# generated using pymatgen data_Hf3Sb7Pd _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.96574742 _cell_length_b 14.63407083 _cell_length_c 17.54612760 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf3Sb7Pd _chemical_formula_sum 'Hf12 Sb28 Pd4' _cell_volume 1018.29001775 _cell_formula_units_Z 4 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 0.25000000 0.31136330 0.84822064 1.0 Hf Hf1 1 0.25000000 0.18863670 0.34822064 1.0 Hf Hf2 1 0.75000000 0.68863670 0.15177936 1.0 Hf Hf3 1 0.75000000 0.81136330 0.65177936 1.0 Hf Hf4 1 0.25000000 0.03192787 0.86965102 1.0 Hf Hf5 1 0.25000000 0.46807213 0.36965102 1.0 Hf Hf6 1 0.75000000 0.96807213 0.13034898 1.0 Hf Hf7 1 0.75000000 0.53192787 0.63034898 1.0 Hf Hf8 1 0.25000000 0.58696984 0.89297125 1.0 Hf Hf9 1 0.25000000 0.91303016 0.39297125 1.0 Hf Hf10 1 0.75000000 0.41303016 0.10702875 1.0 Hf Hf11 1 0.75000000 0.08696984 0.60702875 1.0 Sb Sb12 1 0.25000000 0.19506538 0.52032707 1.0 Sb Sb13 1 0.25000000 0.30493462 0.02032707 1.0 Sb Sb14 1 0.75000000 0.80493462 0.47967293 1.0 Sb Sb15 1 0.75000000 0.69506538 0.97967293 1.0 Sb Sb16 1 0.25000000 0.42906338 0.53658542 1.0 Sb Sb17 1 0.25000000 0.07093662 0.03658542 1.0 Sb Sb18 1 0.75000000 0.57093662 0.46341458 1.0 Sb Sb19 1 0.75000000 0.92906338 0.96341458 1.0 Sb Sb20 1 0.25000000 0.94004132 0.57179917 1.0 Sb Sb21 1 0.25000000 0.55995868 0.07179917 1.0 Sb Sb22 1 0.75000000 0.05995868 0.42820083 1.0 Sb Sb23 1 0.75000000 0.44004132 0.92820083 1.0 Sb Sb24 1 0.25000000 0.67665935 0.59441745 1.0 Sb Sb25 1 0.25000000 0.82334065 0.09441745 1.0 Sb Sb26 1 0.75000000 0.32334065 0.40558255 1.0 Sb Sb27 1 0.75000000 0.17665935 0.90558255 1.0 Sb Sb28 1 0.25000000 0.14771360 0.72702490 1.0 Sb Sb29 1 0.25000000 0.35228640 0.22702490 1.0 Sb Sb30 1 0.75000000 0.85228640 0.27297510 1.0 Sb Sb31 1 0.75000000 0.64771360 0.77297510 1.0 Sb Sb32 1 0.25000000 0.48080967 0.74822485 1.0 Sb Sb33 1 0.25000000 0.01919033 0.24822485 1.0 Sb Sb34 1 0.75000000 0.51919033 0.25177515 1.0 Sb Sb35 1 0.75000000 0.98080967 0.75177515 1.0 Sb Sb36 1 0.25000000 0.82080390 0.78309948 1.0 Sb Sb37 1 0.25000000 0.67919610 0.28309948 1.0 Sb Sb38 1 0.75000000 0.17919610 0.21690052 1.0 Sb Sb39 1 0.75000000 0.32080390 0.71690052 1.0 Pd Pd40 1 0.25000000 0.81010055 0.93561858 1.0 Pd Pd41 1 0.25000000 0.68989945 0.43561858 1.0 Pd Pd42 1 0.75000000 0.18989945 0.06438142 1.0 Pd Pd43 1 0.75000000 0.31010055 0.56438142 1.0