# generated using pymatgen data_ZrAsPd _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.90649303 _cell_length_b 6.76291413 _cell_length_c 19.59287482 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural ZrAsPd _chemical_formula_sum 'Zr10 As10 Pd10' _cell_volume 517.62958536 _cell_formula_units_Z 10 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 0.50000000 0.97167619 0.68283008 1.0 Zr Zr1 1 -0.00000000 0.15462655 0.00000000 1.0 Zr Zr2 1 -0.00000000 0.54346875 0.87775875 1.0 Zr Zr3 1 0.50000000 0.45653125 0.37775875 1.0 Zr Zr4 1 0.50000000 0.45653125 0.62224125 1.0 Zr Zr5 1 -0.00000000 0.54346875 0.12224125 1.0 Zr Zr6 1 0.00000000 0.02832381 0.18283008 1.0 Zr Zr7 1 0.50000000 0.84537345 0.50000000 1.0 Zr Zr8 1 0.00000000 0.02832381 0.81716992 1.0 Zr Zr9 1 0.50000000 0.97167619 0.31716992 1.0 As As10 1 0.00000000 0.75651330 0.40149973 1.0 As As11 1 0.50000000 0.25245333 0.50000000 1.0 As As12 1 0.50000000 0.24348670 0.09850027 1.0 As As13 1 -0.00000000 0.25999090 0.30305779 1.0 As As14 1 0.50000000 0.74000910 0.19694221 1.0 As As15 1 0.50000000 0.74000910 0.80305779 1.0 As As16 1 0.50000000 0.24348670 0.90149973 1.0 As As17 1 0.00000000 0.74754667 0.00000000 1.0 As As18 1 -0.00000000 0.25999090 0.69694221 1.0 As As19 1 0.00000000 0.75651330 0.59850027 1.0 Pd Pd20 1 -0.00000000 0.11879107 0.42376487 1.0 Pd Pd21 1 0.50000000 0.35228027 0.22153317 1.0 Pd Pd22 1 0.50000000 0.48859271 0.00000000 1.0 Pd Pd23 1 0.50000000 0.35228027 0.77846683 1.0 Pd Pd24 1 0.00000000 0.64771973 0.27846683 1.0 Pd Pd25 1 0.00000000 0.64771973 0.72153317 1.0 Pd Pd26 1 0.50000000 0.88120893 0.07623513 1.0 Pd Pd27 1 0.50000000 0.88120893 0.92376487 1.0 Pd Pd28 1 0.00000000 0.11879107 0.57623513 1.0 Pd Pd29 1 -0.00000000 0.51140729 0.50000000 1.0