# generated using pymatgen data_Hf10Re3Ni _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.67831102 _cell_length_b 8.67831202 _cell_length_c 8.39203548 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000371 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf10Re3Ni _chemical_formula_sum 'Hf20 Re6 Ni2' _cell_volume 547.35412848 _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 0.20118811 0.79881189 0.44203036 1.0 Hf Hf1 1 0.20118811 0.40237522 0.44203036 1.0 Hf Hf2 1 0.59762478 0.79881189 0.44203036 1.0 Hf Hf3 1 0.79881189 0.20118811 0.55796964 1.0 Hf Hf4 1 0.79881189 0.59762478 0.55796964 1.0 Hf Hf5 1 0.40237522 0.20118811 0.55796964 1.0 Hf Hf6 1 0.79881189 0.20118811 0.94203036 1.0 Hf Hf7 1 0.79881189 0.59762478 0.94203036 1.0 Hf Hf8 1 0.40237522 0.20118811 0.94203036 1.0 Hf Hf9 1 0.20118811 0.79881189 0.05796964 1.0 Hf Hf10 1 0.20118811 0.40237522 0.05796964 1.0 Hf Hf11 1 0.59762478 0.79881189 0.05796964 1.0 Hf Hf12 1 0.54223200 0.45776800 0.25000000 1.0 Hf Hf13 1 0.54223200 0.08446399 0.25000000 1.0 Hf Hf14 1 0.91553601 0.45776800 0.25000000 1.0 Hf Hf15 1 0.45776800 0.54223200 0.75000000 1.0 Hf Hf16 1 0.45776800 0.91553601 0.75000000 1.0 Hf Hf17 1 0.08446399 0.54223200 0.75000000 1.0 Hf Hf18 1 0.00000000 0.00000000 0.50000000 1.0 Hf Hf19 1 0.00000000 0.00000000 0.00000000 1.0 Re Re20 1 0.88236515 0.11763485 0.25000000 1.0 Re Re21 1 0.88236515 0.76472930 0.25000000 1.0 Re Re22 1 0.23527070 0.11763485 0.25000000 1.0 Re Re23 1 0.11763485 0.88236515 0.75000000 1.0 Re Re24 1 0.11763485 0.23527070 0.75000000 1.0 Re Re25 1 0.76472930 0.88236515 0.75000000 1.0 Ni Ni26 1 0.33333300 0.66666700 0.25000000 1.0 Ni Ni27 1 0.66666700 0.33333300 0.75000000 1.0