# generated using pymatgen
data_Li2Cr3FeO8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.91876222
_cell_length_b   5.91876222
_cell_length_c   5.91876233
_cell_angle_alpha   60.22436753
_cell_angle_beta   60.22436753
_cell_angle_gamma   60.22437603
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Cr3FeO8
_chemical_formula_sum   'Li2 Cr3 Fe1 O8'
_cell_volume   147.35953085
_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  0.87531400  0.87531400  0.87531400  1
  Li  Li1  1  0.12468600  0.12468600  0.12468600  1
  Cr  Cr2  1  0.00000000  0.50000000  0.50000000  1
  Cr  Cr3  1  0.50000000  0.00000000  0.50000000  1
  Cr  Cr4  1  0.50000000  0.50000000  0.00000000  1
  Fe  Fe5  1  0.50000000  0.50000000  0.50000000  1
  O  O6  1  0.73256900  0.73256900  0.73256900  1
  O  O7  1  0.73854800  0.73854800  0.28687000  1
  O  O8  1  0.73854800  0.28687000  0.73854800  1
  O  O9  1  0.28687000  0.73854800  0.73854800  1
  O  O10  1  0.71313000  0.26145200  0.26145200  1
  O  O11  1  0.26145200  0.71313000  0.26145200  1
  O  O12  1  0.26145200  0.26145200  0.71313000  1
  O  O13  1  0.26743100  0.26743100  0.26743100  1
