# generated using pymatgen data_Th2Sc3Si7Pt9 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.03640153 _cell_length_b 10.03640299 _cell_length_c 4.05688403 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000169 _symmetry_Int_Tables_number 1 _chemical_formula_structural Th2Sc3Si7Pt9 _chemical_formula_sum 'Th2 Sc3 Si7 Pt9' _cell_volume 353.89900098 _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 Th Th0 1 0.00000000 0.00000000 0.00000000 1.0 Th Th1 1 0.33333300 0.66666700 0.50000000 1.0 Sc Sc2 1 0.89043342 0.44652528 0.50000000 1.0 Sc Sc3 1 0.55609187 0.10956658 0.50000000 1.0 Sc Sc4 1 0.55347472 0.44390813 0.50000000 1.0 Si Si5 1 0.25549331 0.20383693 0.50000000 1.0 Si Si6 1 0.79616307 0.05165937 0.50000000 1.0 Si Si7 1 0.94834063 0.74450669 0.50000000 1.0 Si Si8 1 0.56711679 0.65024808 0.00000000 1.0 Si Si9 1 0.34975192 0.91686771 0.00000000 1.0 Si Si10 1 0.08313229 0.43288321 0.00000000 1.0 Si Si11 1 0.66666700 0.33333300 0.00000000 1.0 Pt Pt12 1 0.21644750 0.93593731 0.50000000 1.0 Pt Pt13 1 0.06406269 0.28050919 0.50000000 1.0 Pt Pt14 1 0.71949081 0.78355250 0.50000000 1.0 Pt Pt15 1 0.31775811 0.41795465 0.00000000 1.0 Pt Pt16 1 0.58204535 0.89980346 0.00000000 1.0 Pt Pt17 1 0.10019654 0.68224189 0.00000000 1.0 Pt Pt18 1 0.38504359 0.17708691 0.00000000 1.0 Pt Pt19 1 0.82291309 0.20795768 0.00000000 1.0 Pt Pt20 1 0.79204232 0.61495641 0.00000000 1.0