# CIF generated by HEAS from Alexandria entry agm005650100 data_agm005650100 _cell_length_a 5.07722 _cell_length_b 5.10891 _cell_length_c 5.10891 _cell_angle_alpha 65.71333 _cell_angle_beta 60.20498 _cell_angle_gamma 60.20498 _cell_volume 97.39305 _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 0.87194 0.37806 0.37806 1.00000 Ca2 Ca 0.12806 0.62194 0.62194 1.00000 Be1 Be 0.00000 0.00000 0.00000 1.00000 Be2 Be 0.50000 0.00000 0.00000 1.00000 Ir1 Ir 0.50000 0.50000 0.00000 1.00000 Ir2 Ir 0.50000 0.00000 0.50000 1.00000