data_[Fe8P8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Fe  1.8300  1.4000  0.8525
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [P2_12_12_1]
_cell_length_a [4.6698]
_cell_length_b [6.2481]
_cell_length_c [7.1951]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [19]
_chemical_formula_structural [FeP]
_chemical_formula_sum '[Fe8 P8]'
_cell_volume [209.9351]
_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
[
  Fe  Fe0  4  0.0411  0.3160  0.1056  1
  Fe  Fe1  4  0.2326  0.0466  0.6202  1
  P  P2  4  0.0106  0.6857  0.6664  1
  P  P3  4  0.0132  0.6602  0.1173  1
]