# generated using pymatgen data_Hf9CrFeRe3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.52193754 _cell_length_b 8.52193646 _cell_length_c 8.31636118 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999655 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf9CrFeRe3 _chemical_formula_sum 'Hf18 Cr2 Fe2 Re6' _cell_volume 523.04689415 _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 0.19929477 0.80070523 0.44051312 1.0 Hf Hf1 1 0.19929477 0.39859053 0.44051312 1.0 Hf Hf2 1 0.60140947 0.80070523 0.44051312 1.0 Hf Hf3 1 0.80070523 0.19929477 0.55948688 1.0 Hf Hf4 1 0.80070523 0.60140947 0.55948688 1.0 Hf Hf5 1 0.39859053 0.19929477 0.55948688 1.0 Hf Hf6 1 0.80070523 0.19929477 0.94051312 1.0 Hf Hf7 1 0.80070523 0.60140947 0.94051312 1.0 Hf Hf8 1 0.39859053 0.19929477 0.94051312 1.0 Hf Hf9 1 0.19929477 0.80070523 0.05948688 1.0 Hf Hf10 1 0.19929477 0.39859053 0.05948688 1.0 Hf Hf11 1 0.60140947 0.80070523 0.05948688 1.0 Hf Hf12 1 0.54077747 0.45922253 0.25000000 1.0 Hf Hf13 1 0.54077747 0.08155693 0.25000000 1.0 Hf Hf14 1 0.91844307 0.45922253 0.25000000 1.0 Hf Hf15 1 0.45922253 0.54077747 0.75000000 1.0 Hf Hf16 1 0.45922253 0.91844307 0.75000000 1.0 Hf Hf17 1 0.08155693 0.54077747 0.75000000 1.0 Cr Cr18 1 0.00000000 0.00000000 0.50000000 1.0 Cr Cr19 1 0.00000000 0.00000000 0.00000000 1.0 Fe Fe20 1 0.33333300 0.66666700 0.25000000 1.0 Fe Fe21 1 0.66666700 0.33333300 0.75000000 1.0 Re Re22 1 0.89047179 0.10952821 0.25000000 1.0 Re Re23 1 0.89047179 0.78094459 0.25000000 1.0 Re Re24 1 0.21905541 0.10952821 0.25000000 1.0 Re Re25 1 0.10952821 0.89047179 0.75000000 1.0 Re Re26 1 0.10952821 0.21905541 0.75000000 1.0 Re Re27 1 0.78094459 0.89047179 0.75000000 1.0