# generated using pymatgen data_Hf18ReNi2Mo7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.40262766 _cell_length_b 8.64049229 _cell_length_c 8.63848234 _cell_angle_alpha 119.98541859 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf18ReNi2Mo7 _chemical_formula_sum 'Hf18 Re1 Ni2 Mo7' _cell_volume 543.23216938 _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 0.55735518 0.79927553 0.59830349 1.0 Hf Hf1 1 0.55737284 0.79930251 0.20094715 1.0 Hf Hf2 1 0.55649804 0.40030252 0.20015228 1.0 Hf Hf3 1 0.44137296 0.20029507 0.40027962 1.0 Hf Hf4 1 0.44134393 0.20027415 0.80004053 1.0 Hf Hf5 1 0.44285797 0.59837747 0.79919450 1.0 Hf Hf6 1 0.05862704 0.20029507 0.40027962 1.0 Hf Hf7 1 0.05865607 0.20027415 0.80004053 1.0 Hf Hf8 1 0.05714203 0.59837747 0.79919450 1.0 Hf Hf9 1 0.94264482 0.79927553 0.59830349 1.0 Hf Hf10 1 0.94262716 0.79930251 0.20094715 1.0 Hf Hf11 1 0.94350196 0.40030252 0.20015228 1.0 Hf Hf12 1 0.75000000 0.45756285 0.91603874 1.0 Hf Hf13 1 0.75000000 0.45756164 0.54150913 1.0 Hf Hf14 1 0.75000000 0.08454616 0.54227066 1.0 Hf Hf15 1 0.25000000 0.54108100 0.08418161 1.0 Hf Hf16 1 0.25000000 0.54106605 0.45693570 1.0 Hf Hf17 1 0.25000000 0.91599304 0.45800817 1.0 Re Re18 1 0.25000000 0.22594031 0.11297464 1.0 Ni Ni19 1 0.75000000 0.66562442 0.33281001 1.0 Ni Ni20 1 0.25000000 0.33386497 0.66691155 1.0 Mo Mo21 1 0.75000000 0.11191464 0.22322360 1.0 Mo Mo22 1 0.75000000 0.11189096 0.88867418 1.0 Mo Mo23 1 0.75000000 0.77566950 0.88782198 1.0 Mo Mo24 1 0.25000000 0.89043801 0.77784400 1.0 Mo Mo25 1 0.25000000 0.89045943 0.11259493 1.0 Mo Mo26 1 0.49975493 0.00036627 0.00018048 1.0 Mo Mo27 1 0.00024507 0.00036627 0.00018048 1.0