# generated using pymatgen
data_Li2ScP2HO8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.30120200
_cell_length_b   4.91303000
_cell_length_c   7.75950227
_cell_angle_alpha   76.01007921
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2ScP2HO8
_chemical_formula_sum   'Li4 Sc2 P4 H2 O16'
_cell_volume   307.07709419
_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  0.63329500  0.36498700  0.09274200  1
  Li  Li1  1  0.86458200  0.85482100  0.58714100  1
  Li  Li2  1  0.36458200  0.14517900  0.41285900  1
  Li  Li3  1  0.13329500  0.63501300  0.90725800  1
  Sc  Sc4  1  0.50040100  0.75126100  0.74364000  1
  Sc  Sc5  1  0.00040100  0.24873900  0.25636000  1
  P  P6  1  0.84337600  0.88097100  0.98467000  1
  P  P7  1  0.65018600  0.38701700  0.47441000  1
  P  P8  1  0.15018600  0.61298300  0.52559000  1
  P  P9  1  0.34337600  0.11902900  0.01533000  1
  H  H10  1  0.97951600  0.20980100  0.76496500  1
  H  H11  1  0.47951600  0.79019900  0.23503500  1
  O  O12  1  0.82259900  0.10913300  0.08825500  1
  O  O13  1  0.67568400  0.60664400  0.58638500  1
  O  O14  1  0.17568400  0.39335600  0.41361500  1
  O  O15  1  0.32259900  0.89086700  0.91174500  1
  O  O16  1  0.93236800  0.00638900  0.79990800  1
  O  O17  1  0.56014100  0.50827400  0.29863400  1
  O  O18  1  0.06014100  0.49172600  0.70136600  1
  O  O19  1  0.43236800  0.99361100  0.20009200  1
  O  O20  1  0.68328100  0.76088800  0.93588500  1
  O  O21  1  0.81495100  0.26381200  0.43481700  1
  O  O22  1  0.31495100  0.73618800  0.56518300  1
  O  O23  1  0.18328100  0.23911200  0.06411500  1
  O  O24  1  0.95359800  0.64288900  0.08508000  1
  O  O25  1  0.54502200  0.14367000  0.58499900  1
  O  O26  1  0.04502200  0.85633000  0.41500100  1
  O  O27  1  0.45359800  0.35711100  0.91492000  1
