COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.329  -3.740  -1.999  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.308  -2.771  -1.444  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.140  -3.307  -0.664  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.442  -2.177   0.092  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.481  -1.498  -1.661  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.522  -0.447  -1.137  1.00  0.00           C  
HETATM    7  N   UNL     1      -1.256  -1.034  -0.828  1.00  0.00           N  
HETATM    8 RU   UNL     1       0.114   0.284   0.079  1.00  0.00          Ru  
HETATM    9  N   UNL     1       0.660  -1.462   1.145  1.00  0.00           N  
HETATM   10  C   UNL     1       2.075  -1.757   0.989  1.00  0.00           C  
HETATM   11  C   UNL     1       2.431  -3.024   1.778  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.034  -2.589   0.488  1.00  0.00           C  
HETATM   13  C   UNL     1       0.071  -3.821   1.363  1.00  0.00           C  
HETATM   14  C   UNL     1       1.552  -4.220   1.440  1.00  0.00           C  
HETATM   15  C   UNL     1       2.007  -4.859   0.129  1.00  0.00           C  
HETATM   16  N   UNL     1      -0.723   2.093  -0.627  1.00  0.00           N  
HETATM   17  C   UNL     1      -0.680   2.193  -2.068  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.386   3.466  -2.555  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.756   3.678  -1.916  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.119   2.140  -0.168  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.624   3.568  -0.380  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.299   1.533   1.178  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.896   2.397   2.289  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.304   1.404   3.398  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.090   0.573   3.828  1.00  0.00           C  
HETATM   26  C   UNL     1      -1.436  -0.102   2.603  1.00  0.00           C  
HETATM   27  N   UNL     1      -1.041   0.967   1.707  1.00  0.00           N  
HETATM   28  N   UNL     1       1.741   1.444   0.790  1.00  0.00           N  
HETATM   29  C   UNL     1       1.936   1.250   2.210  1.00  0.00           C  
HETATM   30  C   UNL     1       3.093   2.151   2.677  1.00  0.00           C  
HETATM   31  C   UNL     1       4.364   1.842   1.882  1.00  0.00           C  
HETATM   32  C   UNL     1       2.945   1.005   0.064  1.00  0.00           C  
HETATM   33  C   UNL     1       4.073   1.983   0.376  1.00  0.00           C  
HETATM   34  C   UNL     1       2.555   0.911  -1.400  1.00  0.00           C  
HETATM   35  C   UNL     1       3.694   0.515  -2.327  1.00  0.00           C  
HETATM   36  C   UNL     1       3.134   0.426  -3.756  1.00  0.00           C  
HETATM   37  C   UNL     1       1.961  -0.559  -3.793  1.00  0.00           C  
HETATM   38  C   UNL     1       0.887  -0.114  -2.778  1.00  0.00           C  
HETATM   39  N   UNL     1       1.489  -0.101  -1.475  1.00  0.00           N  
HETATM   40  H   UNL     1      -5.119  -3.897  -1.264  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.759  -3.331  -2.913  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.844  -4.691  -2.220  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.488  -4.057   0.047  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.427  -3.770  -1.350  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.012  -1.918   0.972  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.336  -1.172  -2.239  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.006  -0.014  -0.270  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.422   0.305  -1.927  1.00  0.00           H  
HETATM   49  H   UNL     1       2.334  -1.876  -0.057  1.00  0.00           H  
HETATM   50  H   UNL     1       2.660  -0.947   1.432  1.00  0.00           H  
HETATM   51  H   UNL     1       3.478  -3.280   1.572  1.00  0.00           H  
HETATM   52  H   UNL     1       2.348  -2.808   2.849  1.00  0.00           H  
HETATM   53  H   UNL     1       0.497  -2.793  -0.460  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.304  -3.589   2.360  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.511  -4.631   0.927  1.00  0.00           H  
HETATM   56  H   UNL     1       1.668  -4.968   2.240  1.00  0.00           H  
HETATM   57  H   UNL     1       3.051  -5.161   0.215  1.00  0.00           H  
HETATM   58  H   UNL     1       1.393  -5.735  -0.081  1.00  0.00           H  
HETATM   59  H   UNL     1       1.903  -4.139  -0.682  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.119   1.324  -2.545  1.00  0.00           H  
HETATM   61  H   UNL     1       0.376   2.291  -2.370  1.00  0.00           H  
HETATM   62  H   UNL     1      -1.509   3.402  -3.643  1.00  0.00           H  
HETATM   63  H   UNL     1      -0.752   4.331  -2.337  1.00  0.00           H  
HETATM   64  H   UNL     1      -3.452   2.919  -2.275  1.00  0.00           H  
HETATM   65  H   UNL     1      -3.132   4.668  -2.176  1.00  0.00           H  
HETATM   66  H   UNL     1      -2.745   1.553  -0.866  1.00  0.00           H  
HETATM   67  H   UNL     1      -3.586   3.691   0.092  1.00  0.00           H  
HETATM   68  H   UNL     1      -1.887   4.268  -0.015  1.00  0.00           H  
HETATM   69  H   UNL     1      -3.026   0.704   1.086  1.00  0.00           H  
HETATM   70  H   UNL     1      -3.764   2.920   1.915  1.00  0.00           H  
HETATM   71  H   UNL     1      -2.140   3.078   2.656  1.00  0.00           H  
HETATM   72  H   UNL     1      -4.081   0.739   3.021  1.00  0.00           H  
HETATM   73  H   UNL     1      -3.684   1.958   4.255  1.00  0.00           H  
HETATM   74  H   UNL     1      -2.407  -0.196   4.530  1.00  0.00           H  
HETATM   75  H   UNL     1      -1.360   1.226   4.305  1.00  0.00           H  
HETATM   76  H   UNL     1      -2.174  -0.748   2.138  1.00  0.00           H  
HETATM   77  H   UNL     1      -0.573  -0.672   2.933  1.00  0.00           H  
HETATM   78  H   UNL     1       2.150   0.221   2.468  1.00  0.00           H  
HETATM   79  H   UNL     1       1.029   1.560   2.749  1.00  0.00           H  
HETATM   80  H   UNL     1       3.277   1.972   3.738  1.00  0.00           H  
HETATM   81  H   UNL     1       2.818   3.195   2.529  1.00  0.00           H  
HETATM   82  H   UNL     1       4.682   0.820   2.093  1.00  0.00           H  
HETATM   83  H   UNL     1       5.151   2.539   2.167  1.00  0.00           H  
HETATM   84  H   UNL     1       3.285   0.014   0.368  1.00  0.00           H  
HETATM   85  H   UNL     1       4.959   1.722  -0.194  1.00  0.00           H  
HETATM   86  H   UNL     1       3.757   2.997   0.157  1.00  0.00           H  
HETATM   87  H   UNL     1       2.170   1.884  -1.713  1.00  0.00           H  
HETATM   88  H   UNL     1       4.085  -0.453  -2.020  1.00  0.00           H  
HETATM   89  H   UNL     1       4.478   1.267  -2.278  1.00  0.00           H  
HETATM   90  H   UNL     1       3.914   0.077  -4.433  1.00  0.00           H  
HETATM   91  H   UNL     1       2.790   1.408  -4.077  1.00  0.00           H  
