# generated using pymatgen
data_Li2Cu(PO3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.90803620
_cell_length_b   7.90803620
_cell_length_c   8.26614046
_cell_angle_alpha   84.36345391
_cell_angle_beta   84.36345391
_cell_angle_gamma   102.79481634
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Cu(PO3)4
_chemical_formula_sum   'Li4 Cu2 P8 O24'
_cell_volume   497.81857012
_cell_formula_units_Z   2
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  0.45126900  0.82163000  0.94865600  1
  Li  Li1  1  0.82163000  0.45126900  0.44865600  1
  Li  Li2  1  0.16524700  0.52266000  0.54270200  1
  Li  Li3  1  0.52266000  0.16524700  0.04270200  1
  Cu  Cu4  1  0.81665000  0.10530500  0.74652400  1
  Cu  Cu5  1  0.10530500  0.81665000  0.24652400  1
  P  P6  1  0.92592400  0.75877500  0.68847600  1
  P  P7  1  0.75877500  0.92592400  0.18847600  1
  P  P8  1  0.81785600  0.44416500  0.92168100  1
  P  P9  1  0.44416500  0.81785600  0.42168100  1
  P  P10  1  0.49270200  0.14776800  0.58246900  1
  P  P11  1  0.14776800  0.49270200  0.08246900  1
  P  P12  1  0.17669700  0.02966000  0.81954400  1
  P  P13  1  0.02966000  0.17669700  0.31954400  1
  O  O14  1  0.83180600  0.89826400  0.64153500  1
  O  O15  1  0.96727800  0.64526000  0.56071200  1
  O  O16  1  0.89826400  0.83180600  0.14153500  1
  O  O17  1  0.64526000  0.96727800  0.06071200  1
  O  O18  1  0.81224500  0.64097100  0.85008600  1
  O  O19  1  0.64097100  0.81224500  0.35008600  1
  O  O20  1  0.28653600  0.00102000  0.95399100  1
  O  O21  1  0.78993000  0.33684300  0.78050800  1
  O  O22  1  0.00102000  0.28653600  0.45399100  1
  O  O23  1  0.38592600  0.69495400  0.57588800  1
  O  O24  1  0.33684300  0.78993000  0.28050800  1
  O  O25  1  0.69495400  0.38592600  0.07588800  1
  O  O26  1  0.10746000  0.84274400  0.75509400  1
  O  O27  1  0.32667900  0.57656500  0.00035600  1
  O  O28  1  0.84274400  0.10746000  0.25509400  1
  O  O29  1  0.57656500  0.32667900  0.50035600  1
  O  O30  1  0.56983700  0.05652900  0.71793500  1
  O  O31  1  0.02177300  0.46476200  0.94119300  1
  O  O32  1  0.05652900  0.56983700  0.21793500  1
  O  O33  1  0.46476200  0.02177300  0.44119300  1
  O  O34  1  0.29519400  0.14519800  0.65859000  1
  O  O35  1  0.14519800  0.29519400  0.15859000  1
  O  O36  1  0.02780600  0.11677700  0.85344600  1
  O  O37  1  0.11677700  0.02780600  0.35344600  1
