# CIF generated by HEAS from Alexandria entry agm044457767 data_agm044457767 _cell_length_a 9.79357 _cell_length_b 9.79357 _cell_length_c 9.03229 _cell_angle_alpha 72.40810 _cell_angle_beta 107.59190 _cell_angle_gamma 156.10695 _cell_volume 333.72426 _symmetry_space_group_name_H-M 'P 1' _symmetry_Int_Tables_number 1 loop_ _symmetry_equiv_pos_as_xyz 'x, y, z' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Th1 Th 0.33528 0.66472 0.87470 1.00000 Th2 Th 0.67986 0.32014 0.54413 1.00000 Th3 Th 0.66472 0.33528 0.12530 1.00000 Th4 Th 0.01645 0.98355 0.23705 1.00000 Th5 Th 0.98355 0.01645 0.76295 1.00000 Th6 Th 0.32014 0.67986 0.45587 1.00000 Fe1 Fe 0.83374 0.16626 0.67163 1.00000 Fe2 Fe 0.16626 0.83374 0.32837 1.00000 Te1 Te 0.50000 0.50000 0.50000 1.00000 Te2 Te 0.83984 0.16016 0.16699 1.00000 Te3 Te 0.16016 0.83984 0.83301 1.00000 S1 S 0.50000 0.50000 0.00000 1.00000