# generated using pymatgen data_Hf4TaSi3N _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.73512024 _cell_length_b 7.73512024 _cell_length_c 5.44600368 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000422 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf4TaSi3N _chemical_formula_sum 'Hf8 Ta2 Si6 N2' _cell_volume 282.19069021 _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 0.23610557 1.00000000 0.75075988 1.0 Hf Hf1 1 0.76389443 0.00000000 0.24924012 1.0 Hf Hf2 1 1.00000000 0.23610557 0.75075988 1.0 Hf Hf3 1 0.00000000 0.76389443 0.24924012 1.0 Hf Hf4 1 0.76389443 0.76389443 0.75075988 1.0 Hf Hf5 1 0.23610557 0.23610557 0.24924012 1.0 Hf Hf6 1 0.33333300 0.66666700 0.50000000 1.0 Hf Hf7 1 0.66666700 0.33333300 0.50000000 1.0 Ta Ta8 1 0.66666700 0.33333300 0.00000000 1.0 Ta Ta9 1 0.33333300 0.66666700 0.00000000 1.0 Si Si10 1 0.59270308 1.00000000 0.76136783 1.0 Si Si11 1 0.40729692 0.00000000 0.23863217 1.0 Si Si12 1 1.00000000 0.59270308 0.76136783 1.0 Si Si13 1 0.00000000 0.40729692 0.23863217 1.0 Si Si14 1 0.40729692 0.40729692 0.76136783 1.0 Si Si15 1 0.59270308 0.59270308 0.23863217 1.0 N N16 1 0.00000000 0.00000000 0.50000000 1.0 N N17 1 0.00000000 0.00000000 0.00000000 1.0