# generated using pymatgen data_Hf3Ti5Al15Ru7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.67830150 _cell_length_b 8.67396586 _cell_length_c 8.67831529 _cell_angle_alpha 120.12502933 _cell_angle_beta 119.93990496 _cell_angle_gamma 89.95826322 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf3Ti5Al15Ru7 _chemical_formula_sum 'Hf3 Ti5 Al15 Ru7' _cell_volume 461.64000553 _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 Hf Hf0 1 0.80001068 0.28545510 0.07346382 1.0 Hf Hf1 1 0.21199553 0.28544663 0.48544399 1.0 Hf Hf2 1 0.20973377 0.70331576 0.49359711 1.0 Ti Ti3 1 0.22422212 0.72784873 0.94086587 1.0 Ti Ti4 1 0.78698685 0.72784399 0.50363606 1.0 Ti Ti5 1 0.77500926 0.27179425 0.49677246 1.0 Ti Ti6 1 0.37776636 0.12213894 0.74435405 1.0 Ti Ti7 1 0.38244886 0.63955246 0.25714223 1.0 Al Al8 1 0.98655509 0.50417070 0.51762964 1.0 Al Al9 1 0.16847102 0.33294525 0.16446416 1.0 Al Al10 1 0.15572748 0.97288767 0.81714527 1.0 Al Al11 1 0.15158851 0.34750924 0.80984432 1.0 Al Al12 1 0.53765866 0.34749180 0.19590070 1.0 Al Al13 1 0.84708153 0.65239138 0.80533214 1.0 Al Al14 1 0.83684593 0.02028934 0.18341994 1.0 Al Al15 1 0.83532739 0.66172239 0.18055002 1.0 Al Al16 1 0.48117662 0.66171430 0.82638602 1.0 Al Al17 1 0.38310065 0.11943190 0.25696667 1.0 Al Al18 1 0.86245435 0.11943839 0.73631892 1.0 Al Al19 1 0.61916904 0.87789443 0.25872387 1.0 Al Al20 1 0.62106964 0.36460789 0.74354343 1.0 Al Al21 1 0.62082907 0.87588946 0.74135473 1.0 Al Al22 1 0.13453599 0.87589105 0.25506573 1.0 Ru Ru23 1 0.99970883 0.00010415 0.50257352 1.0 Ru Ru24 1 0.49752658 0.00010240 0.00037996 1.0 Ru Ru25 1 0.49748227 0.49908274 0.00161964 1.0 Ru Ru26 1 0.49788752 0.50020032 0.50118123 1.0 Ru Ru27 1 0.99899469 0.50019187 0.00232149 1.0 Ru Ru28 1 0.99982629 0.00294458 0.00309051 1.0 Ru Ru29 1 0.49880641 0.99969991 0.50091449 1.0