# CIF generated by HEAS from Alexandria entry agm005207413 data_agm005207413 _cell_length_a 3.87245 _cell_length_b 4.23270 _cell_length_c 5.90868 _cell_angle_alpha 90.00000 _cell_angle_beta 109.12875 _cell_angle_gamma 90.00000 _cell_volume 91.50123 _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 Nd1 Nd 0.13907 0.00000 0.27813 1.00000 Th1 Th 0.86835 0.50000 0.73669 1.00000 Ni1 Ni 0.58172 0.50000 0.16344 1.00000 Ir1 Ir 0.41087 0.00000 0.82173 1.00000