# generated using pymatgen data_Th10In3Sb3Se2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.50170785 _cell_length_b 9.50170680 _cell_length_c 6.67593706 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999320 _symmetry_Int_Tables_number 1 _chemical_formula_structural Th10In3Sb3Se2 _chemical_formula_sum 'Th10 In3 Sb3 Se2' _cell_volume 521.97078155 _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 0.66666700 0.33333300 0.99852773 1.0 Th Th1 1 0.33333300 0.66666700 0.99852773 1.0 Th Th2 1 0.33333300 0.66666700 0.50147227 1.0 Th Th3 1 0.66666700 0.33333300 0.50147227 1.0 Th Th4 1 0.73395975 0.73395975 0.75000000 1.0 Th Th5 1 0.26604025 1.00000000 0.75000000 1.0 Th Th6 1 1.00000000 0.26604025 0.75000000 1.0 Th Th7 1 0.26557332 0.26557332 0.25000000 1.0 Th Th8 1 0.73442668 0.00000000 0.25000000 1.0 Th Th9 1 0.00000000 0.73442668 0.25000000 1.0 In In10 1 0.38591090 0.38591090 0.75000000 1.0 In In11 1 0.61408910 0.00000000 0.75000000 1.0 In In12 1 0.00000000 0.61408910 0.75000000 1.0 Sb Sb13 1 0.61114631 0.61114631 0.25000000 1.0 Sb Sb14 1 0.38885369 0.00000000 0.25000000 1.0 Sb Sb15 1 0.00000000 0.38885369 0.25000000 1.0 Se Se16 1 0.00000000 0.00000000 0.00110958 1.0 Se Se17 1 0.00000000 0.00000000 0.49889042 1.0