data_[Tb10Np2P12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Np  1.3600  1.7500  1.0000
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [6.9488]
_cell_length_b [12.0357]
_cell_length_c [6.9478]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.4484]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tb5NpP6]
_chemical_formula_sum '[Tb10 Np2 P12]'
_cell_volume [547.9119]
_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  0.0000  0.1681  0.5000  1
  Tb  Tb1  4  0.0000  0.3337  0.0000  1
  Tb  Tb2  2  0.0000  0.5000  0.5000  1
  Np  Np3  2  0.0000  0.0000  0.0000  1
  P  P4  8  0.2460  0.1637  0.2471  1
  P  P5  4  0.2451  0.0000  0.7538  1
]