COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1     -18.834 -20.110  -7.805  1.00  0.00           C  
HETATM    2  C   UNL     1     -19.732 -20.468  -6.592  1.00  0.00           C  
HETATM    3  C   UNL     1     -21.084 -19.724  -6.491  1.00  0.00           C  
HETATM    4  C   UNL     1     -21.178 -18.519  -5.781  1.00  0.00           C  
HETATM    5  C   UNL     1     -22.402 -17.845  -5.683  1.00  0.00           C  
HETATM    6  C   UNL     1     -23.541 -18.383  -6.293  1.00  0.00           C  
HETATM    7  C   UNL     1     -23.457 -19.590  -6.998  1.00  0.00           C  
HETATM    8  C   UNL     1     -22.230 -20.261  -7.095  1.00  0.00           C  
HETATM    9  C   UNL     1     -19.706 -21.763  -9.544  1.00  0.00           C  
HETATM   10  C   UNL     1     -20.247 -21.649 -11.884  1.00  0.00           C  
HETATM   11  C   UNL     1     -20.222 -22.591 -13.071  1.00  0.00           C  
HETATM   12  C   UNL     1     -21.675 -21.520 -11.370  1.00  0.00           C  
HETATM   13  C   UNL     1     -19.730 -20.299 -12.336  1.00  0.00           C  
HETATM   14  C   UNL     1     -24.126 -16.356 -13.101  1.00  0.00           C  
HETATM   15  C   UNL     1     -29.918 -15.973 -11.001  1.00  0.00           C  
HETATM   16  C   UNL     1     -28.695 -15.892 -10.335  1.00  0.00           C  
HETATM   17  C   UNL     1     -30.013 -15.439 -12.283  1.00  0.00           C  
HETATM   18  C   UNL     1     -28.889 -14.842 -12.861  1.00  0.00           C  
HETATM   19  C   UNL     1     -26.294 -16.881 -14.051  1.00  0.00           C  
HETATM   20  C   UNL     1     -25.836 -18.194 -14.287  1.00  0.00           C  
HETATM   21  C   UNL     1     -24.527 -18.578 -13.945  1.00  0.00           C  
HETATM   22  C   UNL     1     -23.657 -17.653 -13.358  1.00  0.00           C  
HETATM   23  C   UNL     1     -22.218 -18.087 -12.980  1.00  0.00           C  
HETATM   24  C   UNL     1     -20.498 -17.060 -11.381  1.00  0.00           C  
HETATM   25  C   UNL     1     -20.163 -16.513  -9.975  1.00  0.00           C  
HETATM   26  C   UNL     1     -18.664 -16.352  -9.636  1.00  0.00           C  
HETATM   27  C   UNL     1     -18.443 -18.619  -7.792  1.00  0.00           C  
HETATM   28  C   UNL     1     -27.599 -15.289 -10.968  1.00  0.00           C  
HETATM   29  C   UNL     1     -28.947 -14.453 -13.792  1.00  0.00           C  
HETATM   30  C   UNL     1     -26.517 -15.131 -10.568  1.00  0.00           C  
HETATM   31  C   UNL     1     -24.067 -14.944  -9.293  1.00  0.00           C  
HETATM   32  C   UNL     1     -26.362 -15.651  -9.274  1.00  0.00           C  
HETATM   33  C   UNL     1     -24.269 -14.433 -10.582  1.00  0.00           C  
HETATM   34  C   UNL     1     -25.129 -15.560  -8.625  1.00  0.00           C  
HETATM   35  C   UNL     1     -28.580 -13.256 -16.258  1.00  0.00           C  
HETATM   36  C   UNL     1     -30.022 -14.386 -14.685  1.00  0.00           C  
HETATM   37  C   UNL     1     -29.833 -13.781 -15.930  1.00  0.00           C  
HETATM   38  C   UNL     1     -27.553 -13.357 -15.312  1.00  0.00           C  
HETATM   39  C   UNL     1     -24.830  -9.865 -10.513  1.00  0.00           C  
HETATM   40  C   UNL     1     -24.621 -11.685 -12.106  1.00  0.00           C  
HETATM   41  C   UNL     1     -26.635 -11.580 -10.903  1.00  0.00           C  
HETATM   42  C   UNL     1     -26.182 -10.430 -10.243  1.00  0.00           C  
HETATM   43  C   UNL     1     -24.086 -10.549 -11.476  1.00  0.00           C  
HETATM   44  C   UNL     1     -23.689 -12.317 -13.126  1.00  0.00           C  
HETATM   45  C   UNL     1     -28.044 -12.084 -10.540  1.00  0.00           C  
HETATM   46  C   UNL     1     -21.827 -13.232 -14.892  1.00  0.00           C  
HETATM   47  C   UNL     1     -22.474 -11.645 -13.252  1.00  0.00           C  
HETATM   48  C   UNL     1     -23.056 -13.886 -14.748  1.00  0.00           C  
HETATM   49  C   UNL     1     -21.516 -12.104 -14.148  1.00  0.00           C  
HETATM   50  C   UNL     1     -23.098 -15.096 -15.714  1.00  0.00           C  
HETATM   51  N   UNL     1     -25.433 -15.964 -13.466  1.00  0.00           N  
HETATM   52  N   UNL     1     -21.850 -17.593 -11.645  1.00  0.00           N  
HETATM   53  N   UNL     1     -19.512 -20.385  -9.080  1.00  0.00           N  
HETATM   54  N   UNL     1     -27.689 -14.764 -12.221  1.00  0.00           N  
HETATM   55  N   UNL     1     -25.479 -14.529 -11.210  1.00  0.00           N  
