# CIF generated by HEAS from Alexandria entry agm005103531 data_agm005103531 _cell_length_a 3.15687 _cell_length_b 3.15687 _cell_length_c 7.24243 _cell_angle_alpha 77.41176 _cell_angle_beta 77.41176 _cell_angle_gamma 60.00000 _cell_volume 60.49538 _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 Ti1 Ti 0.05060 0.05060 0.84820 1.00000 Ti2 Ti 0.28230 0.28230 0.15309 1.00000 Tl1 Tl 0.50025 0.50025 0.49925 1.00000 H1 H 0.66685 0.66685 0.99945 1.00000