# generated using pymatgen data_Na2Ta3Ni9As7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.56943307 _cell_length_b 9.56943235 _cell_length_c 3.76386492 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000587 _symmetry_Int_Tables_number 1 _chemical_formula_structural Na2Ta3Ni9As7 _chemical_formula_sum 'Na2 Ta3 Ni9 As7' _cell_volume 298.49497292 _cell_formula_units_Z 1 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 Na Na0 1 0.33333300 0.66666700 0.00000000 1.0 Na Na1 1 0.66666700 0.33333300 0.50000000 1.0 Ta Ta2 1 0.22363510 0.12244258 0.50000000 1.0 Ta Ta3 1 0.87755742 0.10119252 0.50000000 1.0 Ta Ta4 1 0.89880748 0.77636490 0.50000000 1.0 Ni Ni5 1 0.12537629 0.28240829 0.00000000 1.0 Ni Ni6 1 0.71759171 0.84296800 0.00000000 1.0 Ni Ni7 1 0.15703200 0.87462371 0.00000000 1.0 Ni Ni8 1 0.42309115 0.36059404 0.00000000 1.0 Ni Ni9 1 0.63940596 0.06249812 0.00000000 1.0 Ni Ni10 1 0.93750188 0.57690885 0.00000000 1.0 Ni Ni11 1 0.05447182 0.43126000 0.50000000 1.0 Ni Ni12 1 0.56874000 0.62321183 0.50000000 1.0 Ni Ni13 1 0.37678817 0.94552818 0.50000000 1.0 As As14 1 0.29730207 0.42086178 0.50000000 1.0 As As15 1 0.57913822 0.87644029 0.50000000 1.0 As As16 1 0.12355971 0.70269793 0.50000000 1.0 As As17 1 0.42196557 0.11286596 0.00000000 1.0 As As18 1 0.88713404 0.30909961 0.00000000 1.0 As As19 1 0.69090039 0.57803443 0.00000000 1.0 As As20 1 0.00000000 0.00000000 0.00000000 1.0