# generated using pymatgen
data_LiH20C8ClO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.79329505
_cell_length_b   7.79329505
_cell_length_c   12.21195295
_cell_angle_alpha   85.24562258
_cell_angle_beta   85.24562258
_cell_angle_gamma   62.42401057
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiH20C8ClO4
_chemical_formula_sum   'Li2 H40 C16 Cl2 O8'
_cell_volume   654.34516251
_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  0.05380900  0.94619100  0.75000000  1
  Li  Li1  1  0.94619100  0.05380900  0.25000000  1
  H  H2  1  0.13869700  0.71071800  0.46920900  1
  H  H3  1  0.28928200  0.86130300  0.03079100  1
  H  H4  1  0.86130300  0.28928200  0.53079100  1
  H  H5  1  0.71071800  0.13869700  0.96920900  1
  H  H6  1  0.23981900  0.54949100  0.58654600  1
  H  H7  1  0.45050900  0.76018100  0.91345400  1
  H  H8  1  0.76018100  0.45050900  0.41345400  1
  H  H9  1  0.54949100  0.23981900  0.08654600  1
  H  H10  1  0.44106800  0.87422100  0.59967600  1
  H  H11  1  0.12577900  0.55893200  0.90032400  1
  H  H12  1  0.55893200  0.12577900  0.40032400  1
  H  H13  1  0.87422100  0.44106800  0.09967600  1
  H  H14  1  0.49266800  0.62437900  0.60491000  1
  H  H15  1  0.37562100  0.50733200  0.89509000  1
  H  H16  1  0.50733200  0.37562100  0.39509000  1
  H  H17  1  0.62437900  0.49266800  0.10491000  1
  H  H18  1  0.42329800  0.76859600  0.47769900  1
  H  H19  1  0.23140400  0.57670200  0.02230100  1
  H  H20  1  0.57670200  0.23140400  0.52230100  1
  H  H21  1  0.76859600  0.42329800  0.97769900  1
  H  H22  1  0.88900900  0.64880900  0.58531600  1
  H  H23  1  0.35119100  0.11099100  0.91468400  1
  H  H24  1  0.11099100  0.35119100  0.41468400  1
  H  H25  1  0.64880900  0.88900900  0.08531600  1
  H  H26  1  0.83305500  0.90035400  0.57863400  1
  H  H27  1  0.09964600  0.16694500  0.92136600  1
  H  H28  1  0.16694500  0.09964600  0.42136600  1
  H  H29  1  0.90035400  0.83305500  0.07863400  1
  H  H30  1  0.77814100  0.77132900  0.86963400  1
  H  H31  1  0.22867100  0.22185900  0.63036600  1
  H  H32  1  0.22185900  0.22867100  0.13036600  1
  H  H33  1  0.77132900  0.77814100  0.36963400  1
  H  H34  1  0.64445100  0.91863800  0.75592300  1
  H  H35  1  0.08136200  0.35554900  0.74407700  1
  H  H36  1  0.35554900  0.08136200  0.24407700  1
  H  H37  1  0.91863800  0.64445100  0.25592300  1
  H  H38  1  0.72830000  0.65885500  0.76219800  1
  H  H39  1  0.34114500  0.27170000  0.73780200  1
  H  H40  1  0.27170000  0.34114500  0.23780200  1
  H  H41  1  0.65885500  0.72830000  0.26219800  1
  C  C42  1  0.13817400  0.69968800  0.56017300  1
  C  C43  1  0.30031200  0.86182600  0.93982700  1
  C  C44  1  0.86182600  0.30031200  0.43982700  1
  C  C45  1  0.69968800  0.13817400  0.06017300  1
  C  C46  1  0.40157900  0.76985600  0.56798600  1
  C  C47  1  0.23014400  0.59842100  0.93201400  1
  C  C48  1  0.59842100  0.23014400  0.43201400  1
  C  C49  1  0.76985600  0.40157900  0.06798600  1
  C  C50  1  0.93659700  0.75361300  0.60894500  1
  C  C51  1  0.24638700  0.06340300  0.89105500  1
  C  C52  1  0.06340300  0.24638700  0.39105500  1
  C  C53  1  0.75361300  0.93659700  0.10894500  1
  C  C54  1  0.76160200  0.77609500  0.78064800  1
  C  C55  1  0.22390500  0.23839800  0.71935200  1
  C  C56  1  0.23839800  0.22390500  0.21935200  1
  C  C57  1  0.77609500  0.76160200  0.28064800  1
  Cl  Cl58  1  0.75437300  0.24562700  0.75000000  1
  Cl  Cl59  1  0.24562700  0.75437300  0.25000000  1
  O  O60  1  0.20100100  0.82993300  0.59903800  1
  O  O61  1  0.17006700  0.79899900  0.90096200  1
  O  O62  1  0.79899900  0.17006700  0.40096200  1
  O  O63  1  0.82993300  0.20100100  0.09903800  1
  O  O64  1  0.94231100  0.74818800  0.72641000  1
  O  O65  1  0.25181200  0.05768900  0.77359000  1
  O  O66  1  0.05768900  0.25181200  0.27359000  1
  O  O67  1  0.74818800  0.94231100  0.22641000  1
