# generated using pymatgen
data_LiCu2PO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.26309100
_cell_length_b   6.23702500
_cell_length_c   10.89669500
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCu2PO4
_chemical_formula_sum   'Li4 Cu8 P4 O16'
_cell_volume   357.69523854
_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  0.29812000  0.75000000  0.08298500  1
  Li  Li1  1  0.20188000  0.75000000  0.58298500  1
  Li  Li2  1  0.79812000  0.25000000  0.41701500  1
  Li  Li3  1  0.70188000  0.25000000  0.91701500  1
  Cu  Cu4  1  0.69711700  0.47053200  0.17488700  1
  Cu  Cu5  1  0.80288300  0.47053200  0.67488700  1
  Cu  Cu6  1  0.69711700  0.02946800  0.17488700  1
  Cu  Cu7  1  0.80288300  0.02946800  0.67488700  1
  Cu  Cu8  1  0.30288300  0.97053200  0.82511300  1
  Cu  Cu9  1  0.19711700  0.97053200  0.32511300  1
  Cu  Cu10  1  0.30288300  0.52946800  0.82511300  1
  Cu  Cu11  1  0.19711700  0.52946800  0.32511300  1
  P  P12  1  0.69467000  0.75000000  0.42134900  1
  P  P13  1  0.80533000  0.75000000  0.92134900  1
  P  P14  1  0.19467000  0.25000000  0.07865100  1
  P  P15  1  0.30533000  0.25000000  0.57865100  1
  O  O16  1  0.78155000  0.54465300  0.35050100  1
  O  O17  1  0.71845000  0.54465300  0.85050100  1
  O  O18  1  0.39745800  0.75000000  0.43153000  1
  O  O19  1  0.68453600  0.75000000  0.05078000  1
  O  O20  1  0.81546400  0.75000000  0.55078000  1
  O  O21  1  0.10254200  0.75000000  0.93153000  1
  O  O22  1  0.78155000  0.95534700  0.35050100  1
  O  O23  1  0.71845000  0.95534700  0.85050100  1
  O  O24  1  0.21845000  0.04465300  0.64949900  1
  O  O25  1  0.28155000  0.04465300  0.14949900  1
  O  O26  1  0.18453600  0.25000000  0.44922000  1
  O  O27  1  0.89745800  0.25000000  0.06847000  1
  O  O28  1  0.31546400  0.25000000  0.94922000  1
  O  O29  1  0.60254200  0.25000000  0.56847000  1
  O  O30  1  0.28155000  0.45534700  0.14949900  1
  O  O31  1  0.21845000  0.45534700  0.64949900  1
