# CIF generated by HEAS from Alexandria entry agm005805033 data_agm005805033 _cell_length_a 6.12526 _cell_length_b 8.35311 _cell_length_c 8.35311 _cell_angle_alpha 113.76420 _cell_angle_beta 102.55931 _cell_angle_gamma 102.55931 _cell_volume 358.83518 _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 0.83492 0.65004 0.78088 1.00000 Ca2 Ca 0.06445 0.94722 0.28054 1.00000 Ca3 Ca 0.66508 0.21912 0.34996 1.00000 Ca4 Ca 0.43555 0.71946 0.05278 1.00000 Ca5 Ca 0.56445 0.28054 0.94722 1.00000 Ca6 Ca 0.33492 0.78088 0.65004 1.00000 Ca7 Ca 0.93555 0.05278 0.71946 1.00000 Ca8 Ca 0.16508 0.34996 0.21912 1.00000 Sn1 Sn 0.75000 0.63488 0.36512 1.00000 Sn2 Sn 0.25000 0.36512 0.63488 1.00000 Ir1 Ir 0.25000 0.99837 0.00163 1.00000 Ir2 Ir 0.75000 0.00163 0.99837 1.00000