# CIF generated by HEAS from Alexandria entry agm002006045 data_agm002006045 _cell_length_a 3.71376 _cell_length_b 3.71376 _cell_length_c 9.61729 _cell_angle_alpha 78.86758 _cell_angle_beta 78.86758 _cell_angle_gamma 60.00000 _cell_volume 111.97969 _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 Nb1 Nb 0.00000 0.00000 0.00000 1.00000 Ir1 Ir 0.50000 0.50000 0.50000 1.00000 Th1 Th 0.10015 0.10015 0.69956 1.00000 Th2 Th 0.89985 0.89985 0.30044 1.00000