# CIF generated by HEAS from Alexandria entry agm001663217 data_agm001663217 _cell_length_a 4.96093 _cell_length_b 4.96093 _cell_length_c 3.64332 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 89.66527 _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 P1 P 0.50000 0.50000 0.50000 1.00000 Ca1 Ca 0.00000 0.50000 0.00000 1.00000 Ca2 Ca 0.50000 0.00000 0.00000 1.00000 Pd1 Pd 0.00000 0.00000 0.50000 1.00000 H1 H 0.00000 0.00000 0.00000 1.00000