# generated using pymatgen data_SrNi5N4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.45534300 _cell_length_b 5.56612600 _cell_length_c 5.21181500 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural SrNi5N4 _chemical_formula_sum 'Sr2 Ni10 N8' _cell_volume 245.28627876 _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 Sr Sr0 1 0.75000000 0.25000000 0.85087000 1.0 Sr Sr1 1 0.25000000 0.75000000 0.14913000 1.0 Ni Ni2 1 0.59497500 0.51904800 0.34273800 1.0 Ni Ni3 1 0.90502500 0.51904800 0.34273800 1.0 Ni Ni4 1 0.59497500 0.98095200 0.34273800 1.0 Ni Ni5 1 0.90502500 0.98095200 0.34273800 1.0 Ni Ni6 1 0.40502500 0.48095200 0.65726200 1.0 Ni Ni7 1 0.09497500 0.48095200 0.65726200 1.0 Ni Ni8 1 0.40502500 0.01904800 0.65726200 1.0 Ni Ni9 1 0.09497500 0.01904800 0.65726200 1.0 Ni Ni10 1 0.75000000 0.75000000 0.69973800 1.0 Ni Ni11 1 0.25000000 0.25000000 0.30026200 1.0 N N12 1 0.75000000 0.86941900 0.09985700 1.0 N N13 1 0.75000000 0.63058100 0.09985700 1.0 N N14 1 0.25000000 0.13058100 0.90014300 1.0 N N15 1 0.25000000 0.36941900 0.90014300 1.0 N N16 1 0.53374500 0.75000000 0.62322300 1.0 N N17 1 0.96625500 0.75000000 0.62322300 1.0 N N18 1 0.46625500 0.25000000 0.37677700 1.0 N N19 1 0.03374500 0.25000000 0.37677700 1.0