# CIF generated by HEAS from Alexandria entry agm005708263 data_agm005708263 _cell_length_a 3.97181 _cell_length_b 3.97181 _cell_length_c 7.38582 _cell_angle_alpha 89.99991 _cell_angle_beta 90.00000 _cell_angle_gamma 59.99996 _cell_volume 100.90340 _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 0.66667 0.66667 0.20676 1.00000 Th2 Th 0.33333 0.33333 0.79324 1.00000 Fe1 Fe 0.00000 0.00000 0.00000 1.00000 Se1 Se 0.00000 0.00000 0.50000 1.00000