# generated using pymatgen data_LiCu3F10 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.11394416 _cell_length_b 7.60390048 _cell_length_c 14.17961938 _cell_angle_alpha 73.55585494 _cell_angle_beta 97.62235198 _cell_angle_gamma 117.94151220 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiCu3F10 _chemical_formula_sum 'Li4 Cu12 F40' _cell_volume 741.25138904 _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 0.00824500 0.94716100 0.86337400 1.0 Li Li1 1 0.28655200 0.74591400 0.79001500 1.0 Li Li2 1 0.99175500 0.93891500 0.36337400 1.0 Li Li3 1 0.71344800 0.45936200 0.29001500 1.0 Cu Cu4 1 0.96733400 0.44400100 0.96910300 1.0 Cu Cu5 1 0.24007500 0.84848700 0.21116800 1.0 Cu Cu6 1 0.38719600 0.97048000 0.52118200 1.0 Cu Cu7 1 0.25114300 0.35780400 0.20130400 1.0 Cu Cu8 1 0.41421000 0.46401300 0.52497800 1.0 Cu Cu9 1 0.37110500 0.21025700 0.78397600 1.0 Cu Cu10 1 0.62889500 0.83915200 0.28397600 1.0 Cu Cu11 1 0.61280400 0.58328400 0.02118200 1.0 Cu Cu12 1 0.75992500 0.60841200 0.71116800 1.0 Cu Cu13 1 0.58579000 0.04980200 0.02497800 1.0 Cu Cu14 1 0.74885700 0.10666100 0.70130400 1.0 Cu Cu15 1 0.03266600 0.47666700 0.46910300 1.0 F F16 1 0.97138500 0.73033800 0.64721600 1.0 F F17 1 0.20325300 0.93837100 0.79991100 1.0 F F18 1 0.11788200 0.67503800 0.32477600 1.0 F F19 1 0.20781000 0.97213300 0.43332300 1.0 F F20 1 0.08716500 0.69389300 0.98743600 1.0 F F21 1 0.29497200 0.87311800 0.64858900 1.0 F F22 1 0.94446000 0.28107800 0.62141200 1.0 F F23 1 0.17817900 0.24058800 0.82657800 1.0 F F24 1 0.32940100 0.62754100 0.19232300 1.0 F F25 1 0.16785400 0.49602200 0.90391400 1.0 F F26 1 0.16686600 0.34268600 0.45784700 1.0 F F27 1 0.45807600 0.95057400 0.28261500 1.0 F F28 1 0.26710100 0.64281300 0.52424000 1.0 F F29 1 0.30800800 0.28122800 0.64882600 1.0 F F30 1 0.52131000 0.78181400 0.00319700 1.0 F F31 1 0.15766700 0.08073900 0.23488800 1.0 F F32 1 0.61205100 0.98810400 0.56692100 1.0 F F33 1 0.38794900 0.37605400 0.06692100 1.0 F F34 1 0.43536300 0.37315100 0.28887600 1.0 F F35 1 0.47204300 0.13241000 0.91033400 1.0 F F36 1 0.52795700 0.66036700 0.41033400 1.0 F F37 1 0.54192400 0.49249800 0.78261500 1.0 F F38 1 0.62723200 0.63723000 0.59495100 1.0 F F39 1 0.47869000 0.26050400 0.50319700 1.0 F F40 1 0.37276800 0.00999800 0.09495100 1.0 F F41 1 0.84233300 0.92307200 0.73488800 1.0 F F42 1 0.70502800 0.57814600 0.14858900 1.0 F F43 1 0.79219000 0.76432200 0.93332300 1.0 F F44 1 0.73289900 0.37571200 0.02424000 1.0 F F45 1 0.79674700 0.73511900 0.29991100 1.0 F F46 1 0.67059900 0.29813900 0.69232300 1.0 F F47 1 0.56463700 0.93778900 0.78887600 1.0 F F48 1 0.91283500 0.60672700 0.48743600 1.0 F F49 1 0.83214600 0.32816800 0.40391400 1.0 F F50 1 0.02861500 0.75895300 0.14721600 1.0 F F51 1 0.69199200 0.97322100 0.14882600 1.0 F F52 1 0.83313400 0.17582000 0.95784700 1.0 F F53 1 0.88211800 0.55715600 0.82477600 1.0 F F54 1 0.05554000 0.33661800 0.12141200 1.0 F F55 1 0.82182100 0.06240800 0.32657800 1.0