# generated using pymatgen data_HfNb4Co19P12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.62526823 _cell_length_b 11.62526824 _cell_length_c 3.57182683 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000274 _symmetry_Int_Tables_number 1 _chemical_formula_structural HfNb4Co19P12 _chemical_formula_sum 'Hf1 Nb4 Co19 P12' _cell_volume 418.04879769 _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 0.33333300 0.66666700 0.50000000 1.0 Nb Nb1 1 0.66666700 0.33333300 0.50000000 1.0 Nb Nb2 1 0.81838465 0.99921850 0.00000000 1.0 Nb Nb3 1 0.00078150 0.81916716 0.00000000 1.0 Nb Nb4 1 0.18083284 0.18161535 0.00000000 1.0 Co Co5 1 0.62435870 0.80379569 0.50000000 1.0 Co Co6 1 0.19620431 0.82056301 0.50000000 1.0 Co Co7 1 0.17943699 0.37564130 0.50000000 1.0 Co Co8 1 0.37714643 0.18100865 0.50000000 1.0 Co Co9 1 0.80386222 0.62285357 0.50000000 1.0 Co Co10 1 0.81899135 0.19613778 0.50000000 1.0 Co Co11 1 0.28190355 0.00042175 0.00000000 1.0 Co Co12 1 0.99957825 0.28148080 0.00000000 1.0 Co Co13 1 0.71851920 0.71809645 0.00000000 1.0 Co Co14 1 0.44782082 0.00013536 0.50000000 1.0 Co Co15 1 0.99986464 0.44768546 0.50000000 1.0 Co Co16 1 0.55231454 0.55217918 0.50000000 1.0 Co Co17 1 0.51638056 0.87441546 0.00000000 1.0 Co Co18 1 0.12558454 0.64196510 0.00000000 1.0 Co Co19 1 0.35803490 0.48361944 0.00000000 1.0 Co Co20 1 0.48442330 0.35933399 0.00000000 1.0 Co Co21 1 0.87490968 0.51557670 0.00000000 1.0 Co Co22 1 0.64066601 0.12509032 0.00000000 1.0 Co Co23 1 0.00000000 0.00000000 0.50000000 1.0 P P24 1 0.17716172 0.00085090 0.50000000 1.0 P P25 1 0.99914910 0.17631083 0.50000000 1.0 P P26 1 0.82368917 0.82283828 0.50000000 1.0 P P27 1 0.51841657 0.68577708 0.00000000 1.0 P P28 1 0.31422292 0.83263948 0.00000000 1.0 P P29 1 0.16736052 0.48158343 0.00000000 1.0 P P30 1 0.48275435 0.16873597 0.00000000 1.0 P P31 1 0.68598262 0.51724565 0.00000000 1.0 P P32 1 0.83126403 0.31401738 0.00000000 1.0 P P33 1 0.63929381 0.99975825 0.50000000 1.0 P P34 1 0.00024175 0.63953456 0.50000000 1.0 P P35 1 0.36046544 0.36070619 0.50000000 1.0