# generated using pymatgen data_Sr(NiB)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.24972800 _cell_length_b 6.28179000 _cell_length_c 13.38479500 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sr(NiB)2 _chemical_formula_sum 'Sr4 Ni8 B8' _cell_volume 273.23866211 _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 Sr Sr0 1 0.50000000 0.64137700 0.39826900 1.0 Sr Sr1 1 0.50000000 0.35862300 0.60173100 1.0 Sr Sr2 1 0.00000000 0.85862300 0.89826900 1.0 Sr Sr3 1 0.00000000 0.14137700 0.10173100 1.0 Ni Ni4 1 0.50000000 0.69427600 0.13038900 1.0 Ni Ni5 1 0.50000000 0.30572400 0.86961100 1.0 Ni Ni6 1 0.00000000 0.80572400 0.63038900 1.0 Ni Ni7 1 0.00000000 0.19427600 0.36961100 1.0 Ni Ni8 1 0.50000000 0.62378100 0.75829200 1.0 Ni Ni9 1 0.50000000 0.37621900 0.24170800 1.0 Ni Ni10 1 0.00000000 0.87621900 0.25829200 1.0 Ni Ni11 1 0.00000000 0.12378100 0.74170800 1.0 B B12 1 0.50000000 0.07208500 0.44609100 1.0 B B13 1 0.50000000 0.92791500 0.55390900 1.0 B B14 1 0.00000000 0.42791500 0.94609100 1.0 B B15 1 0.00000000 0.57208500 0.05390900 1.0 B B16 1 0.50000000 0.06059500 0.30986400 1.0 B B17 1 0.50000000 0.93940500 0.69013600 1.0 B B18 1 0.00000000 0.43940500 0.80986400 1.0 B B19 1 0.00000000 0.56059500 0.19013600 1.0