data_[Sm2Sc10P12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  Sc  1.3600  1.6000  0.8850
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [6.6198]
_cell_length_b [11.4649]
_cell_length_c [6.6189]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.5566]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [SmSc5P6]
_chemical_formula_sum '[Sm2 Sc10 P12]'
_cell_volume [473.3627]
_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
[
  Sm  Sm0  2  0.0000  0.0000  0.0000  1
  Sc  Sc1  4  0.0000  0.1638  0.5000  1
  Sc  Sc2  4  0.0000  0.3326  0.0000  1
  Sc  Sc3  2  0.0000  0.5000  0.5000  1
  P  P4  8  0.2412  0.3273  0.7420  1
  P  P5  4  0.2400  0.5000  0.2562  1
]