# generated using pymatgen data_Hf3Cr(Co4P3)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.80294063 _cell_length_b 11.87105385 _cell_length_c 3.59022353 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.19108657 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf3Cr(Co4P3)2 _chemical_formula_sum 'Hf6 Cr2 Co16 P12' _cell_volume 434.80262070 _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 0.82101769 0.82185447 0.50000000 1.0 Hf Hf1 1 1.00000000 0.17411290 0.50000000 1.0 Hf Hf2 1 0.33434315 0.66541626 0.00000000 1.0 Hf Hf3 1 0.66565685 0.33107212 0.00000000 1.0 Hf Hf4 1 0.00000000 0.55598826 0.00000000 1.0 Hf Hf5 1 0.17898231 0.00083677 0.50000000 1.0 Cr Cr6 1 0.44650247 0.44611260 0.00000000 1.0 Cr Cr7 1 0.55349753 0.99961013 0.00000000 1.0 Co Co8 1 0.62217113 0.81840756 0.00000000 1.0 Co Co9 1 0.37782887 0.19623643 0.00000000 1.0 Co Co10 1 1.00000000 0.72187598 0.50000000 1.0 Co Co11 1 0.28393107 0.28285866 0.50000000 1.0 Co Co12 1 0.87099522 0.35422651 0.50000000 1.0 Co Co13 1 0.71606893 0.99892759 0.50000000 1.0 Co Co14 1 0.81796232 0.62780842 0.00000000 1.0 Co Co15 1 0.18203768 0.80984611 0.00000000 1.0 Co Co16 1 0.35881359 0.87531636 0.50000000 1.0 Co Co17 1 0.12900478 0.48323128 0.50000000 1.0 Co Co18 1 0.64118641 0.51650277 0.50000000 1.0 Co Co19 1 1.00000000 0.00130752 0.00000000 1.0 Co Co20 1 0.51578807 0.64223086 0.50000000 1.0 Co Co21 1 0.48421193 0.12644279 0.50000000 1.0 Co Co22 1 0.19696960 0.37471312 0.00000000 1.0 Co Co23 1 0.80303040 0.17774352 0.00000000 1.0 P P24 1 1.00000000 0.34409962 0.00000000 1.0 P P25 1 0.82455355 0.51558658 0.50000000 1.0 P P26 1 0.68559094 0.16603243 0.50000000 1.0 P P27 1 0.17847694 0.17743159 0.00000000 1.0 P P28 1 0.64319375 0.64749574 0.00000000 1.0 P P29 1 0.82152306 0.99895465 0.00000000 1.0 P P30 1 0.51853384 0.83194318 0.50000000 1.0 P P31 1 0.17544645 0.69103203 0.50000000 1.0 P P32 1 0.35680625 0.00430198 0.00000000 1.0 P P33 1 0.48146616 0.31341034 0.50000000 1.0 P P34 1 0.00000000 0.82659138 0.00000000 1.0 P P35 1 0.31440906 0.48044049 0.50000000 1.0