data_[La16Ga8Ni24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Ga  1.8100  1.3000  0.7600
  Ni  1.9100  1.3500  0.7400
]
_symmetry_space_group_name_H-M [Fmmm]
_cell_length_a [8.0221]
_cell_length_b [8.4684]
_cell_length_c [14.4171]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [69]
_chemical_formula_structural [La2GaNi3]
_chemical_formula_sum '[La16 Ga8 Ni24]'
_cell_volume [979.4185]
_cell_formula_units_Z [8]
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
[
  La  La0  8  0.2410  0.0000  0.0000  1.0
  La  La1  8  0.2500  0.2500  0.2500  1.0
  Ga  Ga2  8  0.0000  0.0000  0.3336  1.0
  Ni  Ni3  16  0.0000  0.2490  0.4163  1.0
  Ni  Ni4  8  0.0000  0.0000  0.1651  1.0
]