COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1     -15.277 -34.836  -8.246  1.00  0.00           C  
HETATM    2  C   UNL     1     -16.804 -36.913  -7.136  1.00  0.00           C  
HETATM    3  C   UNL     1     -14.832 -35.423  -7.056  1.00  0.00           C  
HETATM    4  C   UNL     1     -16.503 -35.219  -8.809  1.00  0.00           C  
HETATM    5  C   UNL     1     -17.266 -36.256  -8.260  1.00  0.00           C  
HETATM    6  C   UNL     1     -15.587 -36.548  -6.589  1.00  0.00           C  
HETATM    7  C   UNL     1     -15.051 -37.207  -5.393  1.00  0.00           C  
HETATM    8  C   UNL     1     -13.708 -38.179  -3.202  1.00  0.00           C  
HETATM    9  C   UNL     1     -15.606 -38.271  -4.648  1.00  0.00           C  
HETATM   10  C   UNL     1     -14.895 -38.725  -3.548  1.00  0.00           C  
HETATM   11  C   UNL     1     -13.236 -37.124  -3.967  1.00  0.00           C  
HETATM   12  C   UNL     1     -14.283 -34.093  -5.030  1.00  0.00           C  
HETATM   13  C   UNL     1     -15.801 -32.075  -3.768  1.00  0.00           C  
HETATM   14  C   UNL     1     -15.678 -34.117  -5.055  1.00  0.00           C  
HETATM   15  C   UNL     1     -13.719 -32.943  -4.530  1.00  0.00           C  
HETATM   16  C   UNL     1     -14.419 -31.955  -3.837  1.00  0.00           C  
HETATM   17  C   UNL     1     -16.433 -33.161  -4.373  1.00  0.00           C  
HETATM   18  C   UNL     1     -12.275 -32.893  -4.656  1.00  0.00           C  
HETATM   19  C   UNL     1      -9.613 -32.809  -4.899  1.00  0.00           C  
HETATM   20  C   UNL     1     -11.602 -31.824  -4.072  1.00  0.00           C  
HETATM   21  C   UNL     1     -10.225 -31.781  -4.198  1.00  0.00           C  
HETATM   22  C   UNL     1     -10.373 -33.846  -5.458  1.00  0.00           C  
HETATM   23  C   UNL     1      -9.945 -38.957  -7.488  1.00  0.00           C  
HETATM   24  C   UNL     1     -11.391 -38.010  -5.808  1.00  0.00           C  
HETATM   25  C   UNL     1     -11.164 -36.905  -7.700  1.00  0.00           C  
HETATM   26  C   UNL     1     -10.289 -37.852  -8.228  1.00  0.00           C  
HETATM   27  C   UNL     1     -10.518 -39.024  -6.228  1.00  0.00           C  
HETATM   28  C   UNL     1     -11.453 -35.779  -8.564  1.00  0.00           C  
HETATM   29  C   UNL     1     -12.312 -33.475  -9.832  1.00  0.00           C  
HETATM   30  C   UNL     1     -10.986 -35.521  -9.869  1.00  0.00           C  
HETATM   31  C   UNL     1     -11.422 -34.336 -10.517  1.00  0.00           C  
HETATM   32  C   UNL     1     -12.655 -33.861  -8.550  1.00  0.00           C  
HETATM   33  C   UNL     1     -12.006 -36.496  -3.656  1.00  0.00           C  
HETATM   34  C   UNL     1     -11.225 -36.944  -2.597  1.00  0.00           C  
HETATM   35  C   UNL     1     -11.709 -37.987  -1.807  1.00  0.00           C  
HETATM   36  C   UNL     1     -12.938 -38.609  -2.101  1.00  0.00           C  
HETATM   37  C   UNL     1      -9.694 -34.842  -6.150  1.00  0.00           C  
HETATM   38  C   UNL     1      -8.314 -34.851  -6.295  1.00  0.00           C  
HETATM   39  C   UNL     1      -7.570 -33.810  -5.743  1.00  0.00           C  
HETATM   40  C   UNL     1      -8.221 -32.798  -5.040  1.00  0.00           C  
HETATM   41  C   UNL     1     -12.908 -32.131 -10.344  1.00  0.00           C  
HETATM   42  C   UNL     1     -14.892 -30.665  -9.404  1.00  0.00           C  
HETATM   43  C   UNL     1     -16.339 -30.153  -9.211  1.00  0.00           C  
HETATM   44  C   UNL     1     -16.802 -28.927 -10.052  1.00  0.00           C  
HETATM   45  C   UNL     1     -18.336 -28.771 -10.096  1.00  0.00           C  
HETATM   46  C   UNL     1     -18.158 -31.781  -8.495  1.00  0.00           C  
HETATM   47  C   UNL     1     -19.621 -33.541  -9.634  1.00  0.00           C  
HETATM   48  C   UNL     1     -19.088 -28.689  -8.922  1.00  0.00           C  
HETATM   49  C   UNL     1     -20.484 -28.546  -9.007  1.00  0.00           C  
HETATM   50  C   UNL     1     -20.397 -28.544 -11.345  1.00  0.00           C  
HETATM   51  C   UNL     1     -18.993 -28.689 -11.326  1.00  0.00           C  
HETATM   52  C   UNL     1     -18.672 -33.453 -10.840  1.00  0.00           C  
HETATM   53  C   UNL     1     -19.834 -35.020  -9.316  1.00  0.00           C  
