# generated using pymatgen
data_MgZrIr2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.51723482
_cell_length_b   4.51723482
_cell_length_c   4.51723482
_cell_angle_alpha   59.97427413
_cell_angle_beta   59.97427413
_cell_angle_gamma   59.97427413
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgZrIr2
_chemical_formula_sum   'Mg1 Zr1 Ir2'
_cell_volume   65.14027337
_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  0.24999900  0.24999900  0.24999900  1.0
  Zr  Zr1  1  0.75000100  0.75000100  0.75000100  1.0
  Ir  Ir2  1  0.99993321  0.99993321  0.99993321  1.0
  Ir  Ir3  1  0.50006579  0.50006579  0.50006579  1.0