# generated using pymatgen
data_Na6FeS4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.94658758
_cell_length_b   8.94658758
_cell_length_c   6.94735400
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999689
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Na6FeS4
_chemical_formula_sum   'Na12 Fe2 S8'
_cell_volume   481.57608237
_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  0.14686900  0.85313100  0.53943000  1.0
  Na  Na1  1  0.29373700  0.14686900  0.03943000  1.0
  Na  Na2  1  0.85313100  0.70626300  0.03943000  1.0
  Na  Na3  1  0.14686900  0.29373700  0.53943000  1.0
  Na  Na4  1  0.70626300  0.85313100  0.53943000  1.0
  Na  Na5  1  0.85313100  0.14686900  0.03943000  1.0
  Na  Na6  1  0.53170800  0.46829200  0.36870400  1.0
  Na  Na7  1  0.06341500  0.53170800  0.86870400  1.0
  Na  Na8  1  0.46829200  0.93658500  0.86870400  1.0
  Na  Na9  1  0.53170800  0.06341500  0.36870400  1.0
  Na  Na10  1  0.93658500  0.46829200  0.36870400  1.0
  Na  Na11  1  0.46829200  0.53170800  0.86870400  1.0
  Fe  Fe12  1  0.66666700  0.33333300  0.75286900  1.0
  Fe  Fe13  1  0.33333300  0.66666700  0.25286900  1.0
  S  S14  1  0.81089100  0.18910900  0.64587900  1.0
  S  S15  1  0.62178200  0.81089100  0.14587900  1.0
  S  S16  1  0.33333300  0.66666700  0.59199100  1.0
  S  S17  1  0.66666700  0.33333300  0.09199100  1.0
  S  S18  1  0.18910900  0.81089100  0.14587900  1.0
  S  S19  1  0.37821800  0.18910900  0.64587900  1.0
  S  S20  1  0.81089100  0.62178200  0.64587900  1.0
  S  S21  1  0.18910900  0.37821800  0.14587900  1.0