HETATM   54  C   UNL     1     -20.986 -32.941  -9.985  1.00  0.00           C  
HETATM   55  N   UNL     1     -13.880 -36.741  -5.084  1.00  0.00           N  
HETATM   56  N   UNL     1     -11.683 -36.846  -6.434  1.00  0.00           N  
HETATM   57  N   UNL     1     -11.721 -33.854  -5.398  1.00  0.00           N  
HETATM   58  N   UNL     1     -12.299 -35.021  -7.962  1.00  0.00           N  
HETATM   59  N   UNL     1     -14.349 -31.749 -10.260  1.00  0.00           N  
HETATM   60  N   UNL     1     -17.236 -31.275  -9.541  1.00  0.00           N  
HETATM   61  N   UNL     1     -21.087 -28.481 -10.199  1.00  0.00           N  
HETATM   62  O   UNL     1     -14.104 -30.061  -8.708  1.00  0.00           O  
HETATM   63  O   UNL     1     -19.134 -32.851  -8.474  1.00  0.00           O  
HETATM   64  O   UNL     1     -18.054 -31.183  -7.459  1.00  0.00           O  
HETATM   65 IR   UNL     1     -13.031 -35.259  -6.104  1.00  0.00          Ir1+
HETATM   66  H   UNL     1     -14.673 -34.084  -8.733  1.00  0.00           H  
HETATM   67  H   UNL     1     -17.387 -37.704  -6.689  1.00  0.00           H  
HETATM   68  H   UNL     1     -16.866 -34.703  -9.685  1.00  0.00           H  
HETATM   69  H   UNL     1     -18.206 -36.540  -8.710  1.00  0.00           H  
HETATM   70  H   UNL     1     -16.551 -38.715  -4.925  1.00  0.00           H  
HETATM   71  H   UNL     1     -15.298 -39.532  -2.955  1.00  0.00           H  
HETATM   72  H   UNL     1     -16.384 -31.330  -3.248  1.00  0.00           H  
HETATM   73  H   UNL     1     -16.184 -34.891  -5.613  1.00  0.00           H  
HETATM   74  H   UNL     1     -13.905 -31.127  -3.371  1.00  0.00           H  
HETATM   75  H   UNL     1     -17.507 -33.262  -4.314  1.00  0.00           H  
HETATM   76  H   UNL     1     -12.137 -31.053  -3.538  1.00  0.00           H  
HETATM   77  H   UNL     1      -9.648 -30.977  -3.766  1.00  0.00           H  
HETATM   78  H   UNL     1      -9.276 -39.719  -7.861  1.00  0.00           H  
HETATM   79  H   UNL     1     -11.893 -38.179  -4.867  1.00  0.00           H  
HETATM   80  H   UNL     1      -9.881 -37.717  -9.219  1.00  0.00           H  
HETATM   81  H   UNL     1     -10.293 -39.853  -5.573  1.00  0.00           H  
HETATM   82  H   UNL     1     -10.314 -36.207 -10.363  1.00  0.00           H  
HETATM   83  H   UNL     1     -11.081 -34.096 -11.513  1.00  0.00           H  
HETATM   84  H   UNL     1     -13.258 -33.177  -7.971  1.00  0.00           H  
HETATM   85  H   UNL     1     -11.670 -35.658  -4.249  1.00  0.00           H  
HETATM   86  H   UNL     1     -10.265 -36.495  -2.390  1.00  0.00           H  
HETATM   87  H   UNL     1     -11.133 -38.322  -0.957  1.00  0.00           H  
HETATM   88  H   UNL     1     -13.293 -39.419  -1.481  1.00  0.00           H  
HETATM   89  H   UNL     1     -10.265 -35.644  -6.594  1.00  0.00           H  
HETATM   90  H   UNL     1      -7.824 -35.653  -6.828  1.00  0.00           H  
HETATM   91  H   UNL     1      -6.496 -33.788  -5.859  1.00  0.00           H  
HETATM   92  H   UNL     1      -7.645 -31.997  -4.600  1.00  0.00           H  
HETATM   93  H   UNL     1     -12.654 -32.085 -11.413  1.00  0.00           H  
HETATM   94  H   UNL     1     -12.363 -31.343  -9.803  1.00  0.00           H  
HETATM   95  H   UNL     1     -16.467 -29.898  -8.149  1.00  0.00           H  
HETATM   96  H   UNL     1     -16.432 -29.048 -11.081  1.00  0.00           H  
HETATM   97  H   UNL     1     -16.370 -28.016  -9.612  1.00  0.00           H  
HETATM   98  H   UNL     1     -18.602 -28.735  -7.959  1.00  0.00           H  
HETATM   99  H   UNL     1     -21.073 -28.488  -8.104  1.00  0.00           H  
HETATM  100  H   UNL     1     -20.918 -28.484 -12.289  1.00  0.00           H  
HETATM  101  H   UNL     1     -18.435 -28.736 -12.249  1.00  0.00           H  
HETATM  102  H   UNL     1     -17.697 -33.887 -10.573  1.00  0.00           H  
HETATM  103  H   UNL     1     -19.102 -34.010 -11.686  1.00  0.00           H  
HETATM  104  H   UNL     1     -18.538 -32.399 -11.125  1.00  0.00           H  
HETATM  105  H   UNL     1     -20.511 -35.117  -8.454  1.00  0.00           H  
HETATM  106  H   UNL     1     -20.277 -35.522 -10.189  1.00  0.00           H  
