# generated using pymatgen data_Th2Zn3Cd2Cu7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.07952440 _cell_length_b 8.35723212 _cell_length_c 10.66346820 _cell_angle_alpha 90.05907114 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Th2Zn3Cd2Cu7 _chemical_formula_sum 'Th4 Zn6 Cd4 Cu14' _cell_volume 452.67213626 _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 Th Th0 1 0.74836109 0.24018466 0.93900940 1.0 Th Th1 1 0.24836109 0.75981534 0.06099060 1.0 Th Th2 1 0.74978517 0.74641617 0.55659778 1.0 Th Th3 1 0.24978517 0.25358383 0.44340222 1.0 Zn Zn4 1 0.99879581 0.43414984 0.18647127 1.0 Zn Zn5 1 0.49879581 0.56585016 0.81352873 1.0 Zn Zn6 1 0.50334825 0.93498538 0.31349469 1.0 Zn Zn7 1 0.00334825 0.06501462 0.68650531 1.0 Zn Zn8 1 0.99979105 0.56639639 0.81333479 1.0 Zn Zn9 1 0.49979105 0.43360361 0.18666521 1.0 Cd Cd10 1 0.74603768 0.36202098 0.63547964 1.0 Cd Cd11 1 0.24603768 0.63797902 0.36452036 1.0 Cd Cd12 1 0.74655204 0.86350672 0.86446949 1.0 Cd Cd13 1 0.24655204 0.13649328 0.13553051 1.0 Cu Cu14 1 0.50384520 0.06518955 0.68667923 1.0 Cu Cu15 1 0.00384520 0.93481045 0.31332077 1.0 Cu Cu16 1 0.74887274 0.44056017 0.39194538 1.0 Cu Cu17 1 0.24887274 0.55943983 0.60805462 1.0 Cu Cu18 1 0.75323659 0.94078675 0.10940508 1.0 Cu Cu19 1 0.25323659 0.05921325 0.89059492 1.0 Cu Cu20 1 0.75242065 0.18418880 0.25482472 1.0 Cu Cu21 1 0.25242065 0.81581120 0.74517528 1.0 Cu Cu22 1 0.74959602 0.68559970 0.24641133 1.0 Cu Cu23 1 0.24959602 0.31440030 0.75358867 1.0 Cu Cu24 1 0.74996918 0.08630635 0.48381550 1.0 Cu Cu25 1 0.24996918 0.91369365 0.51618450 1.0 Cu Cu26 1 0.74938855 0.58531343 0.01709856 1.0 Cu Cu27 1 0.24938855 0.41468657 0.98290144 1.0