# CIF generated by HEAS from Alexandria entry agm005607673 data_agm005607673 _cell_length_a 11.39303 _cell_length_b 10.65938 _cell_length_c 10.65938 _cell_angle_alpha 100.54420 _cell_angle_beta 108.72777 _cell_angle_gamma 108.72776 _cell_volume 1100.41239 _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 Zr1 Zr 0.34031 0.08033 0.08033 1.00000 Zr2 Zr 0.65969 0.91967 0.91967 1.00000 Zr3 Zr 0.66097 0.02535 0.25971 1.00000 Zr4 Zr 0.33903 0.74029 0.97465 1.00000 Zr5 Zr 0.33903 0.97465 0.74029 1.00000 Zr6 Zr 0.66097 0.25971 0.02535 1.00000 Hg1 Hg 0.18498 0.54048 0.32291 1.00000 Hg2 Hg 0.81502 0.67709 0.45952 1.00000 Hg3 Hg 0.81502 0.45952 0.67709 1.00000 Hg4 Hg 0.18498 0.32291 0.54048 1.00000 Br1 Br 0.50000 0.23479 0.76521 1.00000 Br2 Br 0.19084 0.49086 0.94344 1.00000 Br3 Br 0.19084 0.94344 0.49086 1.00000 Br4 Br 0.80916 0.50914 0.05656 1.00000 Br5 Br 0.80586 0.82528 0.82528 1.00000 Br6 Br 0.19414 0.17472 0.17472 1.00000 Br7 Br 0.50138 0.34809 0.12238 1.00000 Br8 Br 0.49862 0.87762 0.65191 1.00000 Br9 Br 0.49862 0.65191 0.87762 1.00000 Br10 Br 0.50138 0.12238 0.34809 1.00000 Br11 Br 0.18692 0.70853 0.70853 1.00000 Br12 Br 0.82221 0.93237 0.17317 1.00000 Br13 Br 0.82221 0.17317 0.93237 1.00000 Br14 Br 0.17779 0.06763 0.82683 1.00000 Br15 Br 0.17779 0.82683 0.06763 1.00000 Br16 Br 0.50000 0.76521 0.23479 1.00000 Br17 Br 0.81308 0.29147 0.29147 1.00000 Br18 Br 0.80916 0.05656 0.50914 1.00000