# generated using pymatgen
data_La3TiAlS7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.41234587
_cell_length_b   10.41234587
_cell_length_c   5.83747200
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999918
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La3TiAlS7
_chemical_formula_sum   'La6 Ti2 Al2 S14'
_cell_volume   548.09093261
_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
  La  La0  1  0.75667500  0.12955900  0.73886000  1.0
  La  La1  1  0.37288400  0.24332500  0.73886000  1.0
  La  La2  1  0.87044100  0.62711600  0.73886000  1.0
  La  La3  1  0.24332500  0.87044100  0.23886000  1.0
  La  La4  1  0.62711600  0.75667500  0.23886000  1.0
  La  La5  1  0.12955900  0.37288400  0.23886000  1.0
  Ti  Ti6  1  0.00000000  0.00000000  0.49887900  1.0
  Ti  Ti7  1  0.00000000  0.00000000  0.99887900  1.0
  Al  Al8  1  0.66666700  0.33333300  0.15421600  1.0
  Al  Al9  1  0.33333300  0.66666700  0.65421600  1.0
  S  S10  1  0.84940100  0.07891300  0.25038700  1.0
  S  S11  1  0.22951200  0.15059900  0.25038700  1.0
  S  S12  1  0.92108700  0.77048800  0.25038700  1.0
  S  S13  1  0.15059900  0.92108700  0.75038700  1.0
  S  S14  1  0.77048800  0.84940100  0.75038700  1.0
  S  S15  1  0.07891300  0.22951200  0.75038700  1.0
  S  S16  1  0.89465300  0.40903100  0.00987500  1.0
  S  S17  1  0.51437700  0.10534700  0.00987500  1.0
  S  S18  1  0.59096900  0.48562300  0.00987500  1.0
  S  S19  1  0.10534700  0.59096900  0.50987500  1.0
  S  S20  1  0.48562300  0.89465300  0.50987500  1.0
  S  S21  1  0.40903100  0.51437700  0.50987500  1.0
  S  S22  1  0.66666700  0.33333300  0.53187200  1.0
  S  S23  1  0.33333300  0.66666700  0.03187200  1.0