HETATM   92  H   UNL     1       2.315  -1.553  -3.530  1.00  0.00           H  
HETATM   93  H   UNL     1       1.527  -0.569  -4.791  1.00  0.00           H  
HETATM   94  H   UNL     1       0.061  -0.829  -2.814  1.00  0.00           H  
HETATM   95  H   UNL     1       0.534   0.860  -3.095  1.00  0.00           H  
CONECT    1    2   40   41   42                                       
CONECT    2    1    3    5    5                                       
CONECT    3    2    4   43   44                                       
CONECT    4    3    7   12   45                                       
CONECT    5    2    2    6   46                                       
CONECT    6    5    7   47   48                                       
CONECT    7    4    6    8                                            
CONECT    8    7    9   16   27                                       
CONECT    8   28   39                                                 
CONECT    9    8   10   12                                            
CONECT   10    9   11   49   50                                       
CONECT   11   10   14   51   52                                       
CONECT   12    4    9   13   53                                       
CONECT   13   12   14   54   55                                       
CONECT   14   11   13   15   56                                       
CONECT   15   14   57   58   59                                       
CONECT   16    8   17   20                                            
CONECT   17   16   18   60   61                                       
CONECT   18   17   19   62   63                                       
CONECT   19   18   21   64   65                                       
CONECT   20   16   21   22   66                                       
CONECT   21   19   20   67   68                                       
CONECT   22   20   23   27   69                                       
CONECT   23   22   24   70   71                                       
CONECT   24   23   25   72   73                                       
CONECT   25   24   26   74   75                                       
CONECT   26   25   27   76   77                                       
CONECT   27    8   22   26                                            
CONECT   28    8   29   32                                            
CONECT   29   28   30   78   79                                       
CONECT   30   29   31   80   81                                       
CONECT   31   30   33   82   83                                       
CONECT   32   28   33   34   84                                       
CONECT   33   31   32   85   86                                       
CONECT   34   32   35   39   87                                       
CONECT   35   34   36   88   89                                       
CONECT   36   35   37   90   91                                       
CONECT   37   36   38   92   93                                       
CONECT   38   37   39   94   95                                       
CONECT   39    8   34   38                                            
CONECT   40    1                                                      
CONECT   41    1                                                      
CONECT   42    1                                                      
CONECT   43    3                                                      
CONECT   44    3                                                      
CONECT   45    4                                                      
CONECT   46    5                                                      
CONECT   47    6                                                      
CONECT   48    6                                                      
CONECT   49   10                                                      
CONECT   50   10                                                      
CONECT   51   11                                                      
CONECT   52   11                                                      
CONECT   53   12                                                      
CONECT   54   13                                                      
CONECT   55   13                                                      
CONECT   56   14                                                      
CONECT   57   15                                                      
CONECT   58   15                                                      
CONECT   59   15                                                      
CONECT   60   17                                                      
CONECT   61   17                                                      
CONECT   62   18                                                      
CONECT   63   18                                                      
CONECT   64   19                                                      
CONECT   65   19                                                      
CONECT   66   20                                                      
CONECT   67   21                                                      
CONECT   68   21                                                      
CONECT   69   22                                                      
CONECT   70   23                                                      
CONECT   71   23                                                      
CONECT   72   24                                                      
CONECT   73   24                                                      
CONECT   74   25                                                      
CONECT   75   25                                                      
CONECT   76   26                                                      
CONECT   77   26                                                      
CONECT   78   29                                                      
CONECT   79   29                                                      
CONECT   80   30                                                      
CONECT   81   30                                                      
CONECT   82   31                                                      
CONECT   83   31                                                      
CONECT   84   32                                                      
CONECT   85   33                                                      
CONECT   86   33                                                      
CONECT   87   34                                                      
CONECT   88   35                                                      
CONECT   89   35                                                      
CONECT   90   36                                                      
CONECT   91   36                                                      
CONECT   92   37                                                      
CONECT   93   37                                                      
CONECT   94   38                                                      
CONECT   95   38                                                      
MASTER        0    0    0    0    0    0    0    0   95    0   95    0
END
