# generated using pymatgen data_Ta3Zn3C _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.25259339 _cell_length_b 8.25259345 _cell_length_c 8.25259388 _cell_angle_alpha 119.97541065 _cell_angle_beta 120.02378457 _cell_angle_gamma 90.00069929 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta3Zn3C _chemical_formula_sum 'Ta12 Zn12 C4' _cell_volume 397.42842858 _cell_formula_units_Z 4 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 0.55528400 0.05528400 0.50000000 1.0 Ta Ta1 1 0.19467200 0.69467200 0.50000000 1.0 Ta Ta2 1 0.19449137 0.05509891 0.49997757 1.0 Ta Ta3 1 0.55512235 0.69451481 0.50002243 1.0 Ta Ta4 1 0.55512235 0.05509891 0.86060754 1.0 Ta Ta5 1 0.19449137 0.69451481 0.13939246 1.0 Ta Ta6 1 0.94453655 0.94453655 1.00000000 1.0 Ta Ta7 1 0.30521327 0.30521327 0.00000000 1.0 Ta Ta8 1 0.30546878 0.94491510 0.00020606 1.0 Ta Ta9 1 0.94471104 0.30526372 0.99979394 1.0 Ta Ta10 1 0.94471104 0.94491510 0.63944733 1.0 Ta Ta11 1 0.30546878 0.30526372 0.36055267 1.0 Zn Zn12 1 0.75029186 0.50024089 0.25004997 1.0 Zn Zn13 1 0.25019092 0.50024089 0.74995003 1.0 Zn Zn14 1 0.75004312 0.49999027 0.74994715 1.0 Zn Zn15 1 0.75004312 0.00009596 0.25005285 1.0 Zn Zn16 1 0.95713991 0.29324396 0.66389594 1.0 Zn Zn17 1 0.62934602 0.29324396 0.33610406 1.0 Zn Zn18 1 0.95717399 0.29297740 0.33580341 1.0 Zn Zn19 1 0.95717399 0.62137058 0.66419659 1.0 Zn Zn20 1 0.54326632 0.70699114 0.83627517 1.0 Zn Zn21 1 0.87071597 0.70699114 0.16372483 1.0 Zn Zn22 1 0.54288889 0.70710751 0.16421861 1.0 Zn Zn23 1 0.54288889 0.37867028 0.83578139 1.0 C C24 1 0.24987919 0.99988904 0.24999115 1.0 C C25 1 0.74989789 0.99988904 0.75000885 1.0 C C26 1 0.24988452 0.99990778 0.75002327 1.0 C C27 1 0.24988452 0.49986125 0.24997673 1.0