# generated using pymatgen
data_Li2CrCuO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.12531967
_cell_length_b   5.76306100
_cell_length_c   5.13163984
_cell_angle_alpha   89.99995705
_cell_angle_beta   68.36267544
_cell_angle_gamma   90.00003252
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2CrCuO4
_chemical_formula_sum   'Li4 Cr2 Cu2 O8'
_cell_volume   140.89538895
_cell_formula_units_Z   2
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  0.49999900  0.24990600  0.00000200  1
  Li  Li1  1  0.00000100  0.74997000  0.49999800  1
  Li  Li2  1  0.50000000  0.00009700  0.49999800  1
  Li  Li3  1  0.00000000  0.50000600  0.00000100  1
  Cr  Cr4  1  0.49999700  0.50074100  0.50000300  1
  Cr  Cr5  1  0.00000800  0.00074700  0.00000400  1
  Cu  Cu6  1  0.99999500  0.24975500  0.49999800  1
  Cu  Cu7  1  0.50000300  0.74972000  0.99999900  1
  O  O8  1  0.76788200  0.24981800  0.26726100  1
  O  O9  1  0.26799700  0.74981000  0.76739200  1
  O  O10  1  0.23211600  0.24981900  0.73273400  1
  O  O11  1  0.73200300  0.74981200  0.23260700  1
  O  O12  1  0.23567900  0.99987800  0.23595500  1
  O  O13  1  0.73559100  0.50002100  0.73605700  1
  O  O14  1  0.26440600  0.50002000  0.26394300  1
  O  O15  1  0.76432200  0.99988000  0.76404800  1
