# generated using pymatgen
data_LiCuPO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.87591500
_cell_length_b   7.37079600
_cell_length_c   14.07005500
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCuPO4
_chemical_formula_sum   'Li8 Cu8 P8 O32'
_cell_volume   609.37648491
_cell_formula_units_Z   8
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  0.15709700  0.19671100  0.21721800  1
  Li  Li1  1  0.65709700  0.19671100  0.28278200  1
  Li  Li2  1  0.65709700  0.30328900  0.78278200  1
  Li  Li3  1  0.15709700  0.30328900  0.71721800  1
  Li  Li4  1  0.34290300  0.69671100  0.21721800  1
  Li  Li5  1  0.84290300  0.69671100  0.28278200  1
  Li  Li6  1  0.34290300  0.80328900  0.71721800  1
  Li  Li7  1  0.84290300  0.80328900  0.78278200  1
  Cu  Cu8  1  0.37872900  0.18058400  0.53105500  1
  Cu  Cu9  1  0.87872900  0.18058400  0.96894500  1
  Cu  Cu10  1  0.37872900  0.31941600  0.03105500  1
  Cu  Cu11  1  0.87872900  0.31941600  0.46894500  1
  Cu  Cu12  1  0.12127100  0.68058400  0.53105500  1
  Cu  Cu13  1  0.62127100  0.68058400  0.96894500  1
  Cu  Cu14  1  0.12127100  0.81941600  0.03105500  1
  Cu  Cu15  1  0.62127100  0.81941600  0.46894500  1
  P  P16  1  0.90472300  0.03203700  0.62550100  1
  P  P17  1  0.40472300  0.03203700  0.87449900  1
  P  P18  1  0.90472300  0.46796300  0.12550100  1
  P  P19  1  0.40472300  0.46796300  0.37449900  1
  P  P20  1  0.59527700  0.53203700  0.62550100  1
  P  P21  1  0.09527700  0.53203700  0.87449900  1
  P  P22  1  0.59527700  0.96796300  0.12550100  1
  P  P23  1  0.09527700  0.96796300  0.37449900  1
  O  O24  1  0.81288600  0.99103400  0.06194200  1
  O  O25  1  0.31288600  0.99103400  0.43805800  1
  O  O26  1  0.34473300  0.09142200  0.77425200  1
  O  O27  1  0.84473300  0.09142200  0.72574800  1
  O  O28  1  0.45769500  0.14794000  0.13170300  1
  O  O29  1  0.95769500  0.14794000  0.36829700  1
  O  O30  1  0.05776300  0.18578600  0.57873600  1
  O  O31  1  0.55776300  0.18578600  0.92126400  1
  O  O32  1  0.05776300  0.31421400  0.07873600  1
  O  O33  1  0.55776300  0.31421400  0.42126400  1
  O  O34  1  0.45769500  0.35206000  0.63170300  1
  O  O35  1  0.95769500  0.35206000  0.86829700  1
  O  O36  1  0.84473300  0.40857800  0.22574800  1
  O  O37  1  0.34473300  0.40857800  0.27425200  1
  O  O38  1  0.81288600  0.50896600  0.56194200  1
  O  O39  1  0.31288600  0.50896600  0.93805800  1
  O  O40  1  0.18711400  0.49103400  0.43805800  1
  O  O41  1  0.68711400  0.49103400  0.06194200  1
  O  O42  1  0.65526700  0.59142200  0.72574800  1
  O  O43  1  0.15526700  0.59142200  0.77425200  1
  O  O44  1  0.04230500  0.64794000  0.13170300  1
  O  O45  1  0.54230500  0.64794000  0.36829700  1
  O  O46  1  0.44223700  0.68578600  0.57873600  1
  O  O47  1  0.94223700  0.68578600  0.92126400  1
  O  O48  1  0.44223700  0.81421400  0.07873600  1
  O  O49  1  0.94223700  0.81421400  0.42126400  1
  O  O50  1  0.04230500  0.85206000  0.63170300  1
  O  O51  1  0.54230500  0.85206000  0.86829700  1
  O  O52  1  0.65526700  0.90857800  0.22574800  1
  O  O53  1  0.15526700  0.90857800  0.27425200  1
  O  O54  1  0.68711400  0.00896600  0.56194200  1
  O  O55  1  0.18711400  0.00896600  0.93805800  1
