# CIF generated by HEAS from Alexandria entry agm045864041 data_agm045864041 _cell_length_a 8.01703 _cell_length_b 3.89749 _cell_length_c 8.26952 _cell_angle_alpha 90.00000 _cell_angle_beta 107.78901 _cell_angle_gamma 90.00000 _cell_volume 246.03761 _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 0.66681 0.25000 0.41323 1.00000 Th2 Th 0.01976 0.25000 0.23745 1.00000 Th3 Th 0.33319 0.75000 0.58677 1.00000 Th4 Th 0.98024 0.75000 0.76255 1.00000 Mg1 Mg 0.65562 0.75000 0.06860 1.00000 Mg2 Mg 0.34438 0.25000 0.93140 1.00000 Fe1 Fe 0.89284 0.75000 0.38370 1.00000 Fe2 Fe 0.10716 0.25000 0.61630 1.00000 Hg1 Hg 0.32447 0.75000 0.17943 1.00000 Hg2 Hg 0.67553 0.25000 0.82057 1.00000