HETATM   56  N   UNL     1     -27.727 -13.941 -14.105  1.00  0.00           N  
HETATM   57  N   UNL     1     -25.840 -12.196 -11.841  1.00  0.00           N  
HETATM   58  N   UNL     1     -24.022 -13.421 -13.834  1.00  0.00           N  
HETATM   59  O   UNL     1     -19.665 -17.030 -12.253  1.00  0.00           O  
HETATM   60  O   UNL     1     -20.169 -22.587  -8.800  1.00  0.00           O  
HETATM   61  O   UNL     1     -19.363 -22.145 -10.876  1.00  0.00           O  
HETATM   62  S   UNL     1     -18.029 -18.035  -9.459  1.00  0.00           S  
HETATM   63 RU   UNL     1     -26.062 -13.898 -13.062  1.00  0.00          Ru  
HETATM   64  H   UNL     1     -17.915 -20.711  -7.744  1.00  0.00           H  
HETATM   65  H   UNL     1     -19.947 -21.546  -6.642  1.00  0.00           H  
HETATM   66  H   UNL     1     -19.161 -20.249  -5.677  1.00  0.00           H  
HETATM   67  H   UNL     1     -20.300 -18.107  -5.306  1.00  0.00           H  
HETATM   68  H   UNL     1     -22.467 -16.914  -5.139  1.00  0.00           H  
HETATM   69  H   UNL     1     -24.487 -17.866  -6.220  1.00  0.00           H  
HETATM   70  H   UNL     1     -24.337 -20.004  -7.467  1.00  0.00           H  
HETATM   71  H   UNL     1     -22.167 -21.194  -7.636  1.00  0.00           H  
HETATM   72  H   UNL     1     -20.594 -23.579 -12.763  1.00  0.00           H  
HETATM   73  H   UNL     1     -20.863 -22.190 -13.870  1.00  0.00           H  
HETATM   74  H   UNL     1     -19.191 -22.687 -13.441  1.00  0.00           H  
HETATM   75  H   UNL     1     -21.695 -20.837 -10.508  1.00  0.00           H  
HETATM   76  H   UNL     1     -22.318 -21.121 -12.169  1.00  0.00           H  
HETATM   77  H   UNL     1     -22.044 -22.509 -11.062  1.00  0.00           H  
HETATM   78  H   UNL     1     -19.740 -19.599 -11.487  1.00  0.00           H  
HETATM   79  H   UNL     1     -18.701 -20.407 -12.710  1.00  0.00           H  
HETATM   80  H   UNL     1     -20.373 -19.910 -13.139  1.00  0.00           H  
HETATM   81  H   UNL     1     -23.476 -15.644 -12.615  1.00  0.00           H  
HETATM   82  H   UNL     1     -30.772 -16.440 -10.533  1.00  0.00           H  
HETATM   83  H   UNL     1     -28.593 -16.292  -9.337  1.00  0.00           H  
HETATM   84  H   UNL     1     -30.946 -15.485 -12.826  1.00  0.00           H  
HETATM   85  H   UNL     1     -27.299 -16.594 -14.322  1.00  0.00           H  
HETATM   86  H   UNL     1     -26.501 -18.916 -14.737  1.00  0.00           H  
HETATM   87  H   UNL     1     -24.193 -19.587 -14.136  1.00  0.00           H  
HETATM   88  H   UNL     1     -22.161 -19.186 -12.985  1.00  0.00           H  
HETATM   89  H   UNL     1     -21.514 -17.680 -13.720  1.00  0.00           H  
HETATM   90  H   UNL     1     -20.635 -15.524  -9.880  1.00  0.00           H  
HETATM   91  H   UNL     1     -20.601 -17.200  -9.236  1.00  0.00           H  
HETATM   92  H   UNL     1     -18.140 -15.826 -10.448  1.00  0.00           H  
HETATM   93  H   UNL     1     -18.540 -15.793  -8.697  1.00  0.00           H  
HETATM   94  H   UNL     1     -17.570 -18.483  -7.137  1.00  0.00           H  
HETATM   95  H   UNL     1     -19.287 -18.030  -7.405  1.00  0.00           H  
HETATM   96  H   UNL     1     -23.100 -14.863  -8.820  1.00  0.00           H  
HETATM   97  H   UNL     1     -27.198 -16.123  -8.779  1.00  0.00           H  
HETATM   98  H   UNL     1     -23.448 -13.951 -11.092  1.00  0.00           H  
HETATM   99  H   UNL     1     -24.999 -15.957  -7.629  1.00  0.00           H  
HETATM  100  H   UNL     1     -28.409 -12.785 -17.215  1.00  0.00           H  
HETATM  101  H   UNL     1     -30.984 -14.796 -14.416  1.00  0.00           H  
HETATM  102  H   UNL     1     -30.650 -13.719 -16.634  1.00  0.00           H  
HETATM  103  H   UNL     1     -26.582 -12.952 -15.556  1.00  0.00           H  
HETATM  104  H   UNL     1     -24.454  -8.991 -10.002  1.00  0.00           H  
HETATM  105  H   UNL     1     -26.825  -9.944  -9.525  1.00  0.00           H  
HETATM  106  H   UNL     1     -23.097 -10.204 -11.737  1.00  0.00           H  
HETATM  107  H   UNL     1     -28.480 -11.431  -9.769  1.00  0.00           H  
HETATM  108  H   UNL     1     -28.681 -12.069 -11.437  1.00  0.00           H  
HETATM  109  H   UNL     1     -27.978 -13.112 -10.155  1.00  0.00           H  
HETATM  110  H   UNL     1     -21.105 -13.614 -15.598  1.00  0.00           H  
