# CIF generated by HEAS from Alexandria entry agm005019091 data_agm005019091 _cell_length_a 4.05647 _cell_length_b 4.05647 _cell_length_c 5.71270 _cell_angle_alpha 110.79589 _cell_angle_beta 110.79589 _cell_angle_gamma 90.00000 _cell_volume 81.29400 _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 Fe1 Fe 0.25000 0.75000 0.50000 1.00000 Si1 Si 0.63028 0.63028 0.26057 1.00000 Si2 Si 0.36972 0.36972 0.73943 1.00000 Ir1 Ir 0.75000 0.25000 0.50000 1.00000