# generated using pymatgen
data_LiCuPO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.85905800
_cell_length_b   7.49402600
_cell_length_c   17.87545269
_cell_angle_alpha   87.75806740
_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   650.41683141
_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  0.77021400  0.00163000  0.58793700  1
  Li  Li1  1  0.72978600  0.00163000  0.08793700  1
  Li  Li2  1  0.34410800  0.49825000  0.82256800  1
  Li  Li3  1  0.15589200  0.49825000  0.32256800  1
  Li  Li4  1  0.84410800  0.50175000  0.67743200  1
  Li  Li5  1  0.65589200  0.50175000  0.17743200  1
  Li  Li6  1  0.27021400  0.99837000  0.91206300  1
  Li  Li7  1  0.22978600  0.99837000  0.41206300  1
  Cu  Cu8  1  0.77511800  0.17613700  0.77427600  1
  Cu  Cu9  1  0.72488200  0.17613700  0.27427600  1
  Cu  Cu10  1  0.25134800  0.36621000  0.51343100  1
  Cu  Cu11  1  0.24865200  0.36621000  0.01343100  1
  Cu  Cu12  1  0.75134800  0.63379000  0.98656900  1
  Cu  Cu13  1  0.74865200  0.63379000  0.48656900  1
  Cu  Cu14  1  0.27511800  0.82386300  0.72572400  1
  Cu  Cu15  1  0.22488200  0.82386300  0.22572400  1
  P  P16  1  0.33409400  0.23589600  0.68108500  1
  P  P17  1  0.16590600  0.23589600  0.18108500  1
  P  P18  1  0.71579400  0.25199500  0.93696500  1
  P  P19  1  0.78420600  0.25199500  0.43696500  1
  P  P20  1  0.21579400  0.74800500  0.56303500  1
  P  P21  1  0.28420600  0.74800500  0.06303500  1
  P  P22  1  0.83409400  0.76410400  0.81891500  1
  P  P23  1  0.66590600  0.76410400  0.31891500  1
  O  O24  1  0.45379600  0.05340200  0.71216200  1
  O  O25  1  0.04620400  0.05340200  0.21216200  1
  O  O26  1  0.60978200  0.17205200  0.01053700  1
  O  O27  1  0.59467400  0.14968700  0.87052600  1
  O  O28  1  0.42047700  0.24355700  0.59796300  1
  O  O29  1  0.02074500  0.25714700  0.69161700  1
  O  O30  1  0.89021800  0.17205200  0.51053700  1
  O  O31  1  0.90532600  0.14968700  0.37052600  1
  O  O32  1  0.07952300  0.24355700  0.09796300  1
  O  O33  1  0.47925500  0.25714700  0.19161700  1
  O  O34  1  0.03632800  0.25776800  0.93146400  1
  O  O35  1  0.46367200  0.25776800  0.43146400  1
  O  O36  1  0.49334400  0.37699900  0.72756300  1
  O  O37  1  0.00665600  0.37699900  0.22756300  1
  O  O38  1  0.58504500  0.44765000  0.92708600  1
  O  O39  1  0.91495500  0.44765000  0.42708600  1
  O  O40  1  0.08504500  0.55235000  0.57291400  1
  O  O41  1  0.41495500  0.55235000  0.07291400  1
  O  O42  1  0.99334400  0.62300100  0.77243700  1
  O  O43  1  0.50665600  0.62300100  0.27243700  1
  O  O44  1  0.53632800  0.74223200  0.56853600  1
  O  O45  1  0.96367200  0.74223200  0.06853600  1
  O  O46  1  0.52074500  0.74285300  0.80838300  1
  O  O47  1  0.92047700  0.75644300  0.90203700  1
  O  O48  1  0.09467400  0.85031300  0.62947400  1
  O  O49  1  0.10978200  0.82794800  0.48946300  1
  O  O50  1  0.97925500  0.74285300  0.30838300  1
  O  O51  1  0.57952300  0.75644300  0.40203700  1
  O  O52  1  0.40532600  0.85031300  0.12947400  1
  O  O53  1  0.39021800  0.82794800  0.98946300  1
  O  O54  1  0.95379600  0.94659800  0.78783800  1
  O  O55  1  0.54620400  0.94659800  0.28783800  1
