# generated using pymatgen data_Hf9SiMo4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.64816338 _cell_length_b 8.64816338 _cell_length_c 8.72302000 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999523 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf9SiMo4 _chemical_formula_sum 'Hf18 Si2 Mo8' _cell_volume 564.99589409 _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 0.19745200 0.80254800 0.45475800 1.0 Hf Hf1 1 0.19745200 0.39490500 0.45475800 1.0 Hf Hf2 1 0.60509500 0.80254800 0.45475800 1.0 Hf Hf3 1 0.80254800 0.19745200 0.54524200 1.0 Hf Hf4 1 0.80254800 0.60509500 0.54524200 1.0 Hf Hf5 1 0.39490500 0.19745200 0.54524200 1.0 Hf Hf6 1 0.80254800 0.19745200 0.95475800 1.0 Hf Hf7 1 0.80254800 0.60509500 0.95475800 1.0 Hf Hf8 1 0.39490500 0.19745200 0.95475800 1.0 Hf Hf9 1 0.19745200 0.80254800 0.04524200 1.0 Hf Hf10 1 0.19745200 0.39490500 0.04524200 1.0 Hf Hf11 1 0.60509500 0.80254800 0.04524200 1.0 Hf Hf12 1 0.53683700 0.46316300 0.25000000 1.0 Hf Hf13 1 0.53683700 0.07367400 0.25000000 1.0 Hf Hf14 1 0.92632600 0.46316300 0.25000000 1.0 Hf Hf15 1 0.46316300 0.53683700 0.75000000 1.0 Hf Hf16 1 0.46316300 0.92632600 0.75000000 1.0 Hf Hf17 1 0.07367400 0.53683700 0.75000000 1.0 Si Si18 1 0.33333300 0.66666700 0.25000000 1.0 Si Si19 1 0.66666700 0.33333300 0.75000000 1.0 Mo Mo20 1 0.88975200 0.11024800 0.25000000 1.0 Mo Mo21 1 0.88975200 0.77950300 0.25000000 1.0 Mo Mo22 1 0.22049700 0.11024800 0.25000000 1.0 Mo Mo23 1 0.11024800 0.88975200 0.75000000 1.0 Mo Mo24 1 0.11024800 0.22049700 0.75000000 1.0 Mo Mo25 1 0.77950300 0.88975200 0.75000000 1.0 Mo Mo26 1 0.00000000 0.00000000 0.50000000 1.0 Mo Mo27 1 0.00000000 0.00000000 0.00000000 1.0