# generated using pymatgen data_Li3YN2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.11388334 _cell_length_b 9.11388334 _cell_length_c 9.11388334 _cell_angle_alpha 109.47122063 _cell_angle_beta 109.47122063 _cell_angle_gamma 109.47122063 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li3YN2 _chemical_formula_sum 'Li24 Y8 N16' _cell_volume 582.75834992 _cell_formula_units_Z 8 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 0.55963200 0.50823900 0.27082000 1.0 Li Li1 1 0.76258100 0.99176100 0.55139300 1.0 Li Li2 1 0.73741900 0.28881200 0.22918000 1.0 Li Li3 1 0.94036800 0.21118800 0.94860700 1.0 Li Li4 1 0.55139300 0.76258100 0.99176100 1.0 Li Li5 1 0.27082000 0.55963200 0.50823900 1.0 Li Li6 1 0.94860700 0.94036800 0.21118800 1.0 Li Li7 1 0.22918000 0.73741900 0.28881200 1.0 Li Li8 1 0.28881200 0.22918000 0.73741900 1.0 Li Li9 1 0.21118800 0.94860700 0.94036800 1.0 Li Li10 1 0.50823900 0.27082000 0.55963200 1.0 Li Li11 1 0.99176100 0.55139300 0.76258100 1.0 Li Li12 1 0.44036800 0.49176100 0.72918000 1.0 Li Li13 1 0.23741900 0.00823900 0.44860700 1.0 Li Li14 1 0.26258100 0.71118800 0.77082000 1.0 Li Li15 1 0.05963200 0.78881200 0.05139300 1.0 Li Li16 1 0.44860700 0.23741900 0.00823900 1.0 Li Li17 1 0.72918000 0.44036800 0.49176100 1.0 Li Li18 1 0.05139300 0.05963200 0.78881200 1.0 Li Li19 1 0.77082000 0.26258100 0.71118800 1.0 Li Li20 1 0.71118800 0.77082000 0.26258100 1.0 Li Li21 1 0.78881200 0.05139300 0.05963200 1.0 Li Li22 1 0.49176100 0.72918000 0.44036800 1.0 Li Li23 1 0.00823900 0.44860700 0.23741900 1.0 Y Y24 1 0.25147300 0.25147300 0.25147300 1.0 Y Y25 1 0.00000000 0.24852700 0.50000000 1.0 Y Y26 1 0.50000000 0.00000000 0.24852700 1.0 Y Y27 1 0.24852700 0.50000000 0.00000000 1.0 Y Y28 1 0.74852700 0.74852700 0.74852700 1.0 Y Y29 1 0.00000000 0.75147300 0.50000000 1.0 Y Y30 1 0.50000000 0.00000000 0.75147300 1.0 Y Y31 1 0.75147300 0.50000000 0.00000000 1.0 N N32 1 0.00000000 0.00000000 0.00000000 1.0 N N33 1 0.00000000 0.50000000 0.50000000 1.0 N N34 1 0.50000000 0.00000000 0.50000000 1.0 N N35 1 0.50000000 0.50000000 0.00000000 1.0 N N36 1 0.25220700 0.25000000 0.50220700 1.0 N N37 1 0.24779300 0.75000000 0.99779300 1.0 N N38 1 0.50220700 0.25220700 0.25000000 1.0 N N39 1 0.99779300 0.24779300 0.75000000 1.0 N N40 1 0.75000000 0.99779300 0.24779300 1.0 N N41 1 0.25000000 0.50220700 0.25220700 1.0 N N42 1 0.74779300 0.75000000 0.49779300 1.0 N N43 1 0.75220700 0.25000000 0.00220700 1.0 N N44 1 0.49779300 0.74779300 0.75000000 1.0 N N45 1 0.00220700 0.75220700 0.25000000 1.0 N N46 1 0.25000000 0.00220700 0.75220700 1.0 N N47 1 0.75000000 0.49779300 0.74779300 1.0