# generated using pymatgen data_U6Cu2S13 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.02987602 _cell_length_b 8.02987602 _cell_length_c 14.23101230 _cell_angle_alpha 81.25045869 _cell_angle_beta 81.25045869 _cell_angle_gamma 100.22698880 _symmetry_Int_Tables_number 1 _chemical_formula_structural U6Cu2S13 _chemical_formula_sum 'U12 Cu4 S26' _cell_volume 877.24768813 _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 U U0 1 0.17679100 0.16466500 0.64240700 1.0 U U1 1 0.83533500 0.82320900 0.85759300 1.0 U U2 1 0.82320900 0.83533500 0.35759300 1.0 U U3 1 0.16466500 0.17679100 0.14240700 1.0 U U4 1 0.50949900 0.84312400 0.64349300 1.0 U U5 1 0.15687600 0.49050100 0.85650700 1.0 U U6 1 0.49050100 0.15687600 0.35650700 1.0 U U7 1 0.84312400 0.50949900 0.14349300 1.0 U U8 1 0.33227300 0.98566300 0.88980900 1.0 U U9 1 0.01433700 0.66772700 0.61019100 1.0 U U10 1 0.66772700 0.01433700 0.11019100 1.0 U U11 1 0.98566300 0.33227300 0.38980900 1.0 Cu Cu12 1 0.61379200 0.32702200 0.87076300 1.0 Cu Cu13 1 0.67297800 0.38620800 0.62923700 1.0 Cu Cu14 1 0.38620800 0.67297800 0.12923700 1.0 Cu Cu15 1 0.32702200 0.61379200 0.37076300 1.0 S S16 1 0.17213600 0.82786400 0.75000000 1.0 S S17 1 0.82786400 0.17213600 0.25000000 1.0 S S18 1 0.28948200 0.93843400 0.52580900 1.0 S S19 1 0.06156600 0.71051800 0.97419100 1.0 S S20 1 0.71051800 0.06156600 0.47419100 1.0 S S21 1 0.93843400 0.28948200 0.02580900 1.0 S S22 1 0.67019700 0.06605200 0.91423800 1.0 S S23 1 0.93394800 0.32980300 0.58576200 1.0 S S24 1 0.32980300 0.93394800 0.08576200 1.0 S S25 1 0.06605200 0.67019700 0.41423800 1.0 S S26 1 0.48618600 0.15362500 0.70293100 1.0 S S27 1 0.84637500 0.51381400 0.79706900 1.0 S S28 1 0.51381400 0.84637500 0.29706900 1.0 S S29 1 0.15362500 0.48618600 0.20293100 1.0 S S30 1 0.48868800 0.72202000 0.83490900 1.0 S S31 1 0.27798000 0.51131200 0.66509100 1.0 S S32 1 0.31162300 0.35198100 0.45297900 1.0 S S33 1 0.64801900 0.68837700 0.04702100 1.0 S S34 1 0.68837700 0.64801900 0.54702100 1.0 S S35 1 0.35198100 0.31162300 0.95297900 1.0 S S36 1 0.93111900 0.85656100 0.16734000 1.0 S S37 1 0.14343900 0.06888100 0.33266000 1.0 S S38 1 0.06888100 0.14343900 0.83266000 1.0 S S39 1 0.85656100 0.93111900 0.66734000 1.0 S S40 1 0.72202000 0.48868800 0.33490900 1.0 S S41 1 0.51131200 0.27798000 0.16509100 1.0