# generated using pymatgen data_La2Si5AsPd21 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.70247959 _cell_length_b 8.70247907 _cell_length_c 8.64742721 _cell_angle_alpha 60.20903891 _cell_angle_beta 60.20904086 _cell_angle_gamma 59.58190995 _symmetry_Int_Tables_number 1 _chemical_formula_structural La2Si5AsPd21 _chemical_formula_sum 'La2 Si5 As1 Pd21' _cell_volume 463.04515178 _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 La La0 1 0.75015386 0.75015386 0.74984614 1.0 La La1 1 0.25015386 0.25015386 0.24984614 1.0 Si Si2 1 0.26298239 0.73719786 0.26280214 1.0 Si Si3 1 0.73719786 0.26298239 0.26280214 1.0 Si Si4 1 0.26290322 0.26290322 0.73709678 1.0 Si Si5 1 0.73719786 0.26298239 0.73701761 1.0 Si Si6 1 0.26298239 0.73719786 0.73701761 1.0 As As7 1 0.73882545 0.73882545 0.26117455 1.0 Pd Pd8 1 0.00091451 0.00091451 0.99908549 1.0 Pd Pd9 1 0.61119873 0.61119873 0.15771603 1.0 Pd Pd10 1 0.61339346 0.15705090 0.61477832 1.0 Pd Pd11 1 0.15705090 0.61339346 0.61477832 1.0 Pd Pd12 1 0.61119873 0.61119873 0.61988851 1.0 Pd Pd13 1 0.38522168 0.38522168 0.84294910 1.0 Pd Pd14 1 0.38011149 0.84228397 0.38880127 1.0 Pd Pd15 1 0.84228397 0.38011149 0.38880127 1.0 Pd Pd16 1 0.38522168 0.38522168 0.38660654 1.0 Pd Pd17 1 0.00121430 0.00121430 0.34404820 1.0 Pd Pd18 1 0.65287826 0.00704400 0.34712174 1.0 Pd Pd19 1 0.00704400 0.65287826 0.34712174 1.0 Pd Pd20 1 0.65595180 0.34647780 0.99878570 1.0 Pd Pd21 1 0.99899288 0.34415923 0.00100712 1.0 Pd Pd22 1 0.99899288 0.34415923 0.65584077 1.0 Pd Pd23 1 0.34647780 0.65595180 0.99878570 1.0 Pd Pd24 1 0.34415923 0.99899288 0.65584077 1.0 Pd Pd25 1 0.34415923 0.99899288 0.00100712 1.0 Pd Pd26 1 0.00121430 0.00121430 0.65352220 1.0 Pd Pd27 1 0.00704400 0.65287826 0.99295600 1.0 Pd Pd28 1 0.65287826 0.00704400 0.99295600 1.0