data_InAg2Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.02
_cell_length_b   5.01
_cell_length_c   4.75
_cell_angle_alpha   90.0
_cell_angle_beta   91.85
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InAg2Ir
_chemical_formula_sum   'In1 Ag2 Ir1'
_cell_volume   71.86
_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
  In  In2  1  0.0  0.0  0.0  1.0
  Ag  Ag0  1  0.22  0.51  0.22  1.0
  Ag  Ag1  1  0.64  0.51  0.53  1.0
  Ir  Ir3  1  0.43  0.0  0.37  1.0

data_InAg2Ir
_symmetry_space_group_name_H-M   Pm
_cell_length_a   3.02
_cell_length_b   5.01
_cell_length_c   4.75
_cell_angle_alpha   90.0
_cell_angle_beta   91.85
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   InAg2Ir
_chemical_formula_sum   'In1 Ag2 Ir1'
_cell_volume   71.86
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '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
  In  In0  1  0.0  0.0  0.0  1.0
  Ag  Ag1  1  0.22  0.5  0.22  1.0
  Ag  Ag2  1  0.64  0.5  0.53  1.0
  Ir  Ir3  1  0.43  0.0  0.37  1.0

In Ag Ag Ir