# generated using pymatgen data_Yb6Se3N2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.67328264 _cell_length_b 7.67328307 _cell_length_c 7.67328327 _cell_angle_alpha 93.04736096 _cell_angle_beta 93.04735221 _cell_angle_gamma 93.04735541 _symmetry_Int_Tables_number 1 _chemical_formula_structural Yb6Se3N2 _chemical_formula_sum 'Yb12 Se6 N4' _cell_volume 449.80981092 _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 Yb Yb0 1 0.40621437 0.21409265 0.52399664 1.0 Yb Yb1 1 0.52399664 0.40621437 0.21409265 1.0 Yb Yb2 1 0.21409265 0.52399664 0.40621437 1.0 Yb Yb3 1 0.71409265 0.90621437 0.02399664 1.0 Yb Yb4 1 0.02399664 0.71409265 0.90621437 1.0 Yb Yb5 1 0.90621437 0.02399664 0.71409265 1.0 Yb Yb6 1 0.59378563 0.78590735 0.47600336 1.0 Yb Yb7 1 0.47600336 0.59378563 0.78590735 1.0 Yb Yb8 1 0.78590735 0.47600336 0.59378563 1.0 Yb Yb9 1 0.28590735 0.09378563 0.97600336 1.0 Yb Yb10 1 0.97600336 0.28590735 0.09378563 1.0 Yb Yb11 1 0.09378563 0.97600336 0.28590735 1.0 Se Se12 1 0.75000000 0.12942842 0.37057158 1.0 Se Se13 1 0.37057158 0.75000000 0.12942842 1.0 Se Se14 1 0.12942842 0.37057158 0.75000000 1.0 Se Se15 1 0.62942842 0.25000000 0.87057158 1.0 Se Se16 1 0.87057158 0.62942842 0.25000000 1.0 Se Se17 1 0.25000000 0.87057158 0.62942842 1.0 N N18 1 0.50000000 0.50000000 0.50000000 1.0 N N19 1 0.00000000 0.00000000 0.00000000 1.0 N N20 1 0.25000000 0.25000000 0.25000000 1.0 N N21 1 0.75000000 0.75000000 0.75000000 1.0