# generated using pymatgen data_Ta8Nb(NiP2)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.43224910 _cell_length_b 11.43224910 _cell_length_c 3.45404926 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta8Nb(NiP2)2 _chemical_formula_sum 'Ta16 Nb2 Ni4 P8' _cell_volume 451.43152523 _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 0.10335964 0.18516094 0.50000000 1.0 Ta Ta1 1 0.18516094 0.89664036 0.50000000 1.0 Ta Ta2 1 0.81483906 0.10335964 0.50000000 1.0 Ta Ta3 1 0.89664036 0.81483906 0.50000000 1.0 Ta Ta4 1 0.39664036 0.68516094 0.50000000 1.0 Ta Ta5 1 0.60335964 0.31483906 0.50000000 1.0 Ta Ta6 1 0.68516094 0.60335964 0.50000000 1.0 Ta Ta7 1 0.31483906 0.39664036 0.50000000 1.0 Ta Ta8 1 0.10166133 0.39833867 0.00000000 1.0 Ta Ta9 1 0.39833867 0.89833867 0.00000000 1.0 Ta Ta10 1 0.60166133 0.10166133 0.00000000 1.0 Ta Ta11 1 0.89833867 0.60166133 0.00000000 1.0 Ta Ta12 1 0.39335531 0.10664469 0.50000000 1.0 Ta Ta13 1 0.10664469 0.60664469 0.50000000 1.0 Ta Ta14 1 0.89335531 0.39335531 0.50000000 1.0 Ta Ta15 1 0.60664469 0.89335531 0.50000000 1.0 Nb Nb16 1 0.00000000 0.00000000 0.00000000 1.0 Nb Nb17 1 0.50000000 0.50000000 0.00000000 1.0 Ni Ni18 1 0.26503542 0.23496458 0.00000000 1.0 Ni Ni19 1 0.23496458 0.73496458 0.00000000 1.0 Ni Ni20 1 0.76503542 0.26503542 0.00000000 1.0 Ni Ni21 1 0.73496458 0.76503542 0.00000000 1.0 P P22 1 0.22650640 0.05282388 0.00000000 1.0 P P23 1 0.05282388 0.77349360 0.00000000 1.0 P P24 1 0.94717612 0.22650640 0.00000000 1.0 P P25 1 0.77349360 0.94717612 0.00000000 1.0 P P26 1 0.27349360 0.55282388 0.00000000 1.0 P P27 1 0.72650640 0.44717612 0.00000000 1.0 P P28 1 0.55282388 0.72650640 0.00000000 1.0 P P29 1 0.44717612 0.27349360 0.00000000 1.0