data_[La2Sm8P10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Sm  1.1700  1.8500  1.2290
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [13.7287]
_cell_length_b [4.1445]
_cell_length_c [10.1489]
_cell_angle_alpha [90.0000]
_cell_angle_beta [119.5108]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [LaSm4P5]
_chemical_formula_sum '[La2 Sm8 P10]'
_cell_volume [502.5391]
_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
[
  La  La0  2  0.0000  0.0000  0.0000  1
  Sm  Sm1  4  0.0992  0.5000  0.4007  1
  Sm  Sm2  4  0.2003  0.0000  0.7975  1
  P  P3  4  0.1029  0.5000  0.8974  1
  P  P4  4  0.2016  0.0000  0.3043  1
  P  P5  2  0.0000  0.0000  0.5000  1
]