HETATM  111  H   UNL     1     -22.277 -10.768 -12.653  1.00  0.00           H  
HETATM  112  H   UNL     1     -20.566 -11.602 -14.260  1.00  0.00           H  
HETATM  113  H   UNL     1     -24.061 -15.617 -15.608  1.00  0.00           H  
HETATM  114  H   UNL     1     -22.984 -14.743 -16.749  1.00  0.00           H  
HETATM  115  H   UNL     1     -22.278 -15.788 -15.471  1.00  0.00           H  
HETATM  116  H   UNL     1     -22.524 -17.618 -10.906  1.00  0.00           H  
HETATM  117  H   UNL     1     -19.845 -19.624  -9.637  1.00  0.00           H  
CONECT    1   53   27    2   64                                       
CONECT    2    1    3   65   66                                       
CONECT    3    8    2    4    4                                       
CONECT    4    3    3    5   67                                       
CONECT    5    6    6    4   68                                       
CONECT    6    7    5    5   69                                       
CONECT    7    8    8    6   70                                       
CONECT    8    7    7    3   71                                       
CONECT    9   61   53   60   60                                       
CONECT   10   11   13   12   61                                       
CONECT   11   10   72   73   74                                       
CONECT   12   10   75   76   77                                       
CONECT   13   10   78   79   80                                       
CONECT   14   51   51   22   81                                       
CONECT   15   17   16   16   82                                       
CONECT   16   15   15   28   83                                       
CONECT   17   18   18   15   84                                       
CONECT   18   29   17   17   54                                       
CONECT   19   20   20   51   85                                       
CONECT   20   19   19   21   86                                       
CONECT   21   20   22   22   87                                       
CONECT   22   21   21   14   23                                       
CONECT   23   22   52   88   89                                       
CONECT   24   59   59   52   25                                       
CONECT   25   24   26   90   91                                       
CONECT   26   25   62   92   93                                       
CONECT   27   62    1   94   95                                       
CONECT   28   54   54   30   16                                       
CONECT   29   36   36   56   18                                       
CONECT   30   55   28   32   32                                       
CONECT   31   33   34   34   96                                       
CONECT   32   30   30   34   97                                       
CONECT   33   55   55   31   98                                       
CONECT   34   31   31   32   99                                       
CONECT   35   37   37   38  100                                       
CONECT   36   37   29   29  101                                       
CONECT   37   35   35   36  102                                       
CONECT   38   35   56   56  103                                       
CONECT   39   43   43   42  104                                       
CONECT   40   44   57   57   43                                       
CONECT   41   57   45   42   42                                       
CONECT   42   41   41   39  105                                       
CONECT   43   40   39   39  106                                       
CONECT   44   58   58   47   40                                       
CONECT   45   41  107  108  109                                       
CONECT   46   48   48   49  110                                       
CONECT   47   49   49   44  111                                       
CONECT   48   50   46   46   58                                       
CONECT   49   46   47   47  112                                       
CONECT   50   48  113  114  115                                       
CONECT   51   19   14   14   63                                       
CONECT   52   23   24  116                                            
CONECT   53    9    1  117                                            
CONECT   54   63   18   28   28                                       
CONECT   55   63   33   33   30                                       
CONECT   56   38   38   29   63                                       
