data_[Tc8P32]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tc  1.9000  1.3500  0.7417
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [Pbca]
_cell_length_a [6.2662]
_cell_length_b [9.2612]
_cell_length_c [10.8978]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [61]
_chemical_formula_structural [TcP4]
_chemical_formula_sum '[Tc8 P32]'
_cell_volume [632.4293]
_cell_formula_units_Z [8]
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
[
  Tc  Tc0  8  0.1212  0.6092  0.4247  1
  P  P1  8  0.0009  0.2083  0.4312  1
  P  P2  8  0.0594  0.7187  0.7643  1
  P  P3  8  0.1904  0.0532  0.7618  1
  P  P4  8  0.2437  0.0436  0.0811  1
]