# generated using pymatgen data_Ce4CrS7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.84623459 _cell_length_b 9.69841269 _cell_length_c 9.79980761 _cell_angle_alpha 118.77724897 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ce4CrS7 _chemical_formula_sum 'Ce8 Cr2 S14' _cell_volume 570.32297823 _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 Ce Ce0 1 0.27580440 0.23050435 0.37977123 1.0 Ce Ce1 1 0.24080600 0.62262924 0.83674915 1.0 Ce Ce2 1 0.28884948 0.15796684 0.78880817 1.0 Ce Ce3 1 0.77580440 0.76949565 0.62022877 1.0 Ce Ce4 1 0.74080600 0.37737076 0.16325085 1.0 Ce Ce5 1 0.78884948 0.84203316 0.21119183 1.0 Ce Ce6 1 0.80271823 0.25792131 0.62932481 1.0 Ce Ce7 1 0.30271823 0.74207869 0.37067519 1.0 Cr Cr8 1 0.46621905 0.01123167 0.02418692 1.0 Cr Cr9 1 0.96621905 0.98876833 0.97581308 1.0 S S10 1 0.67404883 0.14895676 0.27326968 1.0 S S11 1 0.69330352 0.78242529 0.90901598 1.0 S S12 1 0.68683017 0.10259549 0.87569476 1.0 S S13 1 0.17404883 0.85104324 0.72673032 1.0 S S14 1 0.19330352 0.21757471 0.09098402 1.0 S S15 1 0.18683017 0.89740451 0.12430524 1.0 S S16 1 0.08338013 0.03738902 0.49611445 1.0 S S17 1 0.99892988 0.46651722 0.56050779 1.0 S S18 1 0.00956608 0.41868952 0.90262928 1.0 S S19 1 0.58338013 0.96261098 0.50388555 1.0 S S20 1 0.49892988 0.53348278 0.43949221 1.0 S S21 1 0.50956608 0.58131048 0.09737072 1.0 S S22 1 0.43354421 0.35017401 0.67723278 1.0 S S23 1 0.93354421 0.64982599 0.32276722 1.0