# generated using pymatgen
data_Li3Cr2FeO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.65206538
_cell_length_b   6.65206538
_cell_length_c   5.94907499
_cell_angle_alpha   76.99327028
_cell_angle_beta   76.99327028
_cell_angle_gamma   25.81837323
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Cr2FeO6
_chemical_formula_sum   'Li3 Cr2 Fe1 O6'
_cell_volume   111.55087725
_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  0.00000000  0.00000000  0.00000000  1
  Li  Li1  1  0.66714700  0.66714700  0.66654300  1
  Li  Li2  1  0.33285300  0.33285300  0.33345700  1
  Cr  Cr3  1  0.66695000  0.66695000  0.16621900  1
  Cr  Cr4  1  0.33305000  0.33305000  0.83378100  1
  Fe  Fe5  1  0.00000000  0.00000000  0.50000000  1
  O  O6  1  0.16216900  0.16216900  0.40187200  1
  O  O7  1  0.82722700  0.82722700  0.06877700  1
  O  O8  1  0.83783100  0.83783100  0.59812800  1
  O  O9  1  0.49471100  0.49471100  0.73939900  1
  O  O10  1  0.50528900  0.50528900  0.26060100  1
  O  O11  1  0.17277300  0.17277300  0.93122300  1
