# generated using pymatgen
data_LiSiPO5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.10852800
_cell_length_b   7.37070200
_cell_length_c   6.64039500
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiSiPO5
_chemical_formula_sum   'Li4 Si4 P4 O20'
_cell_volume   298.97807112
_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  0.00000000  1
  Li  Li1  1  0.50000000  0.50000000  0.50000000  1
  Li  Li2  1  0.50000000  0.00000000  0.00000000  1
  Li  Li3  1  0.00000000  0.50000000  0.50000000  1
  Si  Si4  1  0.25000000  0.77118500  0.63995600  1
  Si  Si5  1  0.25000000  0.72881500  0.13995600  1
  Si  Si6  1  0.75000000  0.22881500  0.36004400  1
  Si  Si7  1  0.75000000  0.27118500  0.86004400  1
  P  P8  1  0.75000000  0.88446100  0.62100500  1
  P  P9  1  0.75000000  0.61553900  0.12100500  1
  P  P10  1  0.25000000  0.11553900  0.37899500  1
  P  P11  1  0.25000000  0.38446100  0.87899500  1
  O  O12  1  0.75000000  0.01534700  0.80487000  1
  O  O13  1  0.75000000  0.48465300  0.30487000  1
  O  O14  1  0.25000000  0.98465300  0.19513000  1
  O  O15  1  0.25000000  0.51534700  0.69513000  1
  O  O16  1  0.55067600  0.75729100  0.63060000  1
  O  O17  1  0.94932400  0.74270900  0.13060000  1
  O  O18  1  0.05067600  0.24270900  0.36940000  1
  O  O19  1  0.44932400  0.25729100  0.86940000  1
  O  O20  1  0.44932400  0.24270900  0.36940000  1
  O  O21  1  0.05067600  0.25729100  0.86940000  1
  O  O22  1  0.94932400  0.75729100  0.63060000  1
  O  O23  1  0.55067600  0.74270900  0.13060000  1
  O  O24  1  0.75000000  0.99811100  0.42634900  1
  O  O25  1  0.75000000  0.50188900  0.92634900  1
  O  O26  1  0.25000000  0.00188900  0.57365100  1
  O  O27  1  0.25000000  0.49811100  0.07365100  1
  O  O28  1  0.25000000  0.81948600  0.89202300  1
  O  O29  1  0.25000000  0.68051400  0.39202300  1
  O  O30  1  0.75000000  0.18051400  0.10797700  1
  O  O31  1  0.75000000  0.31948600  0.60797700  1
