# generated using pymatgen data_Ce10S14O _symmetry_space_group_name_H-M 'P 1' _cell_length_a 14.60678966 _cell_length_b 14.60678966 _cell_length_c 14.60678966 _cell_angle_alpha 117.98832883 _cell_angle_beta 117.98832883 _cell_angle_gamma 93.52112839 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ce10S14O _chemical_formula_sum 'Ce40 S56 O4' _cell_volume 2266.06122561 _cell_formula_units_Z 4 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 0.29352400 0.14422100 0.59256100 1.0 Ce Ce1 1 0.67605000 0.04962600 0.36083500 1.0 Ce Ce2 1 0.85577900 0.44834000 0.14930300 1.0 Ce Ce3 1 0.79352400 0.20096300 0.14930300 1.0 Ce Ce4 1 0.86441500 0.63558500 0.50000000 1.0 Ce Ce5 1 0.57395000 0.43478500 0.87357500 1.0 Ce Ce6 1 0.45647600 0.10577900 0.90743900 1.0 Ce Ce7 1 0.05166000 0.64422100 0.85069700 1.0 Ce Ce8 1 0.45096300 0.54352400 0.64930300 1.0 Ce Ce9 1 0.95647600 0.04903700 0.35069700 1.0 Ce Ce10 1 0.39422100 0.04352400 0.09256100 1.0 Ce Ce11 1 0.55166000 0.70096300 0.40743900 1.0 Ce Ce12 1 0.68478500 0.32395000 0.37357500 1.0 Ce Ce13 1 0.18478500 0.81121000 0.36083500 1.0 Ce Ce14 1 0.29903700 0.70647600 0.85069700 1.0 Ce Ce15 1 0.13558500 0.36441500 0.50000000 1.0 Ce Ce16 1 0.95037400 0.31121000 0.62642500 1.0 Ce Ce17 1 0.45037400 0.82395000 0.63916500 1.0 Ce Ce18 1 0.06521500 0.92605000 0.12642500 1.0 Ce Ce19 1 0.63558500 0.13558500 0.77117000 1.0 Ce Ce20 1 0.11441500 0.11441500 0.72883000 1.0 Ce Ce21 1 0.36441500 0.86441500 0.22883000 1.0 Ce Ce22 1 0.06121000 0.93478500 0.86083500 1.0 Ce Ce23 1 0.56521500 0.43879000 0.13916500 1.0 Ce Ce24 1 0.61441500 0.88558500 0.00000000 1.0 Ce Ce25 1 0.18879000 0.54962600 0.37357500 1.0 Ce Ce26 1 0.79903700 0.94834000 0.59256100 1.0 Ce Ce27 1 0.89422100 0.80166000 0.35069700 1.0 Ce Ce28 1 0.88558500 0.61441500 0.00000000 1.0 Ce Ce29 1 0.95096300 0.30166000 0.90743900 1.0 Ce Ce30 1 0.56121000 0.70037400 0.12642500 1.0 Ce Ce31 1 0.68879000 0.31521500 0.63916500 1.0 Ce Ce32 1 0.29962600 0.42605000 0.86083500 1.0 Ce Ce33 1 0.17605000 0.81521500 0.62642500 1.0 Ce Ce34 1 0.19834000 0.54903700 0.09256100 1.0 Ce Ce35 1 0.07395000 0.20037400 0.13916500 1.0 Ce Ce36 1 0.35577900 0.20647600 0.40743900 1.0 Ce Ce37 1 0.79962600 0.93879000 0.87357500 1.0 Ce Ce38 1 0.69834000 0.60577900 0.64930300 1.0 Ce Ce39 1 0.38558500 0.38558500 0.27117000 1.0 S S40 1 0.31110800 0.64559900 0.02100200 1.0 S S41 1 0.89559900 0.06110800 0.52100200 1.0 S S42 1 0.77490100 0.41509700 0.28349500 1.0 S S43 1 0.12500000 0.22810200 0.60310200 1.0 S S44 1 