# generated using pymatgen data_Hf18Re8BP _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.46148120 _cell_length_b 8.46148164 _cell_length_c 8.55306666 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999826 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf18Re8BP _chemical_formula_sum 'Hf18 Re8 B1 P1' _cell_volume 530.32891503 _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 0.19468132 0.80531868 0.45024071 1.0 Hf Hf1 1 0.19468132 0.38936364 0.45024071 1.0 Hf Hf2 1 0.61063636 0.80531868 0.45024071 1.0 Hf Hf3 1 0.79970368 0.20029632 0.55636024 1.0 Hf Hf4 1 0.79970368 0.59940835 0.55636024 1.0 Hf Hf5 1 0.40059165 0.20029632 0.55636024 1.0 Hf Hf6 1 0.79970368 0.20029632 0.94363976 1.0 Hf Hf7 1 0.79970368 0.59940835 0.94363976 1.0 Hf Hf8 1 0.40059165 0.20029632 0.94363976 1.0 Hf Hf9 1 0.19468132 0.80531868 0.04975929 1.0 Hf Hf10 1 0.19468132 0.38936364 0.04975929 1.0 Hf Hf11 1 0.61063636 0.80531868 0.04975929 1.0 Hf Hf12 1 0.54210478 0.45789522 0.25000000 1.0 Hf Hf13 1 0.54210478 0.08420955 0.25000000 1.0 Hf Hf14 1 0.91579045 0.45789522 0.25000000 1.0 Hf Hf15 1 0.45910075 0.54089925 0.75000000 1.0 Hf Hf16 1 0.45910075 0.91820151 0.75000000 1.0 Hf Hf17 1 0.08179849 0.54089925 0.75000000 1.0 Re Re18 1 0.88941063 0.11058937 0.25000000 1.0 Re Re19 1 0.88941063 0.77882227 0.25000000 1.0 Re Re20 1 0.22117773 0.11058937 0.25000000 1.0 Re Re21 1 0.10997731 0.89002269 0.75000000 1.0 Re Re22 1 0.10997731 0.21995362 0.75000000 1.0 Re Re23 1 0.78004638 0.89002269 0.75000000 1.0 Re Re24 1 0.00000000 0.00000000 0.50006446 1.0 Re Re25 1 0.00000000 0.00000000 0.99993554 1.0 B B26 1 0.66666700 0.33333300 0.75000000 1.0 P P27 1 0.33333300 0.66666700 0.25000000 1.0