# generated using pymatgen
data_Mn5FeIr2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.39696823
_cell_length_b   5.42101596
_cell_length_c   4.39945779
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.85335194
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn5FeIr2
_chemical_formula_sum   'Mn5 Fe1 Ir2'
_cell_volume   111.63495639
_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
  Mn  Mn0  1  0.66176408  0.82847500  0.25000000  1.0
  Mn  Mn1  1  0.16671091  0.82847500  0.25000000  1.0
  Mn  Mn2  1  0.83162846  0.66325692  0.75000000  1.0
  Mn  Mn3  1  0.33717318  0.17239134  0.75000000  1.0
  Mn  Mn4  1  0.83521816  0.17239134  0.75000000  1.0
  Fe  Fe5  1  0.17253561  0.34507122  0.25000000  1.0
  Ir  Ir6  1  0.66399520  0.32798941  0.25000000  1.0
  Ir  Ir7  1  0.33097439  0.66194978  0.75000000  1.0