data_[Tb12Te2As6P4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Te  2.1000  1.4000  1.2933
  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 [18.0014]
_cell_length_b [4.1354]
_cell_length_c [8.3222]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.9216]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tb6TeAs3P2]
_chemical_formula_sum '[Tb12 Te2 As6 P4]'
_cell_volume [603.8402]
_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  4  0.0039  0.0000  0.2704  1.0
  Tb  Tb1  4  0.1696  0.5000  0.5797  1.0
  Tb  Tb2  4  0.1749  0.5000  0.0950  1.0
  Te  Te3  2  0.0000  0.5000  0.0000  1.0
  As  As4  4  0.1633  0.0000  0.8329  1.0
  As  As5  2  0.0000  0.5000  0.5000  1.0
  P  P6  4  0.1675  0.0000  0.3344  1.0
]