# generated using pymatgen data_Li2Cu2F5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.03509200 _cell_length_b 10.79824000 _cell_length_c 12.20815100 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li2Cu2F5 _chemical_formula_sum 'Li8 Cu8 F20' _cell_volume 400.10569046 _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 0.22134700 0.53506600 0.65791600 1.0 Li Li1 1 0.21890500 0.71604900 0.00967300 1.0 Li Li2 1 0.71890500 0.78395100 0.50967300 1.0 Li Li3 1 0.72134700 0.96493400 0.15791600 1.0 Li Li4 1 0.27865300 0.03506600 0.65791600 1.0 Li Li5 1 0.28109500 0.21604900 0.00967300 1.0 Li Li6 1 0.78109500 0.28395100 0.50967300 1.0 Li Li7 1 0.77865300 0.46493400 0.15791600 1.0 Cu Cu8 1 0.29637900 0.50373500 0.39498400 1.0 Cu Cu9 1 0.18571400 0.74423700 0.27298500 1.0 Cu Cu10 1 0.68571400 0.75576300 0.77298500 1.0 Cu Cu11 1 0.79637900 0.99626500 0.89498400 1.0 Cu Cu12 1 0.20362100 0.00373500 0.39498400 1.0 Cu Cu13 1 0.31428600 0.24423700 0.27298500 1.0 Cu Cu14 1 0.81428600 0.25576300 0.77298500 1.0 Cu Cu15 1 0.70362100 0.49626500 0.89498400 1.0 F F16 1 0.28469000 0.56235400 0.23857500 1.0 F F17 1 0.73916400 0.58262200 0.03423900 1.0 F F18 1 0.23493700 0.62560200 0.83404500 1.0 F F19 1 0.71339800 0.66804300 0.63419400 1.0 F F20 1 0.20591100 0.68641800 0.42979900 1.0 F F21 1 0.70591100 0.81358200 0.92979900 1.0 F F22 1 0.21339800 0.83195700 0.13419400 1.0 F F23 1 0.73493700 0.87439800 0.33404500 1.0 F F24 1 0.23916400 0.91737800 0.53423900 1.0 F F25 1 0.78469000 0.93764600 0.73857500 1.0 F F26 1 0.21531000 0.06235400 0.23857500 1.0 F F27 1 0.76083600 0.08262200 0.03423900 1.0 F F28 1 0.26506300 0.12560200 0.83404500 1.0 F F29 1 0.78660200 0.16804300 0.63419400 1.0 F F30 1 0.29408900 0.18641800 0.42979900 1.0 F F31 1 0.79408900 0.31358200 0.92979900 1.0 F F32 1 0.28660200 0.33195700 0.13419400 1.0 F F33 1 0.76506300 0.37439800 0.33404500 1.0 F F34 1 0.26083600 0.41737800 0.53423900 1.0 F F35 1 0.71531000 0.43764600 0.73857500 1.0