# generated using pymatgen
data_Na(Ti3S4)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.84554210
_cell_length_b   9.45002240
_cell_length_c   10.05358204
_cell_angle_alpha   118.02285533
_cell_angle_beta   109.91048614
_cell_angle_gamma   89.99584771
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Na(Ti3S4)4
_chemical_formula_sum   'Na1 Ti12 S16'
_cell_volume   529.68893977
_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  0.00000000  0.00000000  0.00000000  1.0
  Ti  Ti1  1  0.55685753  0.35299103  0.86569162  1.0
  Ti  Ti2  1  0.05931569  0.35472440  0.86652936  1.0
  Ti  Ti3  1  0.36939440  0.13353880  0.48738838  1.0
  Ti  Ti4  1  0.86820719  0.13421597  0.48813450  1.0
  Ti  Ti5  1  0.44670729  0.51179360  0.64609354  1.0
  Ti  Ti6  1  0.94901685  0.51254358  0.64620374  1.0
  Ti  Ti7  1  0.94068431  0.64527560  0.13347064  1.0
  Ti  Ti8  1  0.44314247  0.64700897  0.13430838  1.0
  Ti  Ti9  1  0.13179281  0.86578403  0.51186550  1.0
  Ti  Ti10  1  0.63060560  0.86646120  0.51261162  1.0
  Ti  Ti11  1  0.05098315  0.48745642  0.35379626  1.0
  Ti  Ti12  1  0.55329271  0.48820640  0.35390646  1.0
  S  S13  1  0.97219806  0.04816288  0.69351438  1.0
  S  S14  1  0.47088157  0.04835087  0.69232184  1.0
  S  S15  1  0.80289246  0.30777006  0.35630834  1.0
  S  S16  1  0.30275881  0.30703150  0.35475280  1.0
  S  S17  1  0.10135677  0.64586683  0.95237285  1.0
  S  S18  1  0.60057671  0.64340303  0.95124949  1.0
  S  S19  1  0.52911843  0.95164913  0.30767816  1.0
  S  S20  1  0.02780194  0.95183712  0.30648562  1.0
  S  S21  1  0.69724119  0.69296850  0.64524720  1.0
  S  S22  1  0.19710754  0.69222994  0.64369166  1.0
  S  S23  1  0.39942329  0.35659697  0.04875051  1.0
  S  S24  1  0.89864323  0.35413317  0.04762715  1.0
  S  S25  1  0.79200948  0.66704208  0.33360610  1.0
  S  S26  1  0.29157004  0.66636905  0.33315966  1.0
  S  S27  1  0.70842996  0.33363095  0.66684034  1.0
  S  S28  1  0.20799052  0.33295792  0.66639390  1.0