# generated using pymatgen
data_LiCuPO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.21071200
_cell_length_b   6.24903531
_cell_length_c   10.50617187
_cell_angle_alpha   89.82522210
_cell_angle_beta   89.40374331
_cell_angle_gamma   89.84350775
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCuPO4
_chemical_formula_sum   'Li4 Cu4 P4 O16'
_cell_volume   342.07979988
_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  0.80519000  0.02454600  0.33033500  1
  Li  Li1  1  0.33316300  0.48128400  0.16781900  1
  Li  Li2  1  0.17693900  0.01257500  0.65709000  1
  Li  Li3  1  0.80578300  0.47815900  0.33487200  1
  Cu  Cu4  1  0.27504600  0.74817600  0.91883300  1
  Cu  Cu5  1  0.71313100  0.00492000  0.83614600  1
  Cu  Cu6  1  0.68902700  0.47948400  0.82447300  1
  Cu  Cu7  1  0.20484800  0.75125500  0.41246900  1
  P  P8  1  0.31635200  0.24966300  0.42292500  1
  P  P9  1  0.81125000  0.75089900  0.09535600  1
  P  P10  1  0.19348100  0.25295300  0.92400200  1
  P  P11  1  0.68347700  0.75143700  0.58335500  1
  O  O12  1  0.75999700  0.54317400  0.65422100  1
  O  O13  1  0.11232500  0.72952100  0.08165300  1
  O  O14  1  0.19858100  0.45402600  0.35007400  1
  O  O15  1  0.23632400  0.25483000  0.56146300  1
  O  O16  1  0.38733700  0.77568800  0.57865300  1
  O  O17  1  0.89194700  0.25457100  0.90389600  1
  O  O18  1  0.80077400  0.94063900  0.66158400  1
  O  O19  1  0.29965500  0.45793200  0.84946200  1
  O  O20  1  0.19137400  0.04492900  0.35789400  1
  O  O21  1  0.27239200  0.25030600  0.05955900  1
  O  O22  1  0.69929800  0.55255600  0.15997100  1
  O  O23  1  0.29128600  0.04908600  0.84668300  1
  O  O24  1  0.79734900  0.74915500  0.44595600  1
  O  O25  1  0.71001800  0.75183400  0.94739000  1
  O  O26  1  0.73871600  0.95895700  0.15842400  1
  O  O27  1  0.60580000  0.24962400  0.39761300  1
