# generated using pymatgen
data_Na3FeO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.02791300
_cell_length_b   7.44571300
_cell_length_c   8.21153900
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Na3FeO4
_chemical_formula_sum   'Na12 Fe4 O16'
_cell_volume   429.69196088
_cell_formula_units_Z   4
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  0.04337600  0.27011100  0.03694100  1.0
  Na  Na1  1  0.04337600  0.27011100  0.46305900  1.0
  Na  Na2  1  0.17181900  0.04855000  0.75000000  1.0
  Na  Na3  1  0.32818100  0.54855000  0.25000000  1.0
  Na  Na4  1  0.45662400  0.77011100  0.53694100  1.0
  Na  Na5  1  0.45662400  0.77011100  0.96305900  1.0
  Na  Na6  1  0.54337600  0.22988900  0.03694100  1.0
  Na  Na7  1  0.54337600  0.22988900  0.46305900  1.0
  Na  Na8  1  0.67181900  0.45145000  0.75000000  1.0
  Na  Na9  1  0.82818100  0.95145000  0.25000000  1.0
  Na  Na10  1  0.95662400  0.72988900  0.53694100  1.0
  Na  Na11  1  0.95662400  0.72988900  0.96305900  1.0
  Fe  Fe12  1  0.21669100  0.50321600  0.75000000  1.0
  Fe  Fe13  1  0.28330900  0.00321600  0.25000000  1.0
  Fe  Fe14  1  0.71669100  0.99678400  0.75000000  1.0
  Fe  Fe15  1  0.78330900  0.49678400  0.25000000  1.0
  O  O16  1  0.00009800  0.38781400  0.75000000  1.0
  O  O17  1  0.17959800  0.95476300  0.06192500  1.0
  O  O18  1  0.17959800  0.95476300  0.43807500  1.0
  O  O19  1  0.19857300  0.73911900  0.75000000  1.0
  O  O20  1  0.30142700  0.23911900  0.25000000  1.0
  O  O21  1  0.32040200  0.45476300  0.56192500  1.0
  O  O22  1  0.32040200  0.45476300  0.93807500  1.0
  O  O23  1  0.49990200  0.88781400  0.25000000  1.0
  O  O24  1  0.50009800  0.11218600  0.75000000  1.0
  O  O25  1  0.67959800  0.54523700  0.06192500  1.0
  O  O26  1  0.67959800  0.54523700  0.43807500  1.0
  O  O27  1  0.69857300  0.76088100  0.75000000  1.0
  O  O28  1  0.80142700  0.26088100  0.25000000  1.0
  O  O29  1  0.82040200  0.04523700  0.56192500  1.0
  O  O30  1  0.82040200  0.04523700  0.93807500  1.0
  O  O31  1  0.99990200  0.61218600  0.25000000  1.0