CONECT   57   63   40   40   41                                       
CONECT   58   48   44   44   63                                       
CONECT   59   24   24                                                 
CONECT   60    9    9                                                 
CONECT   61   10    9                                                 
CONECT   62   26   27                                                 
CONECT   63   56   58   51   54                                       
CONECT   63   57   55                                                 
CONECT   64    1                                                      
CONECT   65    2                                                      
CONECT   66    2                                                      
CONECT   67    4                                                      
CONECT   68    5                                                      
CONECT   69    6                                                      
CONECT   70    7                                                      
CONECT   71    8                                                      
CONECT   72   11                                                      
CONECT   73   11                                                      
CONECT   74   11                                                      
CONECT   75   12                                                      
CONECT   76   12                                                      
CONECT   77   12                                                      
CONECT   78   13                                                      
CONECT   79   13                                                      
CONECT   80   13                                                      
CONECT   81   14                                                      
CONECT   82   15                                                      
CONECT   83   16                                                      
CONECT   84   17                                                      
CONECT   85   19                                                      
CONECT   86   20                                                      
CONECT   87   21                                                      
CONECT   88   23                                                      
CONECT   89   23                                                      
CONECT   90   25                                                      
CONECT   91   25                                                      
CONECT   92   26                                                      
CONECT   93   26                                                      
CONECT   94   27                                                      
CONECT   95   27                                                      
CONECT   96   31                                                      
CONECT   97   32                                                      
CONECT   98   33                                                      
CONECT   99   34                                                      
CONECT  100   35                                                      
CONECT  101   36                                                      
CONECT  102   37                                                      
CONECT  103   38                                                      
CONECT  104   39                                                      
CONECT  105   42                                                      
CONECT  106   43                                                      
CONECT  107   45                                                      
CONECT  108   45                                                      
CONECT  109   45                                                      
CONECT  110   46                                                      
CONECT  111   47                                                      
CONECT  112   49                                                      
CONECT  113   50                                                      
CONECT  114   50                                                      
CONECT  115   50                                                      
CONECT  116   52                                                      
CONECT  117   53                                                      
MASTER        0    0    0    0    0    0    0    0  117    0  117    0
END
