data_[Y4Ga1Ir3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  Ga  1.8100  1.3000  0.7600
  Ir  2.2000  1.3500  0.7650
]
_symmetry_space_group_name_H-M [Pmm2]
_cell_length_a [3.8914]
_cell_length_b [4.3207]
_cell_length_c [10.6138]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [25]
_chemical_formula_structural [Y4GaIr3]
_chemical_formula_sum '[Y4 Ga1 Ir3]'
_cell_volume [178.4536]
_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
[
  Y  Y0  1  0.0000  0.0000  0.1465  1
  Y  Y1  1  0.0000  0.5000  0.8471  1
  Y  Y2  1  0.5000  0.0000  0.6415  1
  Y  Y3  1  0.5000  0.5000  0.3665  1
  Ga  Ga4  1  0.5000  0.5000  0.0679  1
  Ir  Ir5  1  0.0000  0.0000  0.4171  1
  Ir  Ir6  1  0.0000  0.5000  0.5799  1
  Ir  Ir7  1  0.5000  0.0000  0.9335  1
]