# generated using pymatgen
data_Ti2CoS4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.54401306
_cell_length_b   3.38285115
_cell_length_c   5.82416113
_cell_angle_alpha   90.00000000
_cell_angle_beta   117.27512919
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti2CoS4
_chemical_formula_sum   'Ti4 Co2 S8'
_cell_volume   219.66696422
_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
  Ti  Ti0  1  0.74362500  0.00000000  0.73513700  1
  Ti  Ti1  1  0.75637500  0.50000000  0.26486300  1
  Ti  Ti2  1  0.24362500  0.50000000  0.73513700  1
  Ti  Ti3  1  0.25637500  0.00000000  0.26486300  1
  Co  Co4  1  0.00000000  0.00000000  0.00000000  1
  Co  Co5  1  0.50000000  0.50000000  0.00000000  1
  S  S6  1  0.88538200  0.00000000  0.55634300  1
  S  S7  1  0.61461800  0.50000000  0.44365700  1
  S  S8  1  0.62017800  0.00000000  0.95967800  1
  S  S9  1  0.87982200  0.50000000  0.04032200  1
  S  S10  1  0.38538200  0.50000000  0.55634300  1
  S  S11  1  0.11461800  0.00000000  0.44365700  1
  S  S12  1  0.12017800  0.50000000  0.95967800  1
  S  S13  1  0.37982200  0.00000000  0.04032200  1
