# generated using pymatgen data_Sr21Al8Sn6Sb _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.18236962 _cell_length_b 12.18237083 _cell_length_c 12.18236918 _cell_angle_alpha 60.00000447 _cell_angle_beta 60.00000118 _cell_angle_gamma 59.99999940 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sr21Al8Sn6Sb _chemical_formula_sum 'Sr21 Al8 Sn6 Sb1' _cell_volume 1278.44003563 _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 Sr Sr0 1 0.87140298 0.87140298 0.38579007 1.0 Sr Sr1 1 0.61420993 0.12859702 0.12859702 1.0 Sr Sr2 1 0.87140298 0.38579007 0.87140298 1.0 Sr Sr3 1 0.12859702 0.12859702 0.12859702 1.0 Sr Sr4 1 0.38579007 0.87140298 0.87140298 1.0 Sr Sr5 1 0.87140298 0.87140298 0.87140298 1.0 Sr Sr6 1 0.18176853 0.81823147 0.50000000 1.0 Sr Sr7 1 0.81823147 0.50000000 0.50000000 1.0 Sr Sr8 1 0.12859702 0.12859702 0.61420993 1.0 Sr Sr9 1 0.81823147 0.18176853 0.50000000 1.0 Sr Sr10 1 0.18176853 0.50000000 0.50000000 1.0 Sr Sr11 1 0.12859702 0.61420993 0.12859702 1.0 Sr Sr12 1 0.50000000 0.50000000 0.18176853 1.0 Sr Sr13 1 0.50000000 0.18176853 0.81823147 1.0 Sr Sr14 1 0.50000000 0.81823147 0.18176853 1.0 Sr Sr15 1 0.50000000 0.50000000 0.81823147 1.0 Sr Sr16 1 0.50000000 0.18176853 0.50000000 1.0 Sr Sr17 1 0.18176853 0.50000000 0.81823147 1.0 Sr Sr18 1 0.00000000 0.00000000 0.00000000 1.0 Sr Sr19 1 0.50000000 0.81823147 0.50000000 1.0 Sr Sr20 1 0.81823147 0.50000000 0.18176853 1.0 Al Al21 1 0.69443126 0.91670623 0.69443126 1.0 Al Al22 1 0.69443126 0.69443126 0.91670623 1.0 Al Al23 1 0.69443126 0.69443126 0.69443126 1.0 Al Al24 1 0.30556874 0.08329377 0.30556874 1.0 Al Al25 1 0.91670623 0.69443126 0.69443126 1.0 Al Al26 1 0.30556874 0.30556874 0.08329377 1.0 Al Al27 1 0.08329377 0.30556874 0.30556874 1.0 Al Al28 1 0.30556874 0.30556874 0.30556874 1.0 Sn Sn29 1 0.78662965 0.21337035 0.78662965 1.0 Sn Sn30 1 0.78662965 0.21337035 0.21337035 1.0 Sn Sn31 1 0.21337035 0.78662965 0.21337035 1.0 Sn Sn32 1 0.21337035 0.78662965 0.78662965 1.0 Sn Sn33 1 0.78662965 0.78662965 0.21337035 1.0 Sn Sn34 1 0.21337035 0.21337035 0.78662965 1.0 Sb Sb35 1 0.50000000 0.50000000 0.50000000 1.0