# generated using pymatgen
data_NaLiSO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.76769011
_cell_length_b   7.76769011
_cell_length_c   9.95878400
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000097
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaLiSO4
_chemical_formula_sum   'Na6 Li6 S6 O24'
_cell_volume   520.38015139
_cell_formula_units_Z   6
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  0.97399300  0.44824200  0.49024100  1
  Na  Na1  1  0.55175800  0.52575200  0.49024100  1
  Na  Na2  1  0.47424800  0.02600700  0.49024100  1
  Na  Na3  1  0.44824200  0.97399300  0.99024100  1
  Na  Na4  1  0.52575200  0.55175800  0.99024100  1
  Na  Na5  1  0.02600700  0.47424800  0.99024100  1
  Li  Li6  1  0.03376500  0.78753600  0.75990500  1
  Li  Li7  1  0.21246400  0.24622900  0.75990500  1
  Li  Li8  1  0.75377100  0.96623500  0.75990500  1
  Li  Li9  1  0.78753600  0.03376500  0.25990500  1
  Li  Li10  1  0.24622900  0.21246400  0.25990500  1
  Li  Li11  1  0.96623500  0.75377100  0.25990500  1
  S  S12  1  0.00000000  0.00000000  0.99929700  1
  S  S13  1  0.00000000  0.00000000  0.49929700  1
  S  S14  1  0.66666700  0.33333300  0.19758100  1
  S  S15  1  0.33333300  0.66666700  0.69758100  1
  S  S16  1  0.33333300  0.66666700  0.26419400  1
  S  S17  1  0.66666700  0.33333300  0.76419400  1
  O  O18  1  0.48133600  0.32278000  0.81513100  1
  O  O19  1  0.67722000  0.15855600  0.81513100  1
  O  O20  1  0.84144400  0.51866400  0.81513100  1
  O  O21  1  0.32278000  0.48133600  0.31513100  1
  O  O22  1  0.15855600  0.67722000  0.31513100  1
  O  O23  1  0.51866400  0.84144400  0.31513100  1
  O  O24  1  0.00000000  0.00000000  0.15200600  1
  O  O25  1  0.00000000  0.00000000  0.65200600  1
  O  O26  1  0.66666700  0.33333300  0.34671000  1
  O  O27  1  0.33333300  0.66666700  0.84671000  1
  O  O28  1  0.33333300  0.66666700  0.11469900  1
  O  O29  1  0.66666700  0.33333300  0.61469900  1
  O  O30  1  0.79131900  0.88825200  0.94965200  1
  O  O31  1  0.11174800  0.90306700  0.94965200  1
  O  O32  1  0.09693300  0.20868100  0.94965200  1
  O  O33  1  0.88825200  0.79131900  0.44965200  1
  O  O34  1  0.90306700  0.11174800  0.44965200  1
  O  O35  1  0.20868100  0.09693300  0.44965200  1
  O  O36  1  0.76841300  0.54190900  0.14557500  1
  O  O37  1  0.45809100  0.22650400  0.14557500  1
  O  O38  1  0.77349600  0.23158700  0.14557500  1
  O  O39  1  0.54190900  0.76841300  0.64557500  1
  O  O40  1  0.22650400  0.45809100  0.64557500  1
  O  O41  1  0.23158700  0.77349600  0.64557500  1
