# generated using pymatgen data_Hf6Co17ReP12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.59879723 _cell_length_b 10.18300614 _cell_length_c 11.82909947 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf6Co17ReP12 _chemical_formula_sum 'Hf6 Co17 Re1 P12' _cell_volume 433.49597181 _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 0.50000000 0.53226994 1.0 Hf Hf1 1 0.50000000 0.00000000 0.47279114 1.0 Hf Hf2 1 0.50000000 0.82387630 0.20953683 1.0 Hf Hf3 1 0.50000000 0.17612370 0.20953683 1.0 Hf Hf4 1 0.00000000 0.67918836 0.79154091 1.0 Hf Hf5 1 0.00000000 0.32081164 0.79154091 1.0 Co Co6 1 0.00000000 0.50000000 0.98970627 1.0 Co Co7 1 0.50000000 0.00000000 0.01405984 1.0 Co Co8 1 0.50000000 0.30024551 0.43257564 1.0 Co Co9 1 0.50000000 0.69975449 0.43257564 1.0 Co Co10 1 0.00000000 0.20072348 0.56621368 1.0 Co Co11 1 0.00000000 0.79927652 0.56621368 1.0 Co Co12 1 0.50000000 0.87533106 0.70679572 1.0 Co Co13 1 0.50000000 0.12466894 0.70679572 1.0 Co Co14 1 0.00000000 0.62456133 0.29367410 1.0 Co Co15 1 0.00000000 0.37543867 0.29367410 1.0 Co Co16 1 0.50000000 0.33254639 0.98998124 1.0 Co Co17 1 0.50000000 0.66745361 0.98998124 1.0 Co Co18 1 0.00000000 0.16751328 0.00589113 1.0 Co Co19 1 0.00000000 0.83248672 0.00589113 1.0 Co Co20 1 0.00000000 0.00000000 0.83590193 1.0 Co Co21 1 0.50000000 0.50000000 0.70295702 1.0 Co Co22 1 0.00000000 0.00000000 0.29649119 1.0 Re Re23 1 0.50000000 0.50000000 0.16129323 1.0 P P24 1 0.50000000 0.31676815 0.61742748 1.0 P P25 1 0.50000000 0.68323185 0.61742748 1.0 P P26 1 0.00000000 0.18159724 0.38328222 1.0 P P27 1 0.00000000 0.81840276 0.38328222 1.0 P P28 1 0.50000000 0.50000000 0.87743940 1.0 P P29 1 0.00000000 0.00000000 0.12071913 1.0 P P30 1 0.50000000 0.84630043 0.88779178 1.0 P P31 1 0.50000000 0.15369957 0.88779178 1.0 P P32 1 0.00000000 0.66068489 0.11090968 1.0 P P33 1 0.00000000 0.33931511 0.11090968 1.0 P P34 1 0.50000000 0.50000000 0.35859724 1.0 P P35 1 0.00000000 0.00000000 0.64653087 1.0