# generated using pymatgen
data_Li4CO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.47339242
_cell_length_b   4.47339242
_cell_length_c   4.53893106
_cell_angle_alpha   85.81002238
_cell_angle_beta   85.81002238
_cell_angle_gamma   91.51546785
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4CO4
_chemical_formula_sum   'Li4 C1 O4'
_cell_volume   90.29862029
_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  0.03104800  0.54507000  0.00920000  1
  Li  Li1  1  0.49652300  0.96176000  0.51219600  1
  Li  Li2  1  0.54507000  0.03104800  0.00920000  1
  Li  Li3  1  0.96176000  0.49652300  0.51219600  1
  C  C4  1  0.00511500  0.00511500  0.49783500  1
  O  O5  1  0.18420600  0.18420600  0.66094200  1
  O  O6  1  0.18446500  0.82154800  0.31354200  1
  O  O7  1  0.81050200  0.81050200  0.70977500  1
  O  O8  1  0.82154800  0.18446500  0.31354200  1
