# generated using pymatgen
data_La5SmS8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.53539634
_cell_length_b   7.53539634
_cell_length_c   7.53539634
_cell_angle_alpha   109.48381248
_cell_angle_beta   109.48381248
_cell_angle_gamma   109.44603987
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La5SmS8
_chemical_formula_sum   'La5 Sm1 S8'
_cell_volume   329.37933310
_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
  La  La0  1  0.50227000  0.12602300  0.87756700  1.0
  La  La1  1  0.75000000  0.25000000  0.50000000  1.0
  La  La2  1  0.24845600  0.62470300  0.12243300  1.0
  La  La3  1  0.37529700  0.49773000  0.62375300  1.0
  La  La4  1  0.87397700  0.75154400  0.37624700  1.0
  Sm  Sm5  1  0.00000000  0.00000000  0.00000000  1.0
  S  S6  1  0.62769700  0.87623600  0.09804600  1.0
  S  S7  1  0.62924700  0.87744200  0.60517700  1.0
  S  S8  1  0.97593100  0.37075300  0.24819600  1.0
  S  S9  1  0.27226500  0.02406900  0.39482300  1.0
  S  S10  1  0.47034900  0.37230300  0.24853900  1.0
  S  S11  1  0.12376400  0.22181000  0.75146100  1.0
  S  S12  1  0.77819000  0.52965100  0.90195400  1.0
  S  S13  1  0.12255800  0.72773500  0.75180400  1.0