# generated using pymatgen data_Sm4SiPd28Se _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.90110627 _cell_length_b 8.90110627 _cell_length_c 7.09839810 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sm4SiPd28Se _chemical_formula_sum 'Sm4 Si1 Pd28 Se1' _cell_volume 562.40390072 _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 Sm Sm0 1 0.50000000 0.00000000 0.93062127 1.0 Sm Sm1 1 0.00000000 0.50000000 0.06422044 1.0 Sm Sm2 1 0.00000000 0.00000000 0.50098581 1.0 Sm Sm3 1 0.50000000 0.50000000 0.50098581 1.0 Si Si4 1 0.00000000 0.50000000 0.55276866 1.0 Pd Pd5 1 0.32699038 0.82699038 0.62226653 1.0 Pd Pd6 1 0.32699038 0.17300962 0.62226653 1.0 Pd Pd7 1 0.67300962 0.82699038 0.62226653 1.0 Pd Pd8 1 0.67300962 0.17300962 0.62226653 1.0 Pd Pd9 1 0.16393151 0.66393151 0.38223338 1.0 Pd Pd10 1 0.16393151 0.33606849 0.38223338 1.0 Pd Pd11 1 0.83606849 0.66393151 0.38223338 1.0 Pd Pd12 1 0.83606849 0.33606849 0.38223338 1.0 Pd Pd13 1 0.50000000 0.76540875 0.25104897 1.0 Pd Pd14 1 0.50000000 0.23459125 0.25104897 1.0 Pd Pd15 1 0.26540875 0.00000000 0.25104897 1.0 Pd Pd16 1 0.73459125 0.00000000 0.25104897 1.0 Pd Pd17 1 0.00000000 0.72981491 0.74113529 1.0 Pd Pd18 1 0.00000000 0.27018509 0.74113529 1.0 Pd Pd19 1 0.22981491 0.50000000 0.74113529 1.0 Pd Pd20 1 0.77018509 0.50000000 0.74113529 1.0 Pd Pd21 1 0.50000000 0.34788428 0.85780671 1.0 Pd Pd22 1 0.50000000 0.65211572 0.85780671 1.0 Pd Pd23 1 0.84788428 0.00000000 0.85780671 1.0 Pd Pd24 1 0.15211572 0.00000000 0.85780671 1.0 Pd Pd25 1 0.00000000 0.15138863 0.14467873 1.0 Pd Pd26 1 0.00000000 0.84861137 0.14467873 1.0 Pd Pd27 1 0.65138863 0.50000000 0.14467873 1.0 Pd Pd28 1 0.34861137 0.50000000 0.14467873 1.0 Pd Pd29 1 0.24716625 0.74716625 0.00022544 1.0 Pd Pd30 1 0.24716625 0.25283375 0.00022544 1.0 Pd Pd31 1 0.75283375 0.74716625 0.00022544 1.0 Pd Pd32 1 0.75283375 0.25283375 0.00022544 1.0 Se Se33 1 0.50000000 0.00000000 0.45283784 1.0