# generated using pymatgen
data_Li5Cu6(P2O7)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.26491700
_cell_length_b   8.37397089
_cell_length_c   10.23645903
_cell_angle_alpha   104.42959281
_cell_angle_beta   90.97826361
_cell_angle_gamma   92.77743154
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li5Cu6(P2O7)4
_chemical_formula_sum   'Li5 Cu6 P8 O28'
_cell_volume   519.23990341
_cell_formula_units_Z   1
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  0.01427100  0.15969900  0.61004000  1
  Li  Li1  1  0.09974300  0.61155800  0.12638600  1
  Li  Li2  1  0.50000000  0.50000000  0.50000000  1
  Li  Li3  1  0.90025700  0.38844200  0.87361400  1
  Li  Li4  1  0.98572900  0.84030100  0.38996000  1
  Cu  Cu5  1  0.00000000  0.50000000  0.50000000  1
  Cu  Cu6  1  0.30776400  0.88792300  0.64847400  1
  Cu  Cu7  1  0.35354800  0.88338800  0.05627700  1
  Cu  Cu8  1  0.50000000  0.50000000  0.00000000  1
  Cu  Cu9  1  0.64645200  0.11661200  0.94372300  1
  Cu  Cu10  1  0.69223600  0.11207700  0.35152600  1
  P  P11  1  0.15507400  0.20937000  0.02151200  1
  P  P12  1  0.18688500  0.18539000  0.31368200  1
  P  P13  1  0.26641700  0.53119400  0.73759800  1
  P  P14  1  0.46912900  0.76218100  0.31844300  1
  P  P15  1  0.53087100  0.23781900  0.68155700  1
  P  P16  1  0.73358300  0.46880600  0.26240200  1
  P  P17  1  0.81311500  0.81461000  0.68631800  1
  P  P18  1  0.84492600  0.79063000  0.97848800  1
  O  O19  1  0.04432200  0.83673200  0.07001300  1
  O  O20  1  0.01456900  0.08349600  0.36778900  1
  O  O21  1  0.06671800  0.41873700  0.72616800  1
  O  O22  1  0.08383100  0.20419700  0.17078700  1
  O  O23  1  0.22418200  0.38924900  0.02469200  1
  O  O24  1  0.22426000  0.35907400  0.40842700  1
  O  O25  1  0.24998400  0.64497900  0.63799100  1
  O  O26  1  0.29297100  0.80655300  0.41723700  1
  O  O27  1  0.34532100  0.62192100  0.87984100  1
  O  O28  1  0.32569400  0.12642400  0.65314900  1
  O  O29  1  0.33169900  0.08428500  0.97840200  1
  O  O30  1  0.39001700  0.72189700  0.16874500  1
  O  O31  1  0.39450100  0.09821500  0.27789100  1
  O  O32  1  0.45923600  0.41795900  0.66648800  1
  O  O33  1  0.54076400  0.58204100  0.33351200  1
  O  O34  1  0.60549900  0.90178500  0.72210900  1
  O  O35  1  0.60998300  0.27810300  0.83125500  1
  O  O36  1  0.66830100  0.91571500  0.02159800  1
  O  O37  1  0.67430600  0.87357600  0.34685100  1
  O  O38  1  0.65467900  0.37807900  0.12015900  1
  O  O39  1  0.70702900  0.19344700  0.58276300  1
  O  O40  1  0.75001600  0.35502100  0.36200900  1
  O  O41  1  0.77574000  0.64092600  0.59157300  1
  O  O42  1  0.77581800  0.61075100  0.97530800  1
  O  O43  1  0.91616900  0.79580300  0.82921300  1
  O  O44  1  0.93328200  0.58126300  0.27383200  1
  O  O45  1  0.98543100  0.91650400  0.63221100  1
  O  O46  1  0.95567800  0.16326800  0.92998700  1
