# generated using pymatgen
data_Na5Li3(TiS4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.09720047
_cell_length_b   10.09720047
_cell_length_c   12.17683231
_cell_angle_alpha   52.95637746
_cell_angle_beta   52.95637746
_cell_angle_gamma   57.47672668
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Na5Li3(TiS4)2
_chemical_formula_sum   'Na10 Li6 Ti4 S16'
_cell_volume   760.59604074
_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
  Na  Na0  1  0.41378200  0.38672800  0.73445800  1
  Na  Na1  1  0.00814500  0.99185500  0.25000000  1
  Na  Na2  1  0.39238700  0.90049400  0.48402500  1
  Na  Na3  1  0.60761300  0.09950600  0.51597500  1
  Na  Na4  1  0.58621800  0.61327200  0.26554200  1
  Na  Na5  1  0.99185500  0.00814500  0.75000000  1
  Na  Na6  1  0.90049400  0.39238700  0.98402500  1
  Na  Na7  1  0.09950600  0.60761300  0.01597500  1
  Na  Na8  1  0.38672800  0.41378200  0.23445800  1
  Na  Na9  1  0.61327200  0.58621800  0.76554200  1
  Li  Li10  1  0.80609000  0.80851900  0.75815800  1
  Li  Li11  1  0.19148100  0.19391000  0.74184200  1
  Li  Li12  1  0.80851900  0.80609000  0.25815800  1
  Li  Li13  1  0.50000000  0.00000000  0.00000000  1
  Li  Li14  1  0.00000000  0.50000000  0.50000000  1
  Li  Li15  1  0.19391000  0.19148100  0.24184200  1
  Ti  Ti16  1  0.84853500  0.31884300  0.46774500  1
  Ti  Ti17  1  0.15146500  0.68115700  0.53225500  1
  Ti  Ti18  1  0.31884300  0.84853500  0.96774500  1
  Ti  Ti19  1  0.68115700  0.15146500  0.03225500  1
  S  S20  1  0.42527800  0.31654200  0.00812700  1
  S  S21  1  0.11807100  0.71033600  0.17667500  1
  S  S22  1  0.57472200  0.68345800  0.99187300  1
  S  S23  1  0.75817800  0.88444800  0.04967500  1
  S  S24  1  0.10508100  0.66638200  0.74781600  1
  S  S25  1  0.68345800  0.57472200  0.49187300  1
  S  S26  1  0.24182200  0.11555200  0.95032500  1
  S  S27  1  0.28966400  0.88192900  0.32332500  1
  S  S28  1  0.33361800  0.89491900  0.75218400  1
  S  S29  1  0.66638200  0.10508100  0.24781600  1
  S  S30  1  0.88444800  0.75817800  0.54967500  1
  S  S31  1  0.11555200  0.24182200  0.45032500  1
  S  S32  1  0.88192900  0.28966400  0.82332500  1
  S  S33  1  0.71033600  0.11807100  0.67667500  1
  S  S34  1  0.31654200  0.42527800  0.50812700  1
  S  S35  1  0.89491900  0.33361800  0.25218400  1
