# generated using pymatgen
data_NaFe(SO)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.49283019
_cell_length_b   6.33649496
_cell_length_c   6.33649496
_cell_angle_alpha   118.55649506
_cell_angle_beta   98.03749018
_cell_angle_gamma   98.03749018
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaFe(SO)2
_chemical_formula_sum   'Na2 Fe2 S4 O4'
_cell_volume   220.23712817
_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  0.75000000  0.60749900  0.39250100  1.0
  Na  Na1  1  0.25000000  0.39250100  0.60749900  1.0
  Fe  Fe2  1  0.75000000  0.93024600  0.06975400  1.0
  Fe  Fe3  1  0.25000000  0.06975400  0.93024600  1.0
  S  S4  1  0.46470500  0.92690400  0.63582100  1.0
  S  S5  1  0.03529500  0.36417900  0.07309600  1.0
  S  S6  1  0.53529500  0.07309600  0.36417900  1.0
  S  S7  1  0.96470500  0.63582100  0.92690400  1.0
  O  O8  1  0.99103300  0.23079100  0.24347800  1.0
  O  O9  1  0.50896700  0.75652200  0.76920900  1.0
  O  O10  1  0.00896700  0.76920900  0.75652200  1.0
  O  O11  1  0.49103300  0.24347800  0.23079100  1.0