# CIF generated by HEAS from Alexandria entry agm005808646 data_agm005808646 _cell_length_a 6.29131 _cell_length_b 8.28557 _cell_length_c 8.28557 _cell_angle_alpha 112.07353 _cell_angle_beta 100.94214 _cell_angle_gamma 100.94212 _cell_volume 376.43413 _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 0.86593 0.65347 0.80432 1.00000 Ca2 Ca 0.05603 0.94112 0.27056 1.00000 Ca3 Ca 0.63407 0.19568 0.34653 1.00000 Ca4 Ca 0.44397 0.72944 0.05888 1.00000 Ca5 Ca 0.55603 0.27056 0.94112 1.00000 Ca6 Ca 0.36593 0.80432 0.65347 1.00000 Ca7 Ca 0.94397 0.05888 0.72944 1.00000 Ca8 Ca 0.13407 0.34653 0.19568 1.00000 Mg1 Mg 0.75000 0.62435 0.37565 1.00000 Mg2 Mg 0.25000 0.37565 0.62435 1.00000 Ir1 Ir 0.25000 0.99954 0.00046 1.00000 Ir2 Ir 0.75000 0.00046 0.99954 1.00000