data_[Tb1Pr2Sm1As4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Pr  1.1300  1.8500  1.0600
  Sm  1.1700  1.8500  1.2290
  As  2.1800  1.1500  0.6600
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [7.3463]
_cell_length_b [4.2459]
_cell_length_c [7.3484]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.4642]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [TbPr2SmAs4]
_chemical_formula_sum '[Tb1 Pr2 Sm1 As4]'
_cell_volume [216.1102]
_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
[
  Tb  Tb0  1  0.0000  0.0000  0.0000  1.0
  Pr  Pr1  1  0.5000  0.0000  0.5000  1.0
  Pr  Pr2  1  0.5000  0.5000  0.0000  1.0
  Sm  Sm3  1  0.0000  0.5000  0.5000  1.0
  As  As4  2  0.2415  0.5000  0.2451  1.0
  As  As5  2  0.2429  0.0000  0.7497  1.0
]