# generated using pymatgen data_Hf6Zn5PdN2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.41738922 _cell_length_b 8.41738943 _cell_length_c 8.47004539 _cell_angle_alpha 60.20543634 _cell_angle_beta 60.20543386 _cell_angle_gamma 60.00000159 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf6Zn5PdN2 _chemical_formula_sum 'Hf12 Zn10 Pd2 N4' _cell_volume 425.66424135 _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 0.81392737 0.19209034 0.18005392 1.0 Hf Hf1 1 0.19209034 0.81392737 0.18005392 1.0 Hf Hf2 1 0.81392737 0.81392737 0.18005392 1.0 Hf Hf3 1 0.19014251 0.80844918 0.81126581 1.0 Hf Hf4 1 0.80844918 0.19014251 0.81126581 1.0 Hf Hf5 1 0.19014251 0.19014251 0.81126581 1.0 Hf Hf6 1 0.43647571 0.05834857 0.06870001 1.0 Hf Hf7 1 0.05834857 0.43647571 0.06870001 1.0 Hf Hf8 1 0.43647571 0.43647571 0.06870001 1.0 Hf Hf9 1 0.06245345 0.43715528 0.43793682 1.0 Hf Hf10 1 0.43715528 0.06245345 0.43793682 1.0 Hf Hf11 1 0.06245345 0.06245345 0.43793682 1.0 Zn Zn12 1 0.41774183 0.41774183 0.42103938 1.0 Zn Zn13 1 0.74347696 0.41774183 0.42103938 1.0 Zn Zn14 1 0.41774183 0.74347696 0.42103938 1.0 Zn Zn15 1 0.83429284 0.83429284 0.49712248 1.0 Zn Zn16 1 0.83226227 0.83226227 0.83117696 1.0 Zn Zn17 1 0.50429951 0.83226227 0.83117696 1.0 Zn Zn18 1 0.83226227 0.50429951 0.83117696 1.0 Zn Zn19 1 0.62879844 0.62879844 0.62063034 1.0 Zn Zn20 1 0.12177379 0.62879844 0.62063034 1.0 Zn Zn21 1 0.62879844 0.12177379 0.62063034 1.0 Pd Pd22 1 0.41325100 0.41325100 0.76024600 1.0 Pd Pd23 1 0.62467516 0.62467516 0.12597352 1.0 N N24 1 0.12454583 0.12454583 0.62636252 1.0 N N25 1 0.12477082 0.12477082 0.12596059 1.0 N N26 1 0.62449776 0.12477082 0.12596059 1.0 N N27 1 0.12477082 0.62449776 0.12596059 1.0