data_[Tb8Zr12Ga16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Zr  1.3300  1.5500  0.8600
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [Cmce]
_cell_length_a [6.3022]
_cell_length_b [15.6000]
_cell_length_c [8.1967]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [64]
_chemical_formula_structural [Tb2Zr3Ga4]
_chemical_formula_sum '[Tb8 Zr12 Ga16]'
_cell_volume [805.8558]
_cell_formula_units_Z [4]
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
[
  Tb  Tb0  8  0.0000  0.1124  0.4128  1
  Zr  Zr1  8  0.2500  0.2079  0.7500  1
  Zr  Zr2  4  0.0000  0.0000  0.0000  1
  Ga  Ga3  8  0.0000  0.1824  0.0533  1
  Ga  Ga4  8  0.2500  0.0325  0.7500  1
]