# generated using pymatgen data_Hf9Mo4P _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.64023251 _cell_length_b 8.64023251 _cell_length_c 8.63126900 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000394 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf9Mo4P _chemical_formula_sum 'Hf18 Mo8 P2' _cell_volume 558.02817346 _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 0.19791700 0.80208300 0.45328400 1.0 Hf Hf1 1 0.19791700 0.39583300 0.45328400 1.0 Hf Hf2 1 0.60416700 0.80208300 0.45328400 1.0 Hf Hf3 1 0.80208300 0.19791700 0.54671600 1.0 Hf Hf4 1 0.80208300 0.60416700 0.54671600 1.0 Hf Hf5 1 0.39583300 0.19791700 0.54671600 1.0 Hf Hf6 1 0.80208300 0.19791700 0.95328400 1.0 Hf Hf7 1 0.80208300 0.60416700 0.95328400 1.0 Hf Hf8 1 0.39583300 0.19791700 0.95328400 1.0 Hf Hf9 1 0.19791700 0.80208300 0.04671600 1.0 Hf Hf10 1 0.19791700 0.39583300 0.04671600 1.0 Hf Hf11 1 0.60416700 0.80208300 0.04671600 1.0 Hf Hf12 1 0.53908000 0.46092000 0.25000000 1.0 Hf Hf13 1 0.53908000 0.07816000 0.25000000 1.0 Hf Hf14 1 0.92184000 0.46092000 0.25000000 1.0 Hf Hf15 1 0.46092000 0.53908000 0.75000000 1.0 Hf Hf16 1 0.46092000 0.92184000 0.75000000 1.0 Hf Hf17 1 0.07816000 0.53908000 0.75000000 1.0 Mo Mo18 1 0.88939200 0.11060800 0.25000000 1.0 Mo Mo19 1 0.88939200 0.77878300 0.25000000 1.0 Mo Mo20 1 0.22121700 0.11060800 0.25000000 1.0 Mo Mo21 1 0.11060800 0.88939200 0.75000000 1.0 Mo Mo22 1 0.11060800 0.22121700 0.75000000 1.0 Mo Mo23 1 0.77878300 0.88939200 0.75000000 1.0 Mo Mo24 1 0.00000000 0.00000000 0.50000000 1.0 Mo Mo25 1 0.00000000 0.00000000 0.00000000 1.0 P P26 1 0.33333300 0.66666700 0.25000000 1.0 P P27 1 0.66666700 0.33333300 0.75000000 1.0