# generated using pymatgen data_Sc11Ga10 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.62139201 _cell_length_b 10.62139201 _cell_length_c 10.62139201 _cell_angle_alpha 121.39153962 _cell_angle_beta 121.39153962 _cell_angle_gamma 87.60622057 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc11Ga10 _chemical_formula_sum 'Sc22 Ga20' _cell_volume 828.67777769 _cell_formula_units_Z 2 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 Sc Sc0 1 0.16691312 0.16691312 -0.00000000 1.0 Sc Sc1 1 0.83308688 0.83308688 -0.00000000 1.0 Sc Sc2 1 0.32177408 0.32177408 0.64354817 1.0 Sc Sc3 1 0.67822592 0.67822592 0.35645183 1.0 Sc Sc4 1 0.32177408 0.67822592 -0.00000000 1.0 Sc Sc5 1 0.67822592 0.32177408 -0.00000000 1.0 Sc Sc6 1 0.43205450 0.10474327 0.32730923 1.0 Sc Sc7 1 0.56794550 0.89525673 0.67269077 1.0 Sc Sc8 1 0.77743404 0.10474327 0.67269077 1.0 Sc Sc9 1 0.10474327 0.77743404 0.67269077 1.0 Sc Sc10 1 0.22256596 0.89525673 0.32730923 1.0 Sc Sc11 1 0.89525673 0.22256596 0.32730923 1.0 Sc Sc12 1 0.10474327 0.43205450 0.32730923 1.0 Sc Sc13 1 0.89525673 0.56794550 0.67269077 1.0 Sc Sc14 1 0.56069238 0.31446575 0.24622663 1.0 Sc Sc15 1 0.43930762 0.68553425 0.75377337 1.0 Sc Sc16 1 0.06824111 0.31446575 0.75377337 1.0 Sc Sc17 1 0.31446575 0.06824111 0.75377337 1.0 Sc Sc18 1 0.93175889 0.68553425 0.24622663 1.0 Sc Sc19 1 0.68553425 0.93175889 0.24622663 1.0 Sc Sc20 1 0.31446575 0.56069238 0.24622663 1.0 Sc Sc21 1 0.68553425 0.43930762 0.75377337 1.0 Ga Ga22 1 0.38334629 0.38334629 0.41303198 1.0 Ga Ga23 1 0.61665371 0.61665371 0.58696802 1.0 Ga Ga24 1 0.97031432 0.97031432 0.58696802 1.0 Ga Ga25 1 0.38334629 0.97031432 0.00000000 1.0 Ga Ga26 1 0.02968568 0.61665371 0.00000000 1.0 Ga Ga27 1 0.02968568 0.02968568 0.41303198 1.0 Ga Ga28 1 0.61665371 0.02968568 -0.00000000 1.0 Ga Ga29 1 0.97031432 0.38334629 -0.00000000 1.0 Ga Ga30 1 0.39669623 0.39669623 0.00000000 1.0 Ga Ga31 1 0.60330377 0.60330377 -0.00000000 1.0 Ga Ga32 1 0.12449870 0.12449870 0.24899641 1.0 Ga Ga33 1 0.87550130 0.87550130 0.75100359 1.0 Ga Ga34 1 0.12449870 0.87550130 -0.00000000 1.0 Ga Ga35 1 0.87550130 0.12449870 0.00000000 1.0 Ga Ga36 1 0.75000000 0.25000000 0.50000000 1.0 Ga Ga37 1 0.25000000 0.75000000 0.50000000 1.0 Ga Ga38 1 0.50000000 0.13165396 0.63165396 1.0 Ga Ga39 1 0.50000000 0.86834604 0.36834604 1.0 Ga Ga40 1 0.13165396 0.50000000 0.63165396 1.0 Ga Ga41 1 0.86834604 0.50000000 0.36834604 1.0