# generated using pymatgen data_PrTh7(FeSi3)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.16591176 _cell_length_b 8.16591122 _cell_length_c 8.34546530 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000218 _symmetry_Int_Tables_number 1 _chemical_formula_structural PrTh7(FeSi3)4 _chemical_formula_sum 'Pr1 Th7 Fe4 Si12' _cell_volume 481.93727097 _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 Pr Pr0 1 0.00000000 0.00000000 0.25000000 1.0 Th Th1 1 0.50002792 0.49997208 0.75000000 1.0 Th Th2 1 0.50001068 0.49998932 0.25000000 1.0 Th Th3 1 0.99994416 0.49997208 0.75000000 1.0 Th Th4 1 0.99997864 0.49998932 0.25000000 1.0 Th Th5 1 0.50002792 0.00005584 0.75000000 1.0 Th Th6 1 0.50001068 0.00002136 0.25000000 1.0 Th Th7 1 0.00000000 0.00000000 0.75000000 1.0 Fe Fe8 1 0.66666700 0.33333300 0.01690724 1.0 Fe Fe9 1 0.33333300 0.66666700 0.01643080 1.0 Fe Fe10 1 0.33333300 0.66666700 0.48356920 1.0 Fe Fe11 1 0.66666700 0.33333300 0.48309276 1.0 Si Si12 1 0.82997094 0.17002906 0.99686116 1.0 Si Si13 1 0.17001665 0.82998335 0.99686281 1.0 Si Si14 1 0.34005813 0.17002906 0.99686116 1.0 Si Si15 1 0.17001665 0.82998335 0.50313719 1.0 Si Si16 1 0.65996571 0.82998335 0.99686281 1.0 Si Si17 1 0.82997094 0.17002906 0.50313884 1.0 Si Si18 1 0.82997094 0.65994187 0.99686116 1.0 Si Si19 1 0.65996571 0.82998335 0.50313719 1.0 Si Si20 1 0.17001665 0.34003429 0.99686281 1.0 Si Si21 1 0.34005813 0.17002906 0.50313884 1.0 Si Si22 1 0.17001665 0.34003429 0.50313719 1.0 Si Si23 1 0.82997094 0.65994187 0.50313884 1.0