# generated using pymatgen data_ErSi3Ni5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.77911700 _cell_length_b 6.64655500 _cell_length_c 18.67202500 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural ErSi3Ni5 _chemical_formula_sum 'Er4 Si12 Ni20' _cell_volume 469.00595905 _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 Er Er0 1 0.25000000 0.62230900 0.64407200 1.0 Er Er1 1 0.25000000 0.87769100 0.14407200 1.0 Er Er2 1 0.75000000 0.37769100 0.35592800 1.0 Er Er3 1 0.75000000 0.12230900 0.85592800 1.0 Si Si4 1 0.25000000 0.41312900 0.91497300 1.0 Si Si5 1 0.25000000 0.08687100 0.41497300 1.0 Si Si6 1 0.75000000 0.58687100 0.08502700 1.0 Si Si7 1 0.75000000 0.91312900 0.58502700 1.0 Si Si8 1 0.25000000 0.12115900 0.73757300 1.0 Si Si9 1 0.25000000 0.37884100 0.23757300 1.0 Si Si10 1 0.75000000 0.87884100 0.26242700 1.0 Si Si11 1 0.75000000 0.62115900 0.76242700 1.0 Si Si12 1 0.25000000 0.84693200 0.92457900 1.0 Si Si13 1 0.25000000 0.65306800 0.42457900 1.0 Si Si14 1 0.75000000 0.15306800 0.07542100 1.0 Si Si15 1 0.75000000 0.34693200 0.57542100 1.0 Ni Ni16 1 0.25000000 0.81588500 0.79978500 1.0 Ni Ni17 1 0.25000000 0.68411500 0.29978500 1.0 Ni Ni18 1 0.75000000 0.18411500 0.20021500 1.0 Ni Ni19 1 0.75000000 0.31588500 0.70021500 1.0 Ni Ni20 1 0.25000000 0.13147000 0.99460300 1.0 Ni Ni21 1 0.25000000 0.36853000 0.49460300 1.0 Ni Ni22 1 0.75000000 0.86853000 0.00539700 1.0 Ni Ni23 1 0.75000000 0.63147000 0.50539700 1.0 Ni Ni24 1 0.25000000 0.88188000 0.51377600 1.0 Ni Ni25 1 0.25000000 0.61812000 0.01377600 1.0 Ni Ni26 1 0.75000000 0.11812000 0.48622400 1.0 Ni Ni27 1 0.75000000 0.38188000 0.98622400 1.0 Ni Ni28 1 0.25000000 0.14335500 0.61447400 1.0 Ni Ni29 1 0.25000000 0.35664500 0.11447400 1.0 Ni Ni30 1 0.75000000 0.85664500 0.38552600 1.0 Ni Ni31 1 0.75000000 0.64335500 0.88552600 1.0 Ni Ni32 1 0.25000000 0.42917700 0.79429200 1.0 Ni Ni33 1 0.25000000 0.07082300 0.29429200 1.0 Ni Ni34 1 0.75000000 0.57082300 0.20570800 1.0 Ni Ni35 1 0.75000000 0.92917700 0.70570800 1.0