# generated using pymatgen data_Be3N2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.03862673 _cell_length_b 7.03862520 _cell_length_c 7.03862696 _cell_angle_alpha 109.47123142 _cell_angle_beta 109.47122702 _cell_angle_gamma 109.47121050 _symmetry_Int_Tables_number 1 _chemical_formula_structural Be3N2 _chemical_formula_sum 'Be24 N16' _cell_volume 268.43664046 _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 Be Be0 1 0.52653725 0.76621634 0.53093266 1.0 Be Be1 1 0.99560459 0.96906734 0.73528368 1.0 Be Be2 1 0.26032191 0.76471632 0.73378366 1.0 Be Be3 1 0.50439541 0.23967809 0.97346275 1.0 Be Be4 1 0.96906734 0.73528368 0.99560459 1.0 Be Be5 1 0.73378366 0.26032191 0.76471632 1.0 Be Be6 1 0.23967809 0.97346275 0.50439541 1.0 Be Be7 1 0.53093266 0.52653725 0.76621634 1.0 Be Be8 1 0.76621634 0.53093266 0.52653725 1.0 Be Be9 1 0.73528368 0.99560459 0.96906734 1.0 Be Be10 1 0.76471632 0.73378366 0.26032191 1.0 Be Be11 1 0.97346275 0.50439541 0.23967809 1.0 Be Be12 1 0.47346275 0.23378366 0.46906734 1.0 Be Be13 1 0.00439541 0.03093266 0.26471632 1.0 Be Be14 1 0.73967809 0.23528368 0.26621634 1.0 Be Be15 1 0.49560459 0.76032191 0.02653725 1.0 Be Be16 1 0.03093266 0.26471632 0.00439541 1.0 Be Be17 1 0.26621634 0.73967809 0.23528368 1.0 Be Be18 1 0.76032191 0.02653725 0.49560459 1.0 Be Be19 1 0.46906734 0.47346275 0.23378366 1.0 Be Be20 1 0.23378366 0.46906734 0.47346275 1.0 Be Be21 1 0.26471632 0.00439541 0.03093266 1.0 Be Be22 1 0.23528368 0.26621634 0.73967809 1.0 Be Be23 1 0.02653725 0.49560459 0.76032191 1.0 N N24 1 0.25000000 0.22875652 0.97875652 1.0 N N25 1 0.27124348 0.52124348 0.75000000 1.0 N N26 1 0.52124348 0.75000000 0.27124348 1.0 N N27 1 0.22875652 0.97875652 0.25000000 1.0 N N28 1 0.97875652 0.25000000 0.22875652 1.0 N N29 1 0.75000000 0.27124348 0.52124348 1.0 N N30 1 0.75000000 0.77124348 0.02124348 1.0 N N31 1 0.72875652 0.47875652 0.25000000 1.0 N N32 1 0.47875652 0.25000000 0.72875652 1.0 N N33 1 0.77124348 0.02124348 0.75000000 1.0 N N34 1 0.02124348 0.75000000 0.77124348 1.0 N N35 1 0.25000000 0.72875652 0.47875652 1.0 N N36 1 0.50000000 0.50000000 0.50000000 1.0 N N37 1 0.00000000 0.00000000 0.50000000 1.0 N N38 1 0.50000000 0.00000000 0.00000000 1.0 N N39 1 0.00000000 0.50000000 0.00000000 1.0