# generated using pymatgen
data_KLiMnS2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.23988216
_cell_length_b   7.23988216
_cell_length_c   7.23988216
_cell_angle_alpha   147.41084902
_cell_angle_beta   147.41084902
_cell_angle_gamma   46.75583594
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KLiMnS2
_chemical_formula_sum   'K1 Li1 Mn1 S2'
_cell_volume   109.68670600
_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  0.00000000  0.00000000  0.00000000  1
  Li  Li1  1  0.75000000  0.25000000  0.50000000  1
  Mn  Mn2  1  0.25000000  0.75000000  0.50000000  1
  S  S3  1  0.64937700  0.64937700  0.00000000  1
  S  S4  1  0.35062300  0.35062300  0.00000000  1
