# generated using pymatgen data_Hf9BeRe3W _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.54285190 _cell_length_b 8.54285211 _cell_length_c 8.50399221 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000303 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf9BeRe3W _chemical_formula_sum 'Hf18 Be2 Re6 W2' _cell_volume 537.47620007 _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 0.19888982 0.80111018 0.44801112 1.0 Hf Hf1 1 0.19888982 0.39777763 0.44801112 1.0 Hf Hf2 1 0.60222237 0.80111018 0.44801112 1.0 Hf Hf3 1 0.80111018 0.19888982 0.55198888 1.0 Hf Hf4 1 0.80111018 0.60222237 0.55198888 1.0 Hf Hf5 1 0.39777763 0.19888982 0.55198888 1.0 Hf Hf6 1 0.80111018 0.19888982 0.94801112 1.0 Hf Hf7 1 0.80111018 0.60222237 0.94801112 1.0 Hf Hf8 1 0.39777763 0.19888982 0.94801112 1.0 Hf Hf9 1 0.19888982 0.80111018 0.05198888 1.0 Hf Hf10 1 0.19888982 0.39777763 0.05198888 1.0 Hf Hf11 1 0.60222237 0.80111018 0.05198888 1.0 Hf Hf12 1 0.53948060 0.46051940 0.25000000 1.0 Hf Hf13 1 0.53948060 0.07896120 0.25000000 1.0 Hf Hf14 1 0.92103880 0.46051940 0.25000000 1.0 Hf Hf15 1 0.46051940 0.53948060 0.75000000 1.0 Hf Hf16 1 0.46051940 0.92103880 0.75000000 1.0 Hf Hf17 1 0.07896120 0.53948060 0.75000000 1.0 Be Be18 1 0.33333300 0.66666700 0.25000000 1.0 Be Be19 1 0.66666700 0.33333300 0.75000000 1.0 Re Re20 1 0.88879055 0.11120945 0.25000000 1.0 Re Re21 1 0.88879055 0.77757810 0.25000000 1.0 Re Re22 1 0.22242190 0.11120945 0.25000000 1.0 Re Re23 1 0.11120945 0.88879055 0.75000000 1.0 Re Re24 1 0.11120945 0.22242190 0.75000000 1.0 Re Re25 1 0.77757810 0.88879055 0.75000000 1.0 W W26 1 0.00000000 0.00000000 0.50000000 1.0 W W27 1 0.00000000 0.00000000 0.00000000 1.0