# generated using pymatgen
data_NaTiS2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.08666562
_cell_length_b   7.08666562
_cell_length_c   7.08666590
_cell_angle_alpha   28.70094278
_cell_angle_beta   28.70094278
_cell_angle_gamma   28.70094000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaTiS2
_chemical_formula_sum   'Na1 Ti1 S2'
_cell_volume   72.56818157
_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
  Na  Na0  1  0.16642360  0.16642360  0.16642360  1.0
  Ti  Ti1  1  0.99775388  0.99775388  0.99775388  1.0
  S  S2  1  0.59437098  0.59437098  0.59437098  1.0
  S  S3  1  0.40145353  0.40145353  0.40145353  1.0