# CIF generated by HEAS from Alexandria entry agm006117791 data_agm006117791 _cell_length_a 6.95429 _cell_length_b 6.95428 _cell_length_c 6.95428 _cell_angle_alpha 59.99999 _cell_angle_beta 60.00000 _cell_angle_gamma 60.00000 _cell_volume 237.81665 _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 Ni1 Ni 0.25000 0.25000 0.25000 1.00000 Ir1 Ir 0.00000 0.00000 0.00000 1.00000 Ir2 Ir 0.62258 0.62258 0.13225 1.00000 Ir3 Ir 0.62258 0.62258 0.62258 1.00000 Ir4 Ir 0.13225 0.62258 0.62258 1.00000 Ir5 Ir 0.62258 0.13225 0.62258 1.00000 S1 S 0.38075 0.85776 0.38075 1.00000 S2 S 0.85776 0.38075 0.38075 1.00000 S3 S 0.38075 0.38075 0.38075 1.00000 S4 S 0.38075 0.38075 0.85776 1.00000 S5 S 0.86556 0.86556 0.40332 1.00000 S6 S 0.40332 0.86556 0.86556 1.00000 S7 S 0.86556 0.86556 0.86556 1.00000 S8 S 0.86556 0.40332 0.86556 1.00000