HETATM  107  H   UNL     1     -18.867 -35.486  -9.076  1.00  0.00           H  
HETATM  108  H   UNL     1     -21.653 -33.011  -9.113  1.00  0.00           H  
HETATM  109  H   UNL     1     -20.861 -31.885 -10.267  1.00  0.00           H  
HETATM  110  H   UNL     1     -21.424 -33.496 -10.828  1.00  0.00           H  
HETATM  111  H   UNL     1     -14.997 -32.262 -10.823  1.00  0.00           H  
HETATM  112  H   UNL     1     -17.223 -31.687 -10.452  1.00  0.00           H  
CONECT    1    4    3    3   66                                       
CONECT    2    5    6    6   67                                       
CONECT    3    1    1    6   65                                       
CONECT    4    5    5    1   68                                       
CONECT    5    4    4    2   69                                       
CONECT    6    2    2    3    7                                       
CONECT    7    6   55   55    9                                       
CONECT    8   11   10   36   36                                       
CONECT    9    7   10   10   70                                       
CONECT   10    9    9    8   71                                       
CONECT   11   55   33   33    8                                       
CONECT   12   65   14   14   15                                       
CONECT   13   17   17   16   72                                       
CONECT   14   12   12   17   73                                       
CONECT   15   12   18   16   16                                       
CONECT   16   15   15   13   74                                       
CONECT   17   14   13   13   75                                       
CONECT   18   57   15   20   20                                       
CONECT   19   22   40   21   21                                       
CONECT   20   18   18   21   76                                       
CONECT   21   19   19   20   77                                       
CONECT   22   37   57   57   19                                       
CONECT   23   26   27   27   78                                       
CONECT   24   56   56   27   79                                       
CONECT   25   28   26   26   56                                       
CONECT   26   25   25   23   80                                       
CONECT   27   23   23   24   81                                       
CONECT   28   30   58   58   25                                       
CONECT   29   31   41   32   32                                       
CONECT   30   31   31   28   82                                       
CONECT   31   30   30   29   83                                       
CONECT   32   29   29   58   84                                       
CONECT   33   11   11   34   85                                       
CONECT   34   33   35   35   86                                       
CONECT   35   34   34   36   87                                       
CONECT   36    8    8   35   88                                       
CONECT   37   38   38   22   89                                       
CONECT   38   37   37   39   90                                       
CONECT   39   38   40   40   91                                       
CONECT   40   39   39   19   92                                       
CONECT   41   59   29   93   94                                       
CONECT   42   59   43   62   62                                       
CONECT   43   44   60   42   95                                       
CONECT   44   45   43   96   97                                       
CONECT   45   51   44   48   48                                       
CONECT   46   60   63   64   64                                       
CONECT   47   52   54   53   63                                       
CONECT   48   45   45   49   98                                       
CONECT   49   61   61   48   99                                       
CONECT   50   51   51   61  100                                       
CONECT   51   50   50   45  101                                       
CONECT   52   47  102  103  104                                       
CONECT   53   47  105  106  107                                       
