# generated using pymatgen data_BaZnSn2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.03321138 _cell_length_b 10.03321138 _cell_length_c 4.81944300 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 148.03238593 _symmetry_Int_Tables_number 1 _chemical_formula_structural BaZnSn2 _chemical_formula_sum 'Ba2 Zn2 Sn4' _cell_volume 256.85816838 _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 Ba Ba0 1 0.60400800 0.39599200 0.25000000 1.0 Ba Ba1 1 0.39599200 0.60400800 0.75000000 1.0 Zn Zn2 1 0.98165700 0.01834300 0.25000000 1.0 Zn Zn3 1 0.01834300 0.98165700 0.75000000 1.0 Sn Sn4 1 0.25596100 0.74403900 0.25000000 1.0 Sn Sn5 1 0.74403900 0.25596100 0.75000000 1.0 Sn Sn6 1 0.83760400 0.16239600 0.25000000 1.0 Sn Sn7 1 0.16239600 0.83760400 0.75000000 1.0