# CIF generated by HEAS from Alexandria entry agm005894792 data_agm005894792 _cell_length_a 6.86394 _cell_length_b 6.86394 _cell_length_c 6.86394 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 323.38545 _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 Mo1 Mo 0.62500 0.29839 0.54839 1.00000 Mo2 Mo 0.70161 0.04839 0.87500 1.00000 Mo3 Mo 0.54839 0.62500 0.29839 1.00000 Mo4 Mo 0.95161 0.37500 0.79839 1.00000 Mo5 Mo 0.29839 0.54839 0.62500 1.00000 Mo6 Mo 0.45161 0.12500 0.20161 1.00000 Mo7 Mo 0.04839 0.87500 0.70161 1.00000 Mo8 Mo 0.79839 0.95161 0.37500 1.00000 Mo9 Mo 0.20161 0.45161 0.12500 1.00000 Mo10 Mo 0.87500 0.70161 0.04839 1.00000 Mo11 Mo 0.37500 0.79839 0.95161 1.00000 Mo12 Mo 0.12500 0.20161 0.45161 1.00000 Ir1 Ir 0.55930 0.44070 0.94070 1.00000 Ir2 Ir 0.69070 0.69070 0.69070 1.00000 Ir3 Ir 0.94070 0.55930 0.44070 1.00000 Ir4 Ir 0.44070 0.94070 0.55930 1.00000 Ir5 Ir 0.19070 0.80930 0.30930 1.00000 Ir6 Ir 0.80930 0.30930 0.19070 1.00000 Ir7 Ir 0.30930 0.19070 0.80930 1.00000 Ir8 Ir 0.05930 0.05930 0.05930 1.00000 N1 N 0.87500 0.12500 0.62500 1.00000 N2 N 0.12500 0.62500 0.87500 1.00000 N3 N 0.62500 0.87500 0.12500 1.00000 N4 N 0.37500 0.37500 0.37500 1.00000