# generated using pymatgen data_Hf18Be2Re5Mo3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.53575847 _cell_length_b 8.53575803 _cell_length_c 8.50425296 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.97972112 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf18Be2Re5Mo3 _chemical_formula_sum 'Hf18 Be2 Re5 Mo3' _cell_volume 536.71004466 _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 0.19927567 0.80072433 0.44827972 1.0 Hf Hf1 1 0.20010684 0.39959924 0.44911667 1.0 Hf Hf2 1 0.60040076 0.79989316 0.44911667 1.0 Hf Hf3 1 0.80064956 0.19935044 0.55241324 1.0 Hf Hf4 1 0.80111231 0.60239158 0.55300363 1.0 Hf Hf5 1 0.39760842 0.19888769 0.55300363 1.0 Hf Hf6 1 0.80064956 0.19935044 0.94758676 1.0 Hf Hf7 1 0.80111231 0.60239158 0.94699637 1.0 Hf Hf8 1 0.39760842 0.19888769 0.94699637 1.0 Hf Hf9 1 0.19927567 0.80072433 0.05172028 1.0 Hf Hf10 1 0.20010684 0.39959924 0.05088333 1.0 Hf Hf11 1 0.60040076 0.79989316 0.05088333 1.0 Hf Hf12 1 0.53954724 0.46045276 0.25000000 1.0 Hf Hf13 1 0.53770119 0.07771793 0.25000000 1.0 Hf Hf14 1 0.92228207 0.46229881 0.25000000 1.0 Hf Hf15 1 0.46039718 0.53960282 0.75000000 1.0 Hf Hf16 1 0.46036726 0.92128706 0.75000000 1.0 Hf Hf17 1 0.07871294 0.53963274 0.75000000 1.0 Be Be18 1 0.33312482 0.66687518 0.25000000 1.0 Be Be19 1 0.66641927 0.33358073 0.75000000 1.0 Re Re20 1 0.88889339 0.77552224 0.25000000 1.0 Re Re21 1 0.22447776 0.11110661 0.25000000 1.0 Re Re22 1 0.11086319 0.88913681 0.75000000 1.0 Re Re23 1 0.11145596 0.22287131 0.75000000 1.0 Re Re24 1 0.77712869 0.88854404 0.75000000 1.0 Mo Mo25 1 0.89023128 0.10976872 0.25000000 1.0 Mo Mo26 1 0.00004429 0.99995571 0.49904375 1.0 Mo Mo27 1 0.00004429 0.99995571 0.00095625 1.0