# generated using pymatgen data_Dy8C3SBr6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.74321292 _cell_length_b 10.85031491 _cell_length_c 20.36279982 _cell_angle_alpha 91.62386806 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Dy8C3SBr6 _chemical_formula_sum 'Dy16 C6 S2 Br12' _cell_volume 826.70376796 _cell_formula_units_Z 2 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 Dy Dy0 1 0.25000000 0.87666144 0.57688272 1.0 Dy Dy1 1 0.75000000 0.12333856 0.42311728 1.0 Dy Dy2 1 0.75000000 0.63696007 0.08083008 1.0 Dy Dy3 1 0.25000000 0.36303993 0.91916992 1.0 Dy Dy4 1 0.25000000 0.89110769 0.73871905 1.0 Dy Dy5 1 0.75000000 0.10889231 0.26128095 1.0 Dy Dy6 1 0.75000000 0.64657441 0.24169259 1.0 Dy Dy7 1 0.25000000 0.35342559 0.75830741 1.0 Dy Dy8 1 0.25000000 0.86623866 0.16960874 1.0 Dy Dy9 1 0.75000000 0.13376134 0.83039126 1.0 Dy Dy10 1 0.75000000 0.65316256 0.65739041 1.0 Dy Dy11 1 0.25000000 0.34683744 0.34260959 1.0 Dy Dy12 1 0.25000000 0.89040319 0.33168716 1.0 Dy Dy13 1 0.75000000 0.10959681 0.66831284 1.0 Dy Dy14 1 0.75000000 0.58958385 0.83976559 1.0 Dy Dy15 1 0.25000000 0.41041615 0.16023441 1.0 C C16 1 0.75000000 0.87802811 0.25245855 1.0 C C17 1 0.25000000 0.12197189 0.74754145 1.0 C C18 1 0.25000000 0.63342949 0.15557885 1.0 C C19 1 0.75000000 0.36657051 0.84442115 1.0 C C20 1 0.75000000 0.87648955 0.65233665 1.0 C C21 1 0.25000000 0.12351045 0.34766335 1.0 S S22 1 0.25000000 0.62172321 0.74898458 1.0 S S23 1 0.75000000 0.37827679 0.25101542 1.0 Br Br24 1 0.25000000 0.61966133 0.55022140 1.0 Br Br25 1 0.75000000 0.38033867 0.44977860 1.0 Br Br26 1 0.75000000 0.88617775 0.05657325 1.0 Br Br27 1 0.25000000 0.11382225 0.94342675 1.0 Br Br28 1 0.25000000 0.62731639 0.95472853 1.0 Br Br29 1 0.75000000 0.37268361 0.04527147 1.0 Br Br30 1 0.75000000 0.86605926 0.45402764 1.0 Br Br31 1 0.25000000 0.13394074 0.54597236 1.0 Br Br32 1 0.25000000 0.62540151 0.35463417 1.0 Br Br33 1 0.75000000 0.37459849 0.64536583 1.0 Br Br34 1 0.75000000 0.86580259 0.85133639 1.0 Br Br35 1 0.25000000 0.13419741 0.14866361 1.0