# generated using pymatgen data_Hf20Sn12P _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.73114353 _cell_length_b 8.43211687 _cell_length_c 14.55335678 _cell_angle_alpha 89.99999334 _cell_angle_beta 90.00000001 _cell_angle_gamma 90.04353107 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf20Sn12P _chemical_formula_sum 'Hf20 Sn12 P1' _cell_volume 703.30054430 _cell_formula_units_Z 1 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 0.50000200 0.00000100 0.33445548 1.0 Hf Hf1 1 0.50000000 0.49999800 0.83216522 1.0 Hf Hf2 1 0.50000000 0.49999800 0.16783478 1.0 Hf Hf3 1 0.50000200 0.00000100 0.66554452 1.0 Hf Hf4 1 0.00000000 0.50000100 0.16589022 1.0 Hf Hf5 1 0.00000100 0.00000000 0.66727853 1.0 Hf Hf6 1 0.00000100 1.00000000 0.33272147 1.0 Hf Hf7 1 1.00000000 0.50000100 0.83410978 1.0 Hf Hf8 1 0.74097308 0.25001763 1.00000000 1.0 Hf Hf9 1 0.74856196 0.74807483 0.50000000 1.0 Hf Hf10 1 0.74914002 0.37877235 0.37952128 1.0 Hf Hf11 1 0.74163748 0.87488494 0.87362950 1.0 Hf Hf12 1 0.74163748 0.87488494 0.12637050 1.0 Hf Hf13 1 0.74914002 0.37877235 0.62047872 1.0 Hf Hf14 1 0.25902192 0.74998237 0.00000000 1.0 Hf Hf15 1 0.25144004 0.25192417 0.50000000 1.0 Hf Hf16 1 0.25836552 0.12511306 0.12637050 1.0 Hf Hf17 1 0.25085998 0.62122665 0.62047872 1.0 Hf Hf18 1 0.25085998 0.62122665 0.37952128 1.0 Hf Hf19 1 0.25836552 0.12511306 0.87362950 1.0 Sn Sn20 1 0.74972747 0.60603627 0.00000000 1.0 Sn Sn21 1 0.75231524 0.10767780 0.50000000 1.0 Sn Sn22 1 0.75046248 0.19855690 0.19875527 1.0 Sn Sn23 1 0.75097576 0.69537280 0.69516085 1.0 Sn Sn24 1 0.75097576 0.69537280 0.30483915 1.0 Sn Sn25 1 0.75046248 0.19855690 0.80124473 1.0 Sn Sn26 1 0.25027853 0.39396573 1.00000000 1.0 Sn Sn27 1 0.24768576 0.89232320 0.50000000 1.0 Sn Sn28 1 0.24902424 0.30462620 0.30484015 1.0 Sn Sn29 1 0.24953052 0.80144310 0.80124773 1.0 Sn Sn30 1 0.24953052 0.80144310 0.19875227 1.0 Sn Sn31 1 0.24902424 0.30462620 0.69515985 1.0 P P32 1 0.00000000 0.99999900 0.00000000 1.0