0.76035300 0.60409900 0.10789500 1.0 S S45 1 0.63160300 0.91509700 0.64019600 1.0 S S46 1 0.13160300 0.49140700 0.71650500 1.0 S S47 1 0.74140700 0.88160300 0.21650500 1.0 S S48 1 0.47509900 0.25859300 0.14019600 1.0 S S49 1 0.20989300 0.87540200 0.02100200 1.0 S S50 1 0.62500000 0.02189800 0.89689800 1.0 S S51 1 0.27490100 0.99140700 0.35980400 1.0 S S52 1 0.98964700 0.64590100 0.39210500 1.0 S S53 1 0.97810200 0.87500000 0.60310200 1.0 S S54 1 0.97509900 0.83490300 0.21650500 1.0 S S55 1 0.27189800 0.37500000 0.39689800 1.0 S S56 1 0.99620400 0.10409900 0.84374600 1.0 S S57 1 0.90245800 0.24620400 0.39210500 1.0 S S58 1 0.85440100 0.18889200 0.97899800 1.0 S S59 1 0.16509700 0.38160300 0.14019600 1.0 S S60 1 0.75379600 0.14590100 0.65625400 1.0 S S61 1 0.48964700 0.09754200 0.34374600 1.0 S S62 1 0.25379600 0.59754200 0.60789500 1.0 S S63 1 0.93889200 0.45989300 0.83449100 1.0 S S64 1 0.35409900 0.74620400 0.34374600 1.0 S S65 1 0.62500000 0.52189800 0.39689800 1.0 S S66 1 0.39559900 0.87459800 0.83449100 1.0 S S67 1 0.77189800 0.37500000 0.89689800 1.0 S S68 1 0.85409900 0.51035300 0.60789500 1.0 S S69 1 0.08490300 0.72509900 0.71650500 1.0 S S70 1 0.12540200 0.95989300 0.52100200 1.0 S S71 1 0.24140700 0.02490100 0.85980400 1.0 S S72 1 0.47810200 0.87500000 0.10310200 1.0 S S73 1 0.12500000 0.72810200 0.10310200 1.0 S S74 1 0.12459800 0.14559900 0.33449100 1.0 S S75 1 0.39590100 0.50379600 0.15625400 1.0 S S76 1 0.35440100 0.37540200 0.66550900 1.0 S S77 1 0.89590100 0.73964700 0.89210500 1.0 S S78 1 0.50859300 0.22509900 0.64019600 1.0 S S79 1 0.26035300 0.15245800 0.15625400 1.0 S S80 1 0.11839700 0.33490300 0.85980400 1.0 S S81 1 0.66509700 0.52490100 0.78349500 1.0 S S82 1 0.81110800 0.79010700 0.66550900 1.0 S S83 1 0.04010700 0.56110800 0.16550900 1.0 S S84 1 0.84754200 0.00379600 0.10789500 1.0 S S85 1 0.61839700 0.75859300 0.78349500 1.0 S S86 1 0.00859300 0.36839700 0.28349500 1.0 S S87 1 0.70989300 0.68889200 0.33449100 1.0 S S88 1 0.49620400 0.65245800 0.89210500 1.0 S S89 1 0.40245800 0.01035300 0.65625400 1.0 S S90 1 0.34754200 0.23964700 0.84374600 1.0 S S91 1 0.43889200 0.60440100 0.47899800 1.0 S S92 1 0.62540200 0.10440100 0.16550900 1.0 S S93 1 0.58490300 0.86839700 0.35980400 1.0 S S94 1 0.62459800 0.29010700 0.97899800 1.0 S S95 1 0.54010700 0.37459800 0.47899800 1.0 O O96 1 0.00000000 0.00000000 0.00000000 1.0 O O97 1 0.75000000 0.25000000 0.50000000 1.0 O O98 1 0.50000000 0.50000000 0.00000000 1.0 O O99 1 0.25000000 0.75000000 0.50000000 1.0