# generated using pymatgen data_Ta6V5GeN2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.21652844 _cell_length_b 8.17412816 _cell_length_c 8.26146198 _cell_angle_alpha 90.00000000 _cell_angle_beta 59.81893213 _cell_angle_gamma 119.82944350 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta6V5GeN2 _chemical_formula_sum 'Ta12 V10 Ge2 N4' _cell_volume 392.28220854 _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 0.62448294 0.81224247 0.43775753 1.0 Ta Ta1 1 0.87052218 0.43526159 0.81473841 1.0 Ta Ta2 1 0.25087777 0.81193809 0.81447136 1.0 Ta Ta3 1 0.25087777 0.43893968 0.43465187 1.0 Ta Ta4 1 0.25087777 0.43893968 0.81447136 1.0 Ta Ta5 1 0.25087777 0.81193809 0.43465187 1.0 Ta Ta6 1 0.37551706 0.18775753 0.56224247 1.0 Ta Ta7 1 0.12947782 0.56473841 0.18526159 1.0 Ta Ta8 1 0.74912223 0.18806191 0.18552864 1.0 Ta Ta9 1 0.74912223 0.56106032 0.56534813 1.0 Ta Ta10 1 0.74912223 0.56106032 0.18552864 1.0 Ta Ta11 1 0.74912223 0.18806191 0.56534813 1.0 V V12 1 0.09695876 0.88343037 0.20152162 1.0 V V13 1 0.09695876 0.21352738 0.20152162 1.0 V V14 1 0.41705320 0.20852660 0.87824929 1.0 V V15 1 0.41705320 0.20852660 0.20469751 1.0 V V16 1 0.90304124 0.11656963 0.79847838 1.0 V V17 1 0.90304124 0.78647262 0.79847838 1.0 V V18 1 0.58294680 0.79147340 0.12175071 1.0 V V19 1 0.58294680 0.79147340 0.79530249 1.0 V V20 1 0.50000000 0.50000000 0.00000000 1.0 V V21 1 0.50000000 0.00000000 0.00000000 1.0 Ge Ge22 1 0.00000000 0.00000000 0.50000000 1.0 Ge Ge23 1 0.00000000 0.00000000 0.00000000 1.0 N N24 1 0.50000000 0.00000000 0.50000000 1.0 N N25 1 0.50000000 0.50000000 0.50000000 1.0 N N26 1 0.00000000 0.50000000 0.00000000 1.0 N N27 1 0.00000000 0.50000000 0.50000000 1.0