# CIF generated by HEAS from Alexandria entry agm005995502 data_agm005995502 _cell_length_a 5.40947 _cell_length_b 9.78331 _cell_length_c 9.78454 _cell_angle_alpha 119.99780 _cell_angle_beta 90.00403 _cell_angle_gamma 90.00151 _cell_volume 448.45762 _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 K1 K 0.00000 0.00000 0.99999 1.00000 Zr1 Zr 0.25501 0.33334 0.66667 1.00000 Zr2 Zr 0.74499 0.66666 0.33331 1.00000 Br1 Br 0.24179 0.66665 0.33330 1.00000 Br2 Br 0.75821 0.33335 0.66667 1.00000 Br3 Br 0.73695 0.81625 0.18154 1.00000 Br4 Br 0.26299 0.18155 0.36534 1.00000 Br5 Br 0.26307 0.63472 0.81624 1.00000 Br6 Br 0.26305 0.18376 0.81845 1.00000 Br7 Br 0.73701 0.81844 0.63464 1.00000 Br8 Br 0.73693 0.36528 0.18376 1.00000