# generated using pymatgen data_Er8Sc3Si16Mo9 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.93587383 _cell_length_b 6.93587346 _cell_length_c 12.77613210 _cell_angle_alpha 90.00889783 _cell_angle_beta 89.99109816 _cell_angle_gamma 89.82941904 _symmetry_Int_Tables_number 1 _chemical_formula_structural Er8Sc3Si16Mo9 _chemical_formula_sum 'Er8 Sc3 Si16 Mo9' _cell_volume 614.61025765 _cell_formula_units_Z 1 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 0.33813258 0.00333120 0.46782939 1.0 Er Er1 1 0.49601240 0.83961093 0.71959534 1.0 Er Er2 1 0.49970108 0.16227308 0.21524518 1.0 Er Er3 1 0.83961093 0.49601240 0.28040466 1.0 Er Er4 1 0.16227308 0.49970108 0.78475482 1.0 Er Er5 1 0.65720273 0.00097859 0.96890631 1.0 Er Er6 1 0.00333120 0.33813258 0.53217061 1.0 Er Er7 1 0.00097859 0.65720273 0.03109369 1.0 Sc Sc8 1 0.16981140 0.83071198 0.24791100 1.0 Sc Sc9 1 0.83071198 0.16981140 0.75208900 1.0 Sc Sc10 1 0.66801674 0.66801674 0.50000000 1.0 Si Si11 1 0.20566503 0.12927346 0.68300504 1.0 Si Si12 1 0.37417534 0.69954694 0.93363758 1.0 Si Si13 1 0.62863283 0.29368189 0.43153312 1.0 Si Si14 1 0.69954694 0.37417534 0.06636242 1.0 Si Si15 1 0.29368189 0.62863283 0.56846688 1.0 Si Si16 1 0.79396953 0.87144106 0.18212816 1.0 Si Si17 1 0.12927346 0.20566503 0.31699496 1.0 Si Si18 1 0.87144106 0.79396953 0.81787184 1.0 Si Si19 1 0.28747789 0.96623738 0.05832402 1.0 Si Si20 1 0.54274011 0.79076473 0.30968113 1.0 Si Si21 1 0.45362664 0.21202736 0.81631369 1.0 Si Si22 1 0.79076473 0.54274011 0.69031887 1.0 Si Si23 1 0.21202736 0.45362664 0.18368631 1.0 Si Si24 1 0.70817157 0.04359724 0.56090263 1.0 Si Si25 1 0.96623738 0.28747789 0.94167598 1.0 Si Si26 1 0.04359724 0.70817157 0.43909737 1.0 Mo Mo27 1 0.33224151 0.33224151 0.00000000 1.0 Mo Mo28 1 0.15670360 0.00077296 0.87306420 1.0 Mo Mo29 1 0.49696348 0.66411411 0.12194057 1.0 Mo Mo30 1 0.50191790 0.34196642 0.62448888 1.0 Mo Mo31 1 0.66411411 0.49696348 0.87805943 1.0 Mo Mo32 1 0.34196642 0.50191790 0.37551112 1.0 Mo Mo33 1 0.84265859 0.99585172 0.37380052 1.0 Mo Mo34 1 0.00077296 0.15670360 0.12693580 1.0 Mo Mo35 1 0.99585172 0.84265859 0.62619948 1.0