data_[Fe2Sb3P1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Fe  1.8300  1.4000  0.8525
  Sb  2.0500  1.4500  0.8300
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [Pm]
_cell_length_a [5.6275]
_cell_length_b [3.0791]
_cell_length_c [6.3155]
_cell_angle_alpha [90.0000]
_cell_angle_beta [91.8558]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [6]
_chemical_formula_structural [Fe2Sb3P]
_chemical_formula_sum '[Fe2 Sb3 P1]'
_cell_volume [109.3744]
_cell_formula_units_Z [1]
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  1  0.0142  0.0000  0.0258  1
  Fe  Fe1  1  0.4650  0.5000  0.4855  1
  Sb  Sb2  1  0.3091  0.5000  0.8523  1
  Sb  Sb3  1  0.6925  0.5000  0.1499  1
  Sb  Sb4  1  0.8237  0.0000  0.6340  1
  P  P5  1  0.1955  0.0000  0.3525  1
]