COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1 IR   UNL     1     -28.523 -26.600 -16.363  1.00  0.00          Ir3+
HETATM    2  C   UNL     1     -15.466 -29.387  -8.502  1.00  0.00           C  
HETATM    3  N   UNL     1     -16.488 -29.579  -7.554  1.00  0.00           N  
HETATM    4  O   UNL     1     -14.079 -29.383  -8.137  1.00  0.00           O  
HETATM    5  S   UNL     1     -17.815 -26.803  -8.716  1.00  0.00           S  
HETATM    6  C   UNL     1     -17.748 -29.388  -8.205  1.00  0.00           C  
HETATM    7  N   UNL     1     -15.924 -29.185  -9.853  1.00  0.00           N  
HETATM    8  O   UNL     1     -19.546 -25.939 -15.327  1.00  0.00           O  
HETATM    9  S   UNL     1     -25.553 -26.764 -16.377  1.00  0.00           S  
HETATM   10  C   UNL     1     -18.396 -28.112  -7.675  1.00  0.00           C  
HETATM   11  N   UNL     1     -20.856 -24.261 -14.031  1.00  0.00           N  
HETATM   12  O   UNL     1     -26.007 -26.087 -17.620  1.00  0.00           O  
HETATM   13  C   UNL     1     -17.383 -29.183  -9.689  1.00  0.00           C  
HETATM   14  N   UNL     1     -26.669 -26.510 -15.259  1.00  0.00           N1-
HETATM   15  O   UNL     1     -25.377 -28.224 -16.588  1.00  0.00           O  
HETATM   16  C   UNL     1     -17.971 -27.829 -10.125  1.00  0.00           C  
HETATM   17  N   UNL     1     -29.238 -27.381 -14.431  1.00  0.00           N  
HETATM   18  C   UNL     1     -17.252 -27.182 -11.307  1.00  0.00           C  
HETATM   19  C   UNL     1     -17.998 -25.964 -11.822  1.00  0.00           C  
HETATM   20  C   UNL     1     -17.480 -25.533 -13.207  1.00  0.00           C  
HETATM   21  C   UNL     1     -18.282 -24.358 -13.774  1.00  0.00           C  
HETATM   22  C   UNL     1     -19.569 -24.862 -14.391  1.00  0.00           C  
HETATM   23  C   UNL     1     -22.032 -24.847 -14.653  1.00  0.00           C  
HETATM   24  C   UNL     1     -22.536 -26.016 -14.110  1.00  0.00           C  
HETATM   25  C   UNL     1     -23.652 -26.609 -14.674  1.00  0.00           C  
HETATM   26  C   UNL     1     -22.621 -24.253 -15.763  1.00  0.00           C  
HETATM   27  C   UNL     1     -23.745 -24.854 -16.328  1.00  0.00           C  
HETATM   28  C   UNL     1     -24.248 -26.043 -15.787  1.00  0.00           C  
HETATM   29  C   UNL     1     -26.778 -27.614 -14.302  1.00  0.00           C  
HETATM   30  C   UNL     1     -28.084 -27.390 -13.533  1.00  0.00           C  
HETATM   31  H   UNL     1     -16.356 -29.810  -6.590  1.00  0.00           H  
HETATM   32  H   UNL     1     -18.419 -30.251  -8.084  1.00  0.00           H  
HETATM   33  H   UNL     1     -15.386 -29.074 -10.689  1.00  0.00           H  
HETATM   34  H   UNL     1     -18.094 -27.934  -6.632  1.00  0.00           H  
HETATM   35  H   UNL     1     -19.492 -28.188  -7.731  1.00  0.00           H  
HETATM   36  H   UNL     1     -20.921 -23.493 -13.394  1.00  0.00           H  
HETATM   37  H   UNL     1     -17.836 -29.986 -10.289  1.00  0.00           H  
HETATM   38  H   UNL     1     -19.044 -27.935 -10.343  1.00  0.00           H  
HETATM   39  H   UNL     1     -29.956 -26.790 -14.064  1.00  0.00           H  
HETATM   40  H   UNL     1     -16.246 -26.874 -10.987  1.00  0.00           H  
HETATM   41  H   UNL     1     -17.169 -27.919 -12.120  1.00  0.00           H  
HETATM   42  H   UNL     1     -19.068 -26.206 -11.899  1.00  0.00           H  
HETATM   43  H   UNL     1     -17.860 -25.134 -11.114  1.00  0.00           H  
HETATM   44  H   UNL     1     -16.426 -25.233 -13.115  1.00  0.00           H  
HETATM   45  H   UNL     1     -17.560 -26.385 -13.898  1.00  0.00           H  
HETATM   46  H   UNL     1     -18.518 -23.653 -12.964  1.00  0.00           H  
HETATM   47  H   UNL     1     -17.685 -23.846 -14.543  1.00  0.00           H  
HETATM   48  H   UNL     1     -22.060 -26.463 -13.250  1.00  0.00           H  
HETATM   49  H   UNL     1     -24.058 -27.514 -14.245  1.00  0.00           H  
HETATM   50  H   UNL     1     -22.216 -23.343 -16.180  1.00  0.00           H  
HETATM   51  H   UNL     1     -24.227 -24.403 -17.182  1.00  0.00           H  
