# generated using pymatgen data_YbSmSiN3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.85966020 _cell_length_b 5.85965886 _cell_length_c 11.37625223 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 125.82855802 _symmetry_Int_Tables_number 1 _chemical_formula_structural YbSmSiN3 _chemical_formula_sum 'Yb4 Sm4 Si4 N12' _cell_volume 316.69616429 _cell_formula_units_Z 4 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 Yb Yb0 1 0.04983940 0.95016060 0.85676120 1.0 Yb Yb1 1 0.95016060 0.04983940 0.14323880 1.0 Yb Yb2 1 0.45016060 0.54983940 0.35676120 1.0 Yb Yb3 1 0.54983940 0.45016060 0.64323880 1.0 Sm Sm4 1 0.64062071 0.35937929 0.07931697 1.0 Sm Sm5 1 0.35937929 0.64062071 0.92068303 1.0 Sm Sm6 1 0.85937929 0.14062071 0.57931697 1.0 Sm Sm7 1 0.14062071 0.85937929 0.42068303 1.0 Si Si8 1 0.73965618 0.26034382 0.83701368 1.0 Si Si9 1 0.26034382 0.73965618 0.16298632 1.0 Si Si10 1 0.76034382 0.23965618 0.33701368 1.0 Si Si11 1 0.23965618 0.76034382 0.66298632 1.0 N N12 1 0.57610993 0.42389007 0.86758111 1.0 N N13 1 0.42389007 0.57610993 0.13241889 1.0 N N14 1 0.92389007 0.07610993 0.36758111 1.0 N N15 1 0.07610993 0.92389007 0.63241889 1.0 N N16 1 0.52902825 0.97097175 0.75000000 1.0 N N17 1 0.97097175 0.52902825 0.25000000 1.0 N N18 1 0.47097175 0.02902825 0.25000000 1.0 N N19 1 0.02902825 0.47097175 0.75000000 1.0 N N20 1 0.84193572 0.15806428 0.95766425 1.0 N N21 1 0.15806428 0.84193572 0.04233575 1.0 N N22 1 0.65806428 0.34193572 0.45766425 1.0 N N23 1 0.34193572 0.65806428 0.54233575 1.0