# CIF generated by HEAS from Alexandria entry agm005104413 data_agm005104413 _cell_length_a 3.28609 _cell_length_b 3.28609 _cell_length_c 7.92023 _cell_angle_alpha 78.14326 _cell_angle_beta 78.14326 _cell_angle_gamma 60.08119 _cell_volume 72.00981 _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 0.05885 0.05885 0.82456 1.00000 Zr2 Zr 0.27417 0.27417 0.17415 1.00000 Tl1 Tl 0.50062 0.50062 0.50034 1.00000 O1 O 0.66637 0.66637 0.00095 1.00000