# generated using pymatgen data_Ta3V2Ga3N _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.54940619 _cell_length_b 7.54940566 _cell_length_c 5.07683576 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000234 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta3V2Ga3N _chemical_formula_sum 'Ta6 V4 Ga6 N2' _cell_volume 250.58166490 _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 0.23572522 0.00000000 0.25000000 1.0 Ta Ta1 1 0.76427478 0.00000000 0.75000000 1.0 Ta Ta2 1 0.00000000 0.23572522 0.25000000 1.0 Ta Ta3 1 1.00000000 0.76427478 0.75000000 1.0 Ta Ta4 1 0.76427478 0.76427478 0.25000000 1.0 Ta Ta5 1 0.23572522 0.23572522 0.75000000 1.0 V V6 1 0.33333300 0.66666700 0.00000000 1.0 V V7 1 0.66666700 0.33333300 0.00000000 1.0 V V8 1 0.66666700 0.33333300 0.50000000 1.0 V V9 1 0.33333300 0.66666700 0.50000000 1.0 Ga Ga10 1 0.58710269 0.00000000 0.25000000 1.0 Ga Ga11 1 0.41289731 0.00000000 0.75000000 1.0 Ga Ga12 1 1.00000000 0.58710269 0.25000000 1.0 Ga Ga13 1 0.00000000 0.41289731 0.75000000 1.0 Ga Ga14 1 0.41289731 0.41289731 0.25000000 1.0 Ga Ga15 1 0.58710269 0.58710269 0.75000000 1.0 N N16 1 0.00000000 0.00000000 0.00000000 1.0 N N17 1 0.00000000 0.00000000 0.50000000 1.0