# generated using pymatgen
data_LiClO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.79246560
_cell_length_b   6.71713302
_cell_length_c   8.58460799
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiClO4
_chemical_formula_sum   'Li4 Cl4 O16'
_cell_volume   276.35251491
_cell_formula_units_Z   4
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  0.50000000  1
  Li  Li1  1  0.50000000  -0.00000000  -0.00000000  1
  Li  Li2  1  -0.00000000  0.50000000  0.50000000  1
  Li  Li3  1  0.50000000  0.50000000  -0.00000000  1
  Cl  Cl4  1  0.53610684  0.25000000  0.31736420  1
  Cl  Cl5  1  0.03610684  0.75000000  0.18263580  1
  Cl  Cl6  1  0.46389316  0.75000000  0.68263580  1
  Cl  Cl7  1  0.96389316  0.25000000  0.81736420  1
  O  O8  1  0.95261501  0.25000000  0.64801075  1
  O  O9  1  0.45261501  0.75000000  0.85198925  1
  O  O10  1  0.04738499  0.75000000  0.35198925  1
  O  O11  1  0.54738499  0.25000000  0.14801075  1
  O  O12  1  0.82695868  0.42638079  0.87217144  1
  O  O13  1  0.32695868  0.57361921  0.62782856  1
  O  O14  1  0.17304132  0.92638079  0.12782856  1
  O  O15  1  0.67304132  0.07361921  0.37217144  1
  O  O16  1  0.17304132  0.57361921  0.12782856  1
  O  O17  1  0.67304132  0.42638079  0.37217144  1
  O  O18  1  0.82695868  0.07361921  0.87217144  1
  O  O19  1  0.32695868  0.92638079  0.62782856  1
  O  O20  1  0.24993744  0.25000000  0.86916738  1
  O  O21  1  0.74993744  0.75000000  0.63083262  1
  O  O22  1  0.75006256  0.75000000  0.13083262  1
  O  O23  1  0.25006256  0.25000000  0.36916738  1
