# generated using pymatgen data_Er8Ti3Si16Mo9 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.86456943 _cell_length_b 6.86456943 _cell_length_c 12.69257900 _cell_angle_alpha 90.03818678 _cell_angle_beta 89.96181322 _cell_angle_gamma 89.69184512 _symmetry_Int_Tables_number 1 _chemical_formula_structural Er8Ti3Si16Mo9 _chemical_formula_sum 'Er8 Ti3 Si16 Mo9' _cell_volume 598.09476900 _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 0.33951306 0.00133703 0.46873802 1.0 Er Er1 1 0.49828045 0.83941316 0.71917029 1.0 Er Er2 1 0.49878774 0.16179128 0.21719172 1.0 Er Er3 1 0.83941316 0.49828045 0.28082971 1.0 Er Er4 1 0.16179128 0.49878774 0.78280828 1.0 Er Er5 1 0.65904277 0.00097189 0.96885821 1.0 Er Er6 1 0.00133703 0.33951306 0.53126198 1.0 Er Er7 1 0.00097189 0.65904277 0.03114179 1.0 Ti Ti8 1 0.16918554 0.83229243 0.24858313 1.0 Ti Ti9 1 0.83229243 0.16918554 0.75141687 1.0 Ti Ti10 1 0.66757069 0.66757069 0.50000000 1.0 Si Si11 1 0.20246828 0.12942768 0.68339806 1.0 Si Si12 1 0.37347224 0.69830339 0.93383458 1.0 Si Si13 1 0.62917573 0.29744321 0.43328135 1.0 Si Si14 1 0.69830339 0.37347224 0.06616542 1.0 Si Si15 1 0.29744321 0.62917573 0.56671865 1.0 Si Si16 1 0.79598264 0.87134935 0.18387037 1.0 Si Si17 1 0.12942768 0.20246828 0.31660194 1.0 Si Si18 1 0.87134935 0.79598264 0.81612963 1.0 Si Si19 1 0.28818358 0.96425993 0.06115550 1.0 Si Si20 1 0.53887500 0.79198606 0.31290951 1.0 Si Si21 1 0.45899356 0.21025408 0.81489526 1.0 Si Si22 1 0.79198606 0.53887500 0.68709049 1.0 Si Si23 1 0.21025408 0.45899356 0.18510474 1.0 Si Si24 1 0.70920505 0.03962582 0.56294733 1.0 Si Si25 1 0.96425993 0.28818358 0.93884450 1.0 Si Si26 1 0.03962582 0.70920505 0.43705267 1.0 Mo Mo27 1 0.33147443 0.33147443 0.00000000 1.0 Mo Mo28 1 0.15531707 0.00117742 0.87261678 1.0 Mo Mo29 1 0.49611845 0.66636335 0.12464997 1.0 Mo Mo30 1 0.50574020 0.34153903 0.62415655 1.0 Mo Mo31 1 0.66636335 0.49611845 0.87535003 1.0 Mo Mo32 1 0.34153903 0.50574020 0.37584345 1.0 Mo Mo33 1 0.84150440 0.99357501 0.37361332 1.0 Mo Mo34 1 0.00117742 0.15531707 0.12738322 1.0 Mo Mo35 1 0.99357501 0.84150440 0.62638668 1.0