# generated using pymatgen data_Cu19Se11 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.97500800 _cell_length_b 4.11183651 _cell_length_c 36.10754169 _cell_angle_alpha 90.89038246 _cell_angle_beta 92.55180595 _cell_angle_gamma 117.59654791 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cu19Se11 _chemical_formula_sum 'Cu19 Se11' _cell_volume 522.06605892 _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 Cu Cu0 1 0.05196900 0.11324000 0.08308600 1.0 Cu Cu1 1 0.75063200 0.49180200 0.15816000 1.0 Cu Cu2 1 0.88764000 0.76495600 0.22353300 1.0 Cu Cu3 1 0.54567100 0.09299800 0.25274800 1.0 Cu Cu4 1 0.23775800 0.44679700 0.34106300 1.0 Cu Cu5 1 0.23806700 0.59126200 0.40891200 1.0 Cu Cu6 1 0.92217700 0.95532300 0.43203100 1.0 Cu Cu7 1 0.67085000 0.37783100 0.52157900 1.0 Cu Cu8 1 0.76259100 0.52902300 0.64845700 1.0 Cu Cu9 1 0.49569900 0.97064900 0.73750200 1.0 Cu Cu10 1 0.39742500 0.80195800 0.60181600 1.0 Cu Cu11 1 0.20450700 0.46894200 0.83646700 1.0 Cu Cu12 1 0.13303700 0.25045100 0.69115700 1.0 Cu Cu13 1 0.93249300 0.94555800 0.94186100 1.0 Cu Cu14 1 0.84885100 0.73710600 0.78892800 1.0 Cu Cu15 1 0.87914700 0.84559100 0.86356300 1.0 Cu Cu16 1 0.55968900 0.21292200 0.88955000 1.0 Cu Cu17 1 0.61919700 0.31274500 0.96985300 1.0 Cu Cu18 1 0.30570500 0.67893200 0.99071700 1.0 Se Se19 1 0.98661500 0.04711300 0.01246700 1.0 Se Se20 1 0.72670500 0.46706500 0.09293300 1.0 Se Se21 1 0.43639300 0.88271000 0.18361900 1.0 Se Se22 1 0.20687900 0.42168700 0.27426200 1.0 Se Se23 1 0.91402700 0.81755200 0.36263000 1.0 Se Se24 1 0.60512800 0.31552400 0.45266700 1.0 Se Se25 1 0.34708500 0.73556500 0.53660600 1.0 Se Se26 1 0.07912700 0.16997800 0.62439100 1.0 Se Se27 1 0.81548500 0.61430500 0.71858300 1.0 Se Se28 1 0.53003300 0.09534200 0.80628700 1.0 Se Se29 1 0.24141500 0.57707800 0.90857600 1.0