# generated using pymatgen data_Li2(Al3Ni)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.17859118 _cell_length_b 7.17859119 _cell_length_c 9.09257421 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.81271150 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li2(Al3Ni)3 _chemical_formula_sum 'Li4 Al18 Ni6' _cell_volume 406.54858967 _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 Li Li0 1 0.99986531 0.67125026 0.25000000 1.0 Li Li1 1 0.00013469 0.32874974 0.75000000 1.0 Li Li2 1 0.67125026 0.99986531 0.25000000 1.0 Li Li3 1 0.32874974 0.00013469 0.75000000 1.0 Al Al4 1 0.99324644 0.33390199 0.07448338 1.0 Al Al5 1 0.00675356 0.66609801 0.92551662 1.0 Al Al6 1 0.00675356 0.66609801 0.57448338 1.0 Al Al7 1 0.33390199 0.99324644 0.42551662 1.0 Al Al8 1 0.99324644 0.33390199 0.42551662 1.0 Al Al9 1 0.66609801 0.00675356 0.57448338 1.0 Al Al10 1 0.66609801 0.00675356 0.92551662 1.0 Al Al11 1 0.33390199 0.99324644 0.07448338 1.0 Al Al12 1 0.33799718 0.56806460 0.25000000 1.0 Al Al13 1 0.66200282 0.43193540 0.75000000 1.0 Al Al14 1 0.56806460 0.33799718 0.25000000 1.0 Al Al15 1 0.43193540 0.66200282 0.75000000 1.0 Al Al16 1 0.32766066 0.32766066 0.55627717 1.0 Al Al17 1 0.67233934 0.67233934 0.44372283 1.0 Al Al18 1 0.67233934 0.67233934 0.05627717 1.0 Al Al19 1 0.32766066 0.32766066 0.94372283 1.0 Al Al20 1 0.10485846 0.10485846 0.25000000 1.0 Al Al21 1 0.89514154 0.89514154 0.75000000 1.0 Ni Ni22 1 0.66927366 0.33072634 0.00000000 1.0 Ni Ni23 1 0.33072634 0.66927366 0.00000000 1.0 Ni Ni24 1 0.33072634 0.66927366 0.50000000 1.0 Ni Ni25 1 0.66927366 0.33072634 0.50000000 1.0 Ni Ni26 1 0.00000000 0.00000000 0.00000000 1.0 Ni Ni27 1 0.00000000 0.00000000 0.50000000 1.0