# generated using pymatgen data_ZrGe _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.91511137 _cell_length_b 7.09613347 _cell_length_c 5.41275154 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural ZrGe _chemical_formula_sum 'Zr4 Ge4' _cell_volume 150.37789052 _cell_formula_units_Z 4 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 0.75000000 0.82392014 0.36911204 1.0 Zr Zr1 1 0.25000000 0.17607886 0.63088796 1.0 Zr Zr2 1 0.25000000 0.67607986 0.86911204 1.0 Zr Zr3 1 0.75000000 0.32392014 0.13088796 1.0 Ge Ge4 1 0.75000000 0.95168177 0.84780711 1.0 Ge Ge5 1 0.25000000 0.04831823 0.15219289 1.0 Ge Ge6 1 0.25000000 0.54831823 0.34780711 1.0 Ge Ge7 1 0.75000000 0.45168177 0.65219289 1.0