HETATM   52  H   UNL     1     -26.809 -28.577 -14.833  1.00  0.00           H  
HETATM   53  H   UNL     1     -25.923 -27.604 -13.611  1.00  0.00           H  
HETATM   54  H   UNL     1     -28.030 -26.424 -13.010  1.00  0.00           H  
HETATM   55  H   UNL     1     -28.209 -28.198 -12.798  1.00  0.00           H  
HETATM   56  H   UNL     1     -29.595 -28.308 -14.544  1.00  0.00           H  
CONECT    1   14   17                                                 
CONECT    2    4    4    3    7                                       
CONECT    3    2   31    6                                            
CONECT    4    2    2                                                 
CONECT    5   10   16                                                 
CONECT    6   10    3   32   13                                       
CONECT    7   13    2   33                                            
CONECT    8   22   22                                                 
CONECT    9   28   14   12   12                                       
CONECT    9   15   15                                                 
CONECT   10    5    6   34   35                                       
CONECT   11   36   22   23                                            
CONECT   12    9    9                                                 
CONECT   13    7    6   37   16                                       
CONECT   14    1    9   29                                            
CONECT   15    9    9                                                 
CONECT   16   13    5   38   18                                       
CONECT   17    1   30   39   56                                       
CONECT   18   16   40   41   19                                       
CONECT   19   18   42   43   20                                       
CONECT   20   19   44   45   21                                       
CONECT   21   20   46   47   22                                       
CONECT   22    8    8   11   21                                       
CONECT   23   24   11   26   26                                       
CONECT   24   23   48   25   25                                       
CONECT   25   24   24   49   28                                       
CONECT   26   23   23   50   27                                       
CONECT   27   28   28   26   51                                       
CONECT   28    9   27   27   25                                       
CONECT   29   14   30   52   53                                       
CONECT   30   17   29   54   55                                       
CONECT   31    3                                                      
CONECT   32    6                                                      
CONECT   33    7                                                      
CONECT   34   10                                                      
CONECT   35   10                                                      
CONECT   36   11                                                      
CONECT   37   13                                                      
CONECT   38   16                                                      
CONECT   39   17                                                      
CONECT   40   18                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   19                                                      
CONECT   44   20                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   21                                                      
CONECT   48   24                                                      
CONECT   49   25                                                      
CONECT   50   26                                                      
CONECT   51   27                                                      
CONECT   52   29                                                      
CONECT   53   29                                                      
CONECT   54   30                                                      
CONECT   55   30                                                      
CONECT   56   17                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
