# generated using pymatgen
data_Mg8B24IrRu3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.45159309
_cell_length_b   8.84981775
_cell_length_c   11.02727392
_cell_angle_alpha   90.03969597
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg8B24IrRu3
_chemical_formula_sum   'Mg8 B24 Ir1 Ru3'
_cell_volume   336.83869541
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Mg  Mg0  1  0.50000000  0.32500932  0.41605589  1.0
  Mg  Mg1  1  0.50000000  0.67291042  0.59038658  1.0
  Mg  Mg2  1  0.50000000  0.16995396  0.91263133  1.0
  Mg  Mg3  1  0.50000000  0.83318789  0.08235591  1.0
  Mg  Mg4  1  0.50000000  0.44159780  0.12822478  1.0
  Mg  Mg5  1  0.50000000  0.55549516  0.86953606  1.0
  Mg  Mg6  1  0.50000000  0.05494180  0.63092067  1.0
  Mg  Mg7  1  0.50000000  0.94677417  0.37111992  1.0
  B  B8  1  0.00000000  0.09255654  0.47489381  1.0
  B  B9  1  0.00000000  0.90651844  0.52597932  1.0
  B  B10  1  0.00000000  0.40640676  0.97432849  1.0
  B  B11  1  0.00000000  0.59278882  0.02478959  1.0
  B  B12  1  0.00000000  0.13208547  0.31996471  1.0
  B  B13  1  0.00000000  0.86804181  0.68082668  1.0
  B  B14  1  0.00000000  0.36775060  0.81896693  1.0
  B  B15  1  0.00000000  0.63235050  0.18003048  1.0
  B  B16  1  0.00000000  0.05545311  0.06424782  1.0
  B  B17  1  0.00000000  0.94526103  0.93561205  1.0
  B  B18  1  0.00000000  0.44520466  0.56425160  1.0
  B  B19  1  0.00000000  0.55600708  0.43595016  1.0
  B  B20  1  0.00000000  0.48034071  0.28882900  1.0
  B  B21  1  0.00000000  0.51981804  0.71153614  1.0
  B  B22  1  0.00000000  0.01954957  0.78850337  1.0
  B  B23  1  0.00000000  0.98092596  0.21110960  1.0
  B  B24  1  0.00000000  0.25536298  0.07911992  1.0
  B  B25  1  0.00000000  0.74347344  0.92031247  1.0
  B  B26  1  0.00000000  0.24312485  0.57974522  1.0
  B  B27  1  0.00000000  0.75614912  0.42036958  1.0
  B  B28  1  0.00000000  0.29729353  0.23928651  1.0
  B  B29  1  0.00000000  0.70255201  0.76104745  1.0
  B  B30  1  0.00000000  0.20248658  0.73886690  1.0
  B  B31  1  0.00000000  0.79746556  0.26073515  1.0
  Ir  Ir32  1  0.50000000  0.64216669  0.31882291  1.0
  Ru  Ru33  1  0.50000000  0.14260951  0.18157875  1.0
  Ru  Ru34  1  0.50000000  0.85799266  0.82074231  1.0
  Ru  Ru35  1  0.50000000  0.35839747  0.67832294  1.0