# generated using pymatgen
data_Mn3Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.42560680
_cell_length_b   5.31341062
_cell_length_c   4.36594521
_cell_angle_alpha   89.99991545
_cell_angle_beta   90.00024064
_cell_angle_gamma   119.96969809
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn3Ir
_chemical_formula_sum   'Mn6 Ir2'
_cell_volume   109.03429923
_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  0.16906450  0.33366354  0.24999975  1.0
  Mn  Mn1  1  0.65658617  0.82502677  0.24999970  1.0
  Mn  Mn2  1  0.15745664  0.82665473  0.24999936  1.0
  Mn  Mn3  1  0.83106644  0.66412876  0.74999965  1.0
  Mn  Mn4  1  0.34726098  0.17163610  0.75000021  1.0
  Mn  Mn5  1  0.84530444  0.17906843  0.74999969  1.0
  Ir  Ir6  1  0.65382384  0.32111493  0.24999872  1.0
  Ir  Ir7  1  0.33943699  0.67870675  0.75000292  1.0