data_[Pm6Sc2P8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pm  1.1300  1.8500  1.1100
  Sc  1.3600  1.6000  0.8850
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [P2/c]
_cell_length_a [7.0015]
_cell_length_b [8.1031]
_cell_length_c [7.0098]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.5199]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [13]
_chemical_formula_structural [Pm3ScP4]
_chemical_formula_sum '[Pm6 Sc2 P8]'
_cell_volume [374.8326]
_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
[
  Pm  Pm0  2  0.0000  0.3726  0.2500  1
  Pm  Pm1  2  0.5000  0.1235  0.2500  1
  Pm  Pm2  2  0.5000  0.3722  0.7500  1
  Sc  Sc3  2  0.0000  0.1231  0.7500  1
  P  P4  4  0.2347  0.1166  0.5005  1
  P  P5  4  0.2432  0.3674  0.9922  1
]