# generated using pymatgen data_LiNd2C3O _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.88844229 _cell_length_b 6.88844229 _cell_length_c 3.93913474 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiNd2C3O _chemical_formula_sum 'Li2 Nd4 C6 O2' _cell_volume 186.91445314 _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 0.50000000 0.50000000 0.00000000 1.0 Li Li1 1 0.00000000 0.00000000 0.00000000 1.0 Nd Nd2 1 0.68061663 0.18061663 0.50000000 1.0 Nd Nd3 1 0.31938337 0.81938337 0.50000000 1.0 Nd Nd4 1 0.18061663 0.31938337 0.50000000 1.0 Nd Nd5 1 0.81938337 0.68061663 0.50000000 1.0 C C6 1 0.13516497 0.63516497 0.00000000 1.0 C C7 1 0.86483503 0.36483503 0.00000000 1.0 C C8 1 0.63516497 0.86483503 0.00000000 1.0 C C9 1 0.36483503 0.13516497 0.00000000 1.0 C C10 1 0.50000000 0.00000000 0.00000000 1.0 C C11 1 0.00000000 0.50000000 0.00000000 1.0 O O12 1 0.50000000 0.50000000 0.50000000 1.0 O O13 1 0.00000000 0.00000000 0.50000000 1.0