CONECT   54   47  108  109  110                                       
CONECT   55   65    7    7   11                                       
CONECT   56   25   65   24   24                                       
CONECT   57   65   22   22   18                                       
CONECT   58   28   28   32   65                                       
CONECT   59   41   42  111                                            
CONECT   60   43   46  112                                            
CONECT   61   50   49   49                                            
CONECT   62   42   42                                                 
CONECT   63   47   46                                                 
CONECT   64   46   46                                                 
CONECT   65   58    3   56   57                                       
CONECT   65   55   12                                                 
CONECT   66    1                                                      
CONECT   67    2                                                      
CONECT   68    4                                                      
CONECT   69    5                                                      
CONECT   70    9                                                      
CONECT   71   10                                                      
CONECT   72   13                                                      
CONECT   73   14                                                      
CONECT   74   16                                                      
CONECT   75   17                                                      
CONECT   76   20                                                      
CONECT   77   21                                                      
CONECT   78   23                                                      
CONECT   79   24                                                      
CONECT   80   26                                                      
CONECT   81   27                                                      
CONECT   82   30                                                      
CONECT   83   31                                                      
CONECT   84   32                                                      
CONECT   85   33                                                      
CONECT   86   34                                                      
CONECT   87   35                                                      
CONECT   88   36                                                      
CONECT   89   37                                                      
CONECT   90   38                                                      
CONECT   91   39                                                      
CONECT   92   40                                                      
CONECT   93   41                                                      
CONECT   94   41                                                      
CONECT   95   43                                                      
CONECT   96   44                                                      
CONECT   97   44                                                      
CONECT   98   48                                                      
CONECT   99   49                                                      
CONECT  100   50                                                      
CONECT  101   51                                                      
CONECT  102   52                                                      
CONECT  103   52                                                      
CONECT  104   52                                                      
CONECT  105   53                                                      
CONECT  106   53                                                      
CONECT  107   53                                                      
CONECT  108   54                                                      
CONECT  109   54                                                      
CONECT  110   54                                                      
CONECT  111   59                                                      
CONECT  112   60                                                      
MASTER        0    0    0    0    0    0    0    0  112    0  112    0
END
