# generated using pymatgen
data_Mn3Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.48937153
_cell_length_b   5.48936316
_cell_length_c   4.26126282
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00029466
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn3Ir
_chemical_formula_sum   'Mn6 Ir2'
_cell_volume   111.20191129
_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
  Mn  Mn0  1  0.17068681  0.34136847  0.25000000  1.0
  Mn  Mn1  1  0.65861929  0.82931074  0.25000000  1.0
  Mn  Mn2  1  0.17068773  0.82930622  0.25000000  1.0
  Mn  Mn3  1  0.82931682  0.65862905  0.75000000  1.0
  Mn  Mn4  1  0.34136764  0.17069239  0.75000000  1.0
  Mn  Mn5  1  0.82932260  0.17069233  0.75000000  1.0
  Ir  Ir6  1  0.66666596  0.33333152  0.25000000  1.0
  Ir  Ir7  1  0.33333215  0.66666728  0.75000000  1.0