# generated using pymatgen data_ZrSn _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.49329600 _cell_length_b 6.13144200 _cell_length_c 8.49528464 _cell_angle_alpha 83.43498333 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural ZrSn _chemical_formula_sum 'Zr6 Sn6' _cell_volume 284.26042981 _cell_formula_units_Z 6 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 Zr Zr0 1 0.25000000 0.44844700 0.59122600 1.0 Zr Zr1 1 0.25000000 0.94329400 0.61523200 1.0 Zr Zr2 1 0.75000000 0.55155300 0.40877400 1.0 Zr Zr3 1 0.75000000 0.05670600 0.38476800 1.0 Zr Zr4 1 0.25000000 0.30283100 0.23494400 1.0 Zr Zr5 1 0.75000000 0.69716900 0.76505600 1.0 Sn Sn6 1 0.25000000 0.78867500 0.30040200 1.0 Sn Sn7 1 0.75000000 0.86118200 0.08265400 1.0 Sn Sn8 1 0.75000000 0.35805900 0.07766100 1.0 Sn Sn9 1 0.25000000 0.64194100 0.92233900 1.0 Sn Sn10 1 0.25000000 0.13881800 0.91734600 1.0 Sn Sn11 1 0.75000000 0.21132500 0.69959800 1.0