# generated using pymatgen
data_KSmS2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.70565355
_cell_length_b   7.70565355
_cell_length_c   7.70565401
_cell_angle_alpha   31.11883067
_cell_angle_beta   31.11883067
_cell_angle_gamma   31.11883305
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KSmS2
_chemical_formula_sum   'K1 Sm1 S2'
_cell_volume   108.43211238
_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
  K  K0  1  0.50000000  0.50000000  0.50000000  1.0
  Sm  Sm1  1  -0.00000000  -0.00000000  0.00000000  1.0
  S  S2  1  0.73560513  0.73560513  0.73560513  1.0
  S  S3  1  0.26439487  0.26439487  0.26439487  1.0