# generated using pymatgen data_Ta6Zn5GaN _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.11314752 _cell_length_b 8.12083076 _cell_length_c 8.12082963 _cell_angle_alpha 60.08083129 _cell_angle_beta 60.03128497 _cell_angle_gamma 60.03129096 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta6Zn5GaN _chemical_formula_sum 'Ta12 Zn10 Ga2 N2' _cell_volume 378.74360596 _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 Ta Ta0 1 0.19035604 0.80969309 0.18945488 1.0 Ta Ta1 1 0.43950501 0.06054512 0.44030691 1.0 Ta Ta2 1 0.43946613 0.05941357 0.06165416 1.0 Ta Ta3 1 0.43973676 0.44049011 0.06131402 1.0 Ta Ta4 1 0.19061539 0.80934751 0.80942171 1.0 Ta Ta5 1 0.05845911 0.44049011 0.06131402 1.0 Ta Ta6 1 0.81049499 0.80969309 0.18945488 1.0 Ta Ta7 1 0.05938461 0.44057829 0.44065249 1.0 Ta Ta8 1 0.19154089 0.18868598 0.80950989 1.0 Ta Ta9 1 0.81053387 0.18834584 0.19058643 1.0 Ta Ta10 1 0.81026324 0.18868598 0.80950989 1.0 Ta Ta11 1 0.05964396 0.06054512 0.44030691 1.0 Zn Zn12 1 0.75037620 0.41646087 0.41641036 1.0 Zn Zn13 1 0.41674957 0.41646087 0.41641036 1.0 Zn Zn14 1 0.83386390 0.83418627 0.49808693 1.0 Zn Zn15 1 0.41613610 0.75191307 0.41581373 1.0 Zn Zn16 1 0.83325043 0.83358964 0.83353913 1.0 Zn Zn17 1 0.49962380 0.83358964 0.83353913 1.0 Zn Zn18 1 0.62664327 0.12357150 0.62314297 1.0 Zn Zn19 1 0.62335673 0.62685703 0.12642850 1.0 Zn Zn20 1 0.12500000 0.62845232 0.62154768 1.0 Zn Zn21 1 0.62500000 0.62845232 0.62154768 1.0 Ga Ga22 1 0.83465555 0.49527911 0.83541280 1.0 Ga Ga23 1 0.41534445 0.41458720 0.75472089 1.0 N N24 1 0.00090324 0.99914045 0.99905308 1.0 N N25 1 0.24909676 0.25094692 0.25085955 1.0