# generated using pymatgen data_Ba3SrSn12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.34104100 _cell_length_b 7.35414300 _cell_length_c 12.98047200 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba3SrSn12 _chemical_formula_sum 'Ba3 Sr1 Sn12' _cell_volume 509.85709468 _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 Ba Ba0 1 0.00000000 0.00000000 0.66727000 1.0 Ba Ba1 1 0.50000000 0.00000000 0.33263200 1.0 Ba Ba2 1 0.50000000 0.50000000 0.83350500 1.0 Sr Sr3 1 0.00000000 0.50000000 0.16663300 1.0 Sn Sn4 1 0.50000000 0.50000000 0.35411400 1.0 Sn Sn5 1 0.50000000 0.00000000 0.85881600 1.0 Sn Sn6 1 0.50000000 0.78198000 0.07259000 1.0 Sn Sn7 1 0.50000000 0.28754600 0.57005300 1.0 Sn Sn8 1 0.50000000 0.21802000 0.07259000 1.0 Sn Sn9 1 0.50000000 0.71245400 0.57005300 1.0 Sn Sn10 1 0.00000000 0.00000000 0.14316100 1.0 Sn Sn11 1 0.00000000 0.50000000 0.64226800 1.0 Sn Sn12 1 0.00000000 0.71219200 0.42767000 1.0 Sn Sn13 1 0.00000000 0.21419300 0.93048600 1.0 Sn Sn14 1 0.00000000 0.28780800 0.42767000 1.0 Sn Sn15 1 0.00000000 0.78580700 0.93048600 1.0