# CIF generated by HEAS from Alexandria entry agm005458809 data_agm005458809 _cell_length_a 3.32994 _cell_length_b 3.32994 _cell_length_c 14.43232 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 160.03311 _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 Tl1 Tl 0.00000 0.00000 0.88617 1.00000 Tl2 Tl 0.00000 0.00000 0.11383 1.00000 Tl3 Tl 0.50000 0.50000 0.69358 1.00000 Tl4 Tl 0.50000 0.50000 0.30642 1.00000 Tl5 Tl 0.00000 0.00000 0.50000 1.00000 Ni1 Ni 0.50000 0.50000 0.00000 1.00000