# CIF generated by HEAS from Alexandria entry agm005685950 data_agm005685950 _cell_length_a 5.53141 _cell_length_b 5.53141 _cell_length_c 5.53141 _cell_angle_alpha 62.61612 _cell_angle_beta 62.61612 _cell_angle_gamma 62.61611 _cell_volume 126.64273 _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 0.37459 0.37459 0.37459 1.00000 Ca2 Ca 0.62541 0.62541 0.62541 1.00000 Tl1 Tl 0.00000 0.00000 0.00000 1.00000 Pd1 Pd 0.00000 0.00000 0.50000 1.00000 Pd2 Pd 0.50000 0.00000 0.00000 1.00000 Pd3 Pd 0.00000 0.50000 0.00000 1.00000