# CIF generated by HEAS from Alexandria entry agm072201450 data_agm072201450 _cell_length_a 8.12261 _cell_length_b 8.12261 _cell_length_c 8.12261 _cell_angle_alpha 71.34829 _cell_angle_beta 71.34829 _cell_angle_gamma 71.34829 _cell_volume 466.75252 _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 0.32809 0.32809 0.32809 1.00000 Ca2 Ca 0.67191 0.67191 0.67191 1.00000 Ca3 Ca 0.84891 0.09499 0.32773 1.00000 Ca4 Ca 0.32773 0.84891 0.09499 1.00000 Ca5 Ca 0.09499 0.32773 0.84891 1.00000 Ca6 Ca 0.15109 0.90501 0.67227 1.00000 Ca7 Ca 0.67227 0.15109 0.90501 1.00000 Ca8 Ca 0.90501 0.67227 0.15109 1.00000 Hg1 Hg 0.07408 0.67436 0.46924 1.00000 Hg2 Hg 0.46924 0.07408 0.67436 1.00000 Hg3 Hg 0.67436 0.46924 0.07408 1.00000 Hg4 Hg 0.92592 0.32564 0.53076 1.00000 Hg5 Hg 0.53076 0.92592 0.32564 1.00000 Hg6 Hg 0.32564 0.53076 0.92592 1.00000 Ir1 Ir 0.00000 0.00000 0.00000 1.00000