data_Mn2InIr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.09
_cell_length_b   5.09
_cell_length_c   5.09
_cell_angle_alpha   146.12
_cell_angle_beta   128.14
_cell_angle_gamma   63.4
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2InIr
_chemical_formula_sum   'Mn2 In1 Ir1'
_cell_volume   57.22
_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  Mn2  1  0.0  0.0  0.28  1.0
  Mn  Mn3  1  0.48  0.0  0.84  1.0
  In  In0  1  0.0  0.0  0.21  1.0
  Ir  Ir1  1  0.0  0.23  0.34  1.0

data_Mn2InIr
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.97
_cell_length_b   4.45
_cell_length_c   5.09
_cell_angle_alpha   115.93
_cell_angle_beta   106.94
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2InIr
_chemical_formula_sum   'Mn2 In1 Ir1'
_cell_volume   57.22
_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  0.64  0.16  0.64  1.0
  Mn  Mn1  1  0.72  0.72  0.72  1.0
  In  In2  1  0.79  0.79  0.79  1.0
  Ir  Ir3  1  0.66  0.89  0.89  1.0

Mn Mn In Ir