# generated using pymatgen
data_LiH2ClO5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.80372901
_cell_length_b   7.80372901
_cell_length_c   10.51481246
_cell_angle_alpha   69.94252562
_cell_angle_beta   69.94252562
_cell_angle_gamma   40.14510281
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiH2ClO5
_chemical_formula_sum   'Li4 H8 Cl4 O20'
_cell_volume   384.33332672
_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  0.50000000  0.00000000  1
  Li  Li1  1  0.50000000  0.00000000  0.50000000  1
  Li  Li2  1  0.43435500  0.56564500  0.75000000  1
  Li  Li3  1  0.56564500  0.43435500  0.25000000  1
  H  H4  1  0.35749000  0.44470400  0.01417600  1
  H  H5  1  0.55529600  0.64251000  0.48582400  1
  H  H6  1  0.64251000  0.55529600  0.98582400  1
  H  H7  1  0.44470400  0.35749000  0.51417600  1
  H  H8  1  0.50698600  0.20989000  0.93677800  1
  H  H9  1  0.79011000  0.49301400  0.56322200  1
  H  H10  1  0.49301400  0.79011000  0.06322200  1
  H  H11  1  0.20989000  0.50698600  0.43677800  1
  Cl  Cl12  1  0.83123200  0.91198900  0.70615200  1
  Cl  Cl13  1  0.08801100  0.16876800  0.79384800  1
  Cl  Cl14  1  0.16876800  0.08801100  0.29384800  1
  Cl  Cl15  1  0.91198900  0.83123200  0.20615200  1
  O  O16  1  0.75538500  0.83463100  0.64934900  1
  O  O17  1  0.16536900  0.24461500  0.85065100  1
  O  O18  1  0.24461500  0.16536900  0.35065100  1
  O  O19  1  0.83463100  0.75538500  0.14934900  1
  O  O20  1  0.66342200  0.19771700  0.66230500  1
  O  O21  1  0.80228300  0.33657800  0.83769500  1
  O  O22  1  0.33657800  0.80228300  0.33769500  1
  O  O23  1  0.19771700  0.66342200  0.16230500  1
  O  O24  1  0.79072400  0.86533100  0.85587500  1
  O  O25  1  0.13466900  0.20927600  0.64412500  1
  O  O26  1  0.20927600  0.13466900  0.14412500  1
  O  O27  1  0.86533100  0.79072400  0.35587500  1
  O  O28  1  0.11223000  0.75512000  0.65872600  1
  O  O29  1  0.24488000  0.88777000  0.84127400  1
  O  O30  1  0.88777000  0.24488000  0.34127400  1
  O  O31  1  0.75512000  0.11223000  0.15872600  1
  O  O32  1  0.35260200  0.40529800  0.93724400  1
  O  O33  1  0.59470200  0.64739800  0.56275600  1
  O  O34  1  0.64739800  0.59470200  0.06275600  1
  O  O35  1  0.40529800  0.35260200  0.43724400  1
