# generated using pymatgen
data_MgIr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.41403500
_cell_length_b   3.12043700
_cell_length_c   4.41418600
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgIr
_chemical_formula_sum   'Mg2 Ir2'
_cell_volume   60.79975375
_cell_formula_units_Z   2
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  0.75000000  0.50000000  0.26574900  1.0
  Mg  Mg1  1  0.24999800  0.50000000  0.73424900  1.0
  Ir  Ir2  1  0.24999800  0.00000000  0.23228100  1.0
  Ir  Ir3  1  0.75000000  0.00000000  0.76771900  1.0