# generated using pymatgen
data_Li4Cr3(FeO4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.62850991
_cell_length_b   8.98114956
_cell_length_c   5.31464266
_cell_angle_alpha   80.23074028
_cell_angle_beta   66.81527446
_cell_angle_gamma   32.95398526
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4Cr3(FeO4)3
_chemical_formula_sum   'Li4 Cr3 Fe3 O12'
_cell_volume   217.62121842
_cell_formula_units_Z   1
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  0.57990000  0.57990000  0.92010000  1
  Li  Li1  1  0.92010000  0.92010000  0.57990000  1
  Li  Li2  1  0.33034600  0.33034600  0.66965400  1
  Li  Li3  1  0.66965400  0.66965400  0.33034600  1
  Cr  Cr4  1  0.83561100  0.83561100  0.16438900  1
  Cr  Cr5  1  0.16438900  0.16438900  0.83561100  1
  Cr  Cr6  1  0.50000000  0.50000000  0.50000000  1
  Fe  Fe7  1  0.75000000  0.75000000  0.75000000  1
  Fe  Fe8  1  0.41448500  0.41448500  0.08551500  1
  Fe  Fe9  1  0.08551500  0.08551500  0.41448500  1
  O  O10  1  0.96933000  0.53067000  0.96933000  1
  O  O11  1  0.20121300  0.62527300  0.85424500  1
  O  O12  1  0.62287100  0.05052300  0.92999300  1
  O  O13  1  0.85424500  0.31926900  0.20121300  1
  O  O14  1  0.05052300  0.62287100  0.39661300  1
  O  O15  1  0.39661300  0.92999300  0.05052300  1
  O  O16  1  0.27895200  0.72104800  0.27895200  1
  O  O17  1  0.62527300  0.20121300  0.31926900  1
  O  O18  1  0.53067000  0.96933000  0.53067000  1
  O  O19  1  0.92999300  0.39661300  0.62287100  1
  O  O20  1  0.31926900  0.85424500  0.62527300  1
  O  O21  1  0.72104800  0.27895200  0.72104800  1
