   39                                            
CONECT   22   19   21   24   40                                       
CONECT   23   20   20                                                 
CONECT   24   22   25                                                 
CONECT   25   24   26   27   28                                       
CONECT   26   21   25   29   41                                       
CONECT   27   25   42   43   44                                       
CONECT   28   25   45   46   47                                       
CONECT   29   26   30   30   31                                       
CONECT   30   29   29                                                 
CONECT   31   29   48                                                 
CONECT   32   20   49                                                 
CONECT   33   13                                                      
CONECT   34   13                                                      
CONECT   35   14                                                      
CONECT   36   14                                                      
CONECT   37   18                                                      
CONECT   38   19                                                      
CONECT   39   21                                                      
CONECT   40   22                                                      
CONECT   41   26                                                      
CONECT   42   27                                                      
CONECT   43   27                                                      
CONECT   44   27                                                      
CONECT   45   28                                                      
CONECT   46   28                                                      
CONECT   47   28                                                      
CONECT   48   31                                                      
CONECT   49   32                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
