# CIF generated by HEAS from Alexandria entry agm006111699 data_agm006111699 _cell_length_a 5.37897 _cell_length_b 7.47370 _cell_length_c 8.52138 _cell_angle_alpha 90.00017 _cell_angle_beta 71.60198 _cell_angle_gamma 90.00054 _cell_volume 325.05703 _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 Ca1 Ca 0.00000 0.00000 0.00000 1.00000 Tl1 Tl 0.83222 0.74781 0.33559 1.00000 Tl2 Tl 0.83219 0.25219 0.33559 1.00000 Tl3 Tl 0.50003 0.25056 1.00000 1.00000 Tl4 Tl 0.49997 0.74944 0.00000 1.00000 Tl5 Tl 0.16781 0.74781 0.66441 1.00000 Tl6 Tl 0.16778 0.25219 0.66441 1.00000 Er1 Er 0.66482 0.50000 0.67036 1.00000 Er2 Er 0.33339 0.00000 0.33323 1.00000 Er3 Er 0.00000 0.50000 0.00000 1.00000 Er4 Er 0.66661 1.00000 0.66677 1.00000 Er5 Er 0.33518 0.50000 0.32964 1.00000