COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1     -21.632 -34.244  -6.512  1.00  0.00           O  
HETATM    2  C   UNL     1     -22.673 -34.587  -5.938  1.00  0.00           C  
HETATM    3  O   UNL     1     -23.306 -35.741  -6.250  1.00  0.00           O  
HETATM    4  C   UNL     1     -22.424 -36.694  -6.841  1.00  0.00           C  
HETATM    5  C   UNL     1     -23.157 -38.029  -7.041  1.00  0.00           C  
HETATM    6  C   UNL     1     -23.193 -33.734  -4.856  1.00  0.00           C  
HETATM    7  C   UNL     1     -22.387 -32.677  -4.465  1.00  0.00           C  
HETATM    8  C   UNL     1     -23.028 -31.965  -3.435  1.00  0.00           C  
HETATM    9  C   UNL     1     -24.281 -32.592  -3.220  1.00  0.00           C  
HETATM   10  C   UNL     1     -24.405 -33.720  -4.070  1.00  0.00           C  
HETATM   11 RU   UNL     1     -22.598 -34.007  -2.749  1.00  0.00          Ru  
HETATM   12  C   UNL     1     -20.789 -34.373  -2.766  1.00  0.00           C  
HETATM   13  O   UNL     1     -19.694 -34.522  -2.911  1.00  0.00           O  
HETATM   14  N   UNL     1     -22.537 -33.649  -0.668  1.00  0.00           N  
HETATM   15  C   UNL     1     -22.898 -34.729  -0.003  1.00  0.00           C  
HETATM   16  C   UNL     1     -23.264 -35.920  -0.680  1.00  0.00           C  
HETATM   17  N   UNL     1     -23.193 -35.915  -2.063  1.00  0.00           N  
HETATM   18  C   UNL     1     -23.649 -37.033   0.092  1.00  0.00           C  
HETATM   19  C   UNL     1     -24.004 -38.211  -0.649  1.00  0.00           C  
HETATM   20  C   UNL     1     -23.935 -38.204  -2.035  1.00  0.00           C  
HETATM   21  C   UNL     1     -23.533 -37.048  -2.734  1.00  0.00           C  
HETATM   22  C   UNL     1     -23.653 -36.841   1.535  1.00  0.00           C  
HETATM   23  C   UNL     1     -24.019 -37.781   2.584  1.00  0.00           C  
HETATM   24  O   UNL     1     -24.395 -38.914   2.456  1.00  0.00           O  
HETATM   25  N   UNL     1     -23.879 -37.127   3.808  1.00  0.00           N  
HETATM   26  C   UNL     1     -23.446 -35.816   3.649  1.00  0.00           C  
HETATM   27  O   UNL     1     -23.241 -34.994   4.527  1.00  0.00           O  
HETATM   28  C   UNL     1     -23.308 -35.648   2.168  1.00  0.00           C  
HETATM   29  C   UNL     1     -22.901 -34.544   1.407  1.00  0.00           C  
HETATM   30  C   UNL     1     -22.479 -33.208   1.567  1.00  0.00           C  
HETATM   31  C   UNL     1     -22.252 -32.687   0.255  1.00  0.00           C  
HETATM   32  C   UNL     1     -21.835 -31.378   0.061  1.00  0.00           C  
HETATM   33  C   UNL     1     -21.608 -30.599   1.195  1.00  0.00           C  
HETATM   34  C   UNL     1     -21.831 -31.123   2.481  1.00  0.00           C  
HETATM   35  O   UNL     1     -21.617 -30.336   3.578  1.00  0.00           O  
HETATM   36  C   UNL     1     -22.262 -32.412   2.676  1.00  0.00           C  
HETATM   37  H   UNL     1     -22.080 -36.317  -7.815  1.00  0.00           H  
HETATM   38  H   UNL     1     -21.558 -36.848  -6.181  1.00  0.00           H  
HETATM   39  H   UNL     1     -22.472 -38.759  -7.497  1.00  0.00           H  
HETATM   40  H   UNL     1     -23.501 -38.408  -6.067  1.00  0.00           H  
HETATM   41  H   UNL     1     -24.023 -37.876  -7.702  1.00  0.00           H  
HETATM   42  H   UNL     1     -21.331 -32.549  -4.747  1.00  0.00           H  
HETATM   43  H   UNL     1     -22.569 -31.203  -2.788  1.00  0.00           H  
HETATM   44  H   UNL     1     -24.905 -32.424  -2.330  1.00  0.00           H  
HETATM   45  H   UNL     1     -25.126 -34.545  -3.973  1.00  0.00           H  
HETATM   46  H   UNL     1     -20.808 -34.882  -1.814  1.00  0.00           H  
HETATM   47  H   UNL     1     -24.324 -39.101  -0.128  1.00  0.00           H  
HETATM   48  H   UNL     1     -24.193 -39.097  -2.586  1.00  0.00           H  
HETATM   49  H   UNL     1     -23.495 -37.062  -3.813  1.00  0.00           H  
HETATM   50  H   UNL     1     -24.068 -37.551   4.694  1.00  0.00           H  
HETATM   51  H   UNL     1     -21.691 -30.977  -0.932  1.00  0.00           H  
HETATM   52  H   UNL     1     -21.257 -29.583   1.085  1.00  0.00           H  
HETATM   53  H   UNL     1     -21.810 -30.831   4.366  1.00  0.00           H  
HETATM   54  H   UNL     1     -22.427 -32.795   3.672  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    6                                       
CONECT    3    2    4                                                 
CONECT    4    3    5   37   38                                       
CONECT    5    4   39   40   41                                       
CONECT    6    2    7   10   11                                       
CONECT    7    6    8   11   42                                       
CONECT    8    7    9   11   43                                       
CONECT    9    8   10   11   44                                       
CONECT   10    6    9   11   45                                       
CONECT   11    6    7    8    9                                       
CONECT   11   10   12   14   17                                       
CONECT   12   11   13   13   13                                       
CONECT   12   46                                                      
CONECT   13   12   12   12                                            
CONECT   14   11   15   31                                            
CONECT   15   14   16   29   29                                       
CONECT   16   15   17   18   18                                       
CONECT   17   11   16   21   21                                       
CONECT   18   16   16   19   22                                       
CONECT   19   18   20   20   47                                       
CONECT   20   19   19   21   48                                       
CONECT   21   17   17   20   49                                       
CONECT   22   18   23   28   28                                       
CONECT   23   22   24   24   25                                       
CONECT   24   23   23                                                 
CONECT   25   23   26   50                                            
CONECT   26   25   27   27   28                                       
CONECT   27   26   26                                                 
CONECT   28   22   22   26   29                                       
CONECT   29   15   15   28   30                                       
CONECT   30   29   31   36   36                                       
CONECT   31   14   30   32   32                                       
CONECT   32   31   31   33   51                                       
CONECT   33   32   34   34   52                                       
CONECT   34   33   33   35   36                                       
CONECT   35   34   53                                                 
CONECT   36   30   30   34   54                                       
CONECT   37    4                                                      
CONECT   38    4                                                      
CONECT   39    5                                                      
CONECT   40    5                                                      
CONECT   41    5                                                      
CONECT   42    7                                                      
CONECT   43    8                                                      
CONECT   44    9                                                      
CONECT   45   10                                                      
CONECT   46   12                                                      
CONECT   47   19                                                      
CONECT   48   20                                                      
CONECT   49   21                                                      
CONECT   50   25                                                      
CONECT   51   32                                                      
CONECT   52   33                                                      
CONECT   53   35                                                      
CONECT   54   36                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
