# generated using pymatgen data_Hf5Co16(ReP4)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.62448734 _cell_length_b 11.73498033 _cell_length_c 11.73497959 _cell_angle_alpha 119.99999791 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf5Co16(ReP4)3 _chemical_formula_sum 'Hf5 Co16 Re3 P12' _cell_volume 432.25689846 _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 0.00000000 0.66666700 0.33333300 1.0 Hf Hf1 1 0.00000000 0.33333300 0.66666700 1.0 Hf Hf2 1 0.50000000 0.82147676 0.82147676 1.0 Hf Hf3 1 0.50000000 0.17852324 0.00000000 1.0 Hf Hf4 1 0.50000000 0.00000000 0.17852324 1.0 Co Co5 1 0.00000000 0.19406757 0.37375169 1.0 Co Co6 1 0.00000000 0.17968412 0.80593243 1.0 Co Co7 1 0.00000000 0.82031588 0.62624831 1.0 Co Co8 1 0.00000000 0.80593243 0.17968412 1.0 Co Co9 1 0.00000000 0.37375169 0.19406757 1.0 Co Co10 1 0.50000000 0.12927361 0.48587419 1.0 Co Co11 1 0.50000000 0.35660059 0.87072639 1.0 Co Co12 1 0.50000000 0.51412581 0.64339941 1.0 Co Co13 1 0.50000000 0.64339941 0.51412581 1.0 Co Co14 1 0.50000000 0.87072639 0.35660059 1.0 Co Co15 1 0.50000000 0.48587419 0.12927361 1.0 Co Co16 1 0.00000000 0.00000000 0.00000000 1.0 Co Co17 1 0.50000000 0.71942479 0.00000000 1.0 Co Co18 1 0.50000000 0.00000000 0.71942479 1.0 Co Co19 1 0.00000000 0.62624831 0.82031588 1.0 Co Co20 1 0.50000000 0.28057521 0.28057521 1.0 Re Re21 1 0.00000000 0.44683729 0.44683729 1.0 Re Re22 1 0.00000000 0.55316271 1.00000000 1.0 Re Re23 1 0.00000000 0.00000000 0.55316271 1.0 P P24 1 0.00000000 0.64297587 0.64297587 1.0 P P25 1 0.00000000 0.35702413 1.00000000 1.0 P P26 1 0.00000000 0.00000000 0.35702413 1.0 P P27 1 0.50000000 0.48111770 0.31374302 1.0 P P28 1 0.50000000 0.68625698 0.16737468 1.0 P P29 1 0.50000000 0.83262532 0.51888230 1.0 P P30 1 0.50000000 0.51888230 0.83262532 1.0 P P31 1 0.50000000 0.16737468 0.68625698 1.0 P P32 1 0.00000000 0.82398522 0.00000000 1.0 P P33 1 0.00000000 0.00000000 0.82398522 1.0 P P34 1 0.50000000 0.31374302 0.48111770 1.0 P P35 1 0.00000000 0.17601478 0.17601478 1.0