# generated using pymatgen data_Ce4(GeS4)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.55436653 _cell_length_b 11.55436653 _cell_length_c 11.55436579 _cell_angle_alpha 114.78062183 _cell_angle_beta 114.78062183 _cell_angle_gamma 114.78062322 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ce4(GeS4)3 _chemical_formula_sum 'Ce8 Ge6 S24' _cell_volume 880.30566806 _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 0.93188500 0.47213400 0.70770600 1.0 Ce Ce1 1 0.70770600 0.93188500 0.47213400 1.0 Ce Ce2 1 0.20770600 0.97213400 0.43188500 1.0 Ce Ce3 1 0.47213400 0.70770600 0.93188500 1.0 Ce Ce4 1 0.97213400 0.43188500 0.20770600 1.0 Ce Ce5 1 0.99978800 0.99978800 0.99978800 1.0 Ce Ce6 1 0.43188500 0.20770600 0.97213400 1.0 Ce Ce7 1 0.49978800 0.49978800 0.49978800 1.0 Ge Ge8 1 0.46700300 0.85430100 0.64158000 1.0 Ge Ge9 1 0.14158000 0.35430100 0.96700300 1.0 Ge Ge10 1 0.96700300 0.14158000 0.35430100 1.0 Ge Ge11 1 0.85430100 0.64158000 0.46700300 1.0 Ge Ge12 1 0.64158000 0.46700300 0.85430100 1.0 Ge Ge13 1 0.35430100 0.96700300 0.14158000 1.0 S S14 1 0.68892600 0.87336900 0.68852000 1.0 S S15 1 0.37336900 0.18892600 0.18852000 1.0 S S16 1 0.29548400 0.60945300 0.58325200 1.0 S S17 1 0.58325200 0.29548400 0.60945300 1.0 S S18 1 0.78161700 0.38352400 0.31318900 1.0 S S19 1 0.68852000 0.68892600 0.87336900 1.0 S S20 1 0.60945300 0.58325200 0.29548400 1.0 S S21 1 0.81318900 0.88352400 0.28161700 1.0 S S22 1 0.12958800 0.85207800 0.58275600 1.0 S S23 1 0.35207800 0.62958800 0.08275600 1.0 S S24 1 0.58275600 0.12958800 0.85207800 1.0 S S25 1 0.08325200 0.10945300 0.79548400 1.0 S S26 1 0.10945300 0.79548400 0.08325200 1.0 S S27 1 0.18892600 0.18852000 0.37336900 1.0 S S28 1 0.18852000 0.37336900 0.18892600 1.0 S S29 1 0.62958800 0.08275600 0.35207800 1.0 S S30 1 0.38352400 0.31318900 0.78161700 1.0 S S31 1 0.08275600 0.35207800 0.62958800 1.0 S S32 1 0.28161700 0.81318900 0.88352400 1.0 S S33 1 0.88352400 0.28161700 0.81318900 1.0 S S34 1 0.31318900 0.78161700 0.38352400 1.0 S S35 1 0.85207800 0.58275600 0.12958800 1.0 S S36 1 0.87336900 0.68852000 0.68892600 1.0 S S37 1 0.79548400 0.08325200 0.10945300 1.0