# CIF generated by HEAS from Alexandria entry agm004952084 data_agm004952084 _cell_length_a 5.42747 _cell_length_b 5.42756 _cell_length_c 5.71293 _cell_angle_alpha 61.63802 _cell_angle_beta 61.63728 _cell_angle_gamma 59.99888 _cell_volume 121.85950 _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 0.29908 0.29908 0.10275 1.00000 Sc1 Sc 0.81001 0.81001 0.56998 1.00000 Fe1 Fe 0.51592 0.51592 0.45224 1.00000 Fe2 Fe 0.01725 0.01726 0.94824 1.00000 O1 O 0.66114 0.23314 0.24800 1.00000 O2 O 0.23315 0.85771 0.24800 1.00000 O3 O 0.85771 0.66116 0.24799 1.00000 O4 O 0.40827 0.73084 0.73267 1.00000 O5 O 0.73086 0.12822 0.73266 1.00000 O6 O 0.12821 0.40827 0.73268 1.00000