# generated using pymatgen
data_Li3FeO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.88602600
_cell_length_b   5.90474000
_cell_length_c   8.42948800
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3FeO3
_chemical_formula_sum   'Li12 Fe4 O12'
_cell_volume   292.97067537
_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
  Li  Li0  1  0.48252900  0.99442700  0.75133800  1
  Li  Li1  1  0.01747100  0.99442700  0.75133800  1
  Li  Li2  1  0.75000000  0.25550500  0.47576000  1
  Li  Li3  1  0.25000000  0.24449500  0.97576000  1
  Li  Li4  1  0.51747100  0.50557300  0.25133800  1
  Li  Li5  1  0.98252900  0.50557300  0.25133800  1
  Li  Li6  1  0.48252900  0.49442700  0.74866200  1
  Li  Li7  1  0.01747100  0.49442700  0.74866200  1
  Li  Li8  1  0.75000000  0.75550500  0.02424000  1
  Li  Li9  1  0.25000000  0.74449500  0.52424000  1
  Li  Li10  1  0.98252900  0.00557300  0.24866200  1
  Li  Li11  1  0.51747100  0.00557300  0.24866200  1
  Fe  Fe12  1  0.75000000  0.21898000  0.01718800  1
  Fe  Fe13  1  0.25000000  0.28102000  0.51718800  1
  Fe  Fe14  1  0.75000000  0.71898000  0.48281200  1
  Fe  Fe15  1  0.25000000  0.78102000  0.98281200  1
  O  O16  1  0.00000000  0.00000000  0.00000000  1
  O  O17  1  0.50000000  0.00000000  0.00000000  1
  O  O18  1  0.25000000  0.02305700  0.39024400  1
  O  O19  1  0.25000000  0.24001100  0.73778300  1
  O  O20  1  0.75000000  0.25998900  0.23778300  1
  O  O21  1  0.75000000  0.47694300  0.89024400  1
  O  O22  1  0.50000000  0.50000000  0.50000000  1
  O  O23  1  0.00000000  0.50000000  0.50000000  1
  O  O24  1  0.25000000  0.52305700  0.10975600  1
  O  O25  1  0.25000000  0.74001100  0.76221700  1
  O  O26  1  0.75000000  0.75998900  0.26221700  1
  O  O27  1  0.75000000  0.97694300  0.60975600  1
