data_[Tb12As2P10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  As  2.1800  1.1500  0.6600
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.0125]
_cell_length_b [12.1411]
_cell_length_c [7.0089]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.4781]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tb6AsP5]
_chemical_formula_sum '[Tb12 As2 P10]'
_cell_volume [562.5820]
_cell_formula_units_Z [2]
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  0.2470  0.3312  0.7477  1
  Tb  Tb1  4  0.2464  0.5000  0.2522  1
  As  As2  2  0.0000  0.0000  0.0000  1
  P  P3  4  0.0000  0.1657  0.5000  1
  P  P4  4  0.0000  0.3333  0.0000  1
  P  P5  2  0.0000  0.5000  0.5000  1
]