data_[Y2Al3Ga1Cu4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  Al  1.6100  1.2500  0.6750
  Ga  1.8100  1.3000  0.7600
  Cu  1.9000  1.3500  0.8200
]
_symmetry_space_group_name_H-M [P-4m2]
_cell_length_a [4.1331]
_cell_length_b [4.1331]
_cell_length_c [10.1678]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [115]
_chemical_formula_structural [Y2Al3GaCu4]
_chemical_formula_sum '[Y2 Al3 Ga1 Cu4]'
_cell_volume [173.6915]
_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  2  0.0000  0.5000  0.7524  1
  Al  Al1  2  0.0000  0.5000  0.1287  1
  Al  Al2  1  0.0000  0.0000  0.5000  1
  Ga  Ga3  1  0.5000  0.5000  0.5000  1
  Cu  Cu4  2  0.0000  0.5000  0.3645  1
  Cu  Cu5  1  0.0000  0.0000  0.0000  1
  Cu  Cu6  1  0.5000  0.5000  0.0000  1
]