# generated using pymatgen
data_LiCr2O4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.25463958
_cell_length_b   2.92963078
_cell_length_c   5.14476175
_cell_angle_alpha   89.69588146
_cell_angle_beta   69.87525216
_cell_angle_gamma   89.99245329
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCr2O4
_chemical_formula_sum   'Li1 Cr2 O4'
_cell_volume   74.36263252
_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  0.50000000  0.50000000  1
  Cr  Cr1  1  0.49999400  0.00000200  0.50000000  1
  Cr  Cr2  1  0.49999900  0.49999800  0.00000200  1
  O  O3  1  0.71197400  0.00210100  0.74543800  1
  O  O4  1  0.70325600  0.49634900  0.27333400  1
  O  O5  1  0.29674800  0.50364800  0.72666300  1
  O  O6  1  0.28802900  0.99790200  0.25456200  1
