# generated using pymatgen data_Li3Hf2Ni9P7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.05752105 _cell_length_b 9.06311175 _cell_length_c 3.63738816 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.85932546 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li3Hf2Ni9P7 _chemical_formula_sum 'Li3 Hf2 Ni9 P7' _cell_volume 258.95294202 _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 Li Li0 1 0.44078733 0.21320422 0.50000000 1.0 Li Li1 1 0.78082749 0.22180353 0.50000000 1.0 Li Li2 1 0.00447191 0.00698344 0.50000000 1.0 Hf Hf3 1 0.76973514 0.55442380 0.50000000 1.0 Hf Hf4 1 0.32798094 0.66658993 0.00000000 1.0 Ni Ni5 1 0.27162057 0.38016523 0.50000000 1.0 Ni Ni6 1 0.61977274 0.89270942 0.50000000 1.0 Ni Ni7 1 0.11578583 0.72567207 0.50000000 1.0 Ni Ni8 1 0.49580063 0.45585765 0.00000000 1.0 Ni Ni9 1 0.54590948 0.04181426 0.00000000 1.0 Ni Ni10 1 0.95908801 0.49766446 0.00000000 1.0 Ni Ni11 1 0.72872325 0.76514163 0.00000000 1.0 Ni Ni12 1 0.24403765 0.97186898 0.00000000 1.0 Ni Ni13 1 0.03490576 0.27168545 0.00000000 1.0 P P14 1 0.98200593 0.76560560 0.00000000 1.0 P P15 1 0.24122617 0.21442666 0.00000000 1.0 P P16 1 0.78646806 0.02963052 0.00000000 1.0 P P17 1 0.66312547 0.32582309 0.00000000 1.0 P P18 1 0.52657176 0.62012060 0.50000000 1.0 P P19 1 0.38343750 0.92094375 0.50000000 1.0 P P20 1 0.07772136 0.45786572 0.50000000 1.0