# generated using pymatgen data_Hf9Nb3POs _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.63436758 _cell_length_b 8.63401050 _cell_length_c 8.78069817 _cell_angle_alpha 89.99998692 _cell_angle_beta 90.00002616 _cell_angle_gamma 119.99790973 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf9Nb3POs _chemical_formula_sum 'Hf18 Nb6 P2 Os2' _cell_volume 566.90714891 _cell_formula_units_Z 2 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Hf Hf0 1 0.19786072 0.80212792 0.45245040 1.0 Hf Hf1 1 0.19786687 0.39574708 0.45245537 1.0 Hf Hf2 1 0.60425266 0.80212489 0.45245131 1.0 Hf Hf3 1 0.80213723 0.19787689 0.54752018 1.0 Hf Hf4 1 0.80212918 0.60424740 0.54751557 1.0 Hf Hf5 1 0.39575446 0.19787809 0.54752014 1.0 Hf Hf6 1 0.80213623 0.19787589 0.95247982 1.0 Hf Hf7 1 0.80213018 0.60424740 0.95248343 1.0 Hf Hf8 1 0.39575446 0.19787909 0.95247986 1.0 Hf Hf9 1 0.19785872 0.80212692 0.04754860 1.0 Hf Hf10 1 0.19786787 0.39574808 0.04754463 1.0 Hf Hf11 1 0.60425166 0.80212589 0.04754869 1.0 Hf Hf12 1 0.53818307 0.46180147 0.25000000 1.0 Hf Hf13 1 0.53818788 0.07639409 0.25000100 1.0 Hf Hf14 1 0.92361454 0.46180914 0.25000100 1.0 Hf Hf15 1 0.46181802 0.53819847 0.75000100 1.0 Hf Hf16 1 0.46181277 0.92360802 0.74999900 1.0 Hf Hf17 1 0.07638297 0.53819039 0.74999900 1.0 Nb Nb18 1 0.88933554 0.11066599 0.25000200 1.0 Nb Nb19 1 0.88933345 0.77866129 0.25000000 1.0 Nb Nb20 1 0.22133558 0.11066971 0.25000000 1.0 Nb Nb21 1 0.11065314 0.88934264 0.74999800 1.0 Nb Nb22 1 0.11065487 0.22130913 0.75000000 1.0 Nb Nb23 1 0.77868530 0.88934215 0.75000000 1.0 P P24 1 0.33335102 0.66667265 0.25000000 1.0 P P25 1 0.66664983 0.33332872 0.75000000 1.0 Os Os26 1 0.99999991 0.00000031 0.49997743 1.0 Os Os27 1 0.99999991 0.00000031 0.00002357 1.0