data_Ag2IrSe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.94
_cell_length_b   4.94
_cell_length_c   4.94
_cell_angle_alpha   129.91
_cell_angle_beta   129.91
_cell_angle_gamma   73.55
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ag2IrSe
_chemical_formula_sum   'Ag2 Ir1 Se1'
_cell_volume   69.05
_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
  Ag  Ag0  1  0.09  0.0  0.98  1.0
  Ag  Ag1  1  0.0  0.0  0.95  1.0
  Ir  Ir2  1  0.0  0.09  0.98  1.0
  Se  Se3  1  0.0  0.0  0.0  1.0

data_Ag2IrSe
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.18
_cell_length_b   4.18
_cell_length_c   4.94
_cell_angle_alpha   115.04
_cell_angle_beta   115.04
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ag2IrSe
_chemical_formula_sum   'Ag2 Ir1 Se1'
_cell_volume   69.05
_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
  Ag  Ag0  1  0.95  0.95  0.95  1.0
  Ag  Ag1  1  0.98  0.89  0.89  1.0
  Ir  Ir2  1  0.89  0.98  0.89  1.0
  Se  Se3  1  0.0  0.0  0.0  1.0

Ag Ag Ir Se