# generated using pymatgen
data_MgIr2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.17449227
_cell_length_b   5.17449047
_cell_length_c   8.40033559
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999865
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgIr2
_chemical_formula_sum   'Mg4 Ir8'
_cell_volume   194.78818363
_cell_formula_units_Z   4
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  0.33333300  0.66666700  0.06945439  1.0
  Mg  Mg1  1  0.66666700  0.33333300  0.56945439  1.0
  Mg  Mg2  1  0.66666700  0.33333300  0.93054561  1.0
  Mg  Mg3  1  0.33333300  0.66666700  0.43054561  1.0
  Ir  Ir4  1  -0.00000000  -0.00000000  0.00000000  1.0
  Ir  Ir5  1  -0.00000000  -0.00000000  0.50000000  1.0
  Ir  Ir6  1  0.82794655  0.65589511  0.25000000  1.0
  Ir  Ir7  1  0.17205345  0.82794655  0.75000000  1.0
  Ir  Ir8  1  0.65589511  0.82794655  0.75000000  1.0
  Ir  Ir9  1  0.34410489  0.17205345  0.25000000  1.0
  Ir  Ir10  1  0.82794655  0.17205345  0.25000000  1.0
  Ir  Ir11  1  0.17205345  0.34410489  0.75000000  1.0