# generated using pymatgen
data_LiCu2PO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.58182200
_cell_length_b   6.25956001
_cell_length_c   10.20990802
_cell_angle_alpha   90.51582414
_cell_angle_beta   90.00151518
_cell_angle_gamma   92.98746977
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCu2PO4
_chemical_formula_sum   'Li4 Cu8 P4 O16'
_cell_volume   356.23233689
_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  0.85814500  0.00622400  0.74807300  1
  Li  Li1  1  0.66959200  0.24585600  0.50060100  1
  Li  Li2  1  0.68031100  0.24704800  0.99961900  1
  Li  Li3  1  0.31435900  0.24543400  0.24794400  1
  Cu  Cu4  1  0.74957900  0.98669800  0.23811700  1
  Cu  Cu5  1  0.33844600  0.29631100  0.74726000  1
  Cu  Cu6  1  0.25489800  0.51570700  0.97737900  1
  Cu  Cu7  1  0.25004400  0.50520600  0.48679400  1
  Cu  Cu8  1  0.36061800  0.69638300  0.72693600  1
  Cu  Cu9  1  0.35789100  0.75509200  0.23504000  1
  Cu  Cu10  1  0.63262700  0.72931600  0.48683100  1
  Cu  Cu11  1  0.64405100  0.74468600  0.00032100  1
  P  P12  1  0.16139800  0.01135300  0.00335000  1
  P  P13  1  0.15283900  0.01186700  0.50492100  1
  P  P14  1  0.83552800  0.48039600  0.25534900  1
  P  P15  1  0.81810900  0.50037800  0.75360200  1
  O  O16  1  0.17189200  0.01078200  0.65648800  1
  O  O17  1  0.88696100  0.01287400  0.46064300  1
  O  O18  1  0.15589000  0.99540000  0.15504400  1
  O  O19  1  0.90523100  0.01794100  0.94493000  1
  O  O20  1  0.30651500  0.20667300  0.44648500  1
  O  O21  1  0.32076500  0.21503700  0.96308200  1
  O  O22  1  0.67917100  0.28258500  0.20057700  1
  O  O23  1  0.68961500  0.29023000  0.69777900  1
  O  O24  1  0.82152800  0.49703400  0.90515800  1
  O  O25  1  0.07572300  0.50319000  0.69579300  1
  O  O26  1  0.82183700  0.48835800  0.40686800  1
  O  O27  1  0.09681800  0.47739000  0.20643300  1
  O  O28  1  0.70888700  0.71321500  0.70472000  1
  O  O29  1  0.71260600  0.68069800  0.19871500  1
  O  O30  1  0.27374700  0.81095000  0.44596900  1
  O  O31  1  0.29438200  0.81969100  0.94177300  1
