# generated using pymatgen data_Ce3MnAlS7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.06224630 _cell_length_b 10.06224630 _cell_length_c 5.99889900 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000196 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ce3MnAlS7 _chemical_formula_sum 'Ce6 Mn2 Al2 S14' _cell_volume 526.00764987 _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 0.14078100 0.37243800 0.24394500 1.0 Ce Ce1 1 0.85921900 0.62756200 0.74394500 1.0 Ce Ce2 1 0.62756200 0.76834300 0.24394500 1.0 Ce Ce3 1 0.23165700 0.85921900 0.24394500 1.0 Ce Ce4 1 0.76834300 0.14078100 0.74394500 1.0 Ce Ce5 1 0.37243800 0.23165700 0.74394500 1.0 Mn Mn6 1 0.00000000 0.00000000 0.02157200 1.0 Mn Mn7 1 0.00000000 0.00000000 0.52157200 1.0 Al Al8 1 0.33333300 0.66666700 0.66264500 1.0 Al Al9 1 0.66666700 0.33333300 0.16264500 1.0 S S10 1 0.33333300 0.66666700 0.03491400 1.0 S S11 1 0.66666700 0.33333300 0.53491400 1.0 S S12 1 0.09229500 0.23850200 0.78875600 1.0 S S13 1 0.90770500 0.76149800 0.28875600 1.0 S S14 1 0.76149800 0.85379300 0.78875600 1.0 S S15 1 0.14620700 0.90770500 0.78875600 1.0 S S16 1 0.85379300 0.09229500 0.28875600 1.0 S S17 1 0.23850200 0.14620700 0.28875600 1.0 S S18 1 0.42083700 0.51976400 0.51649800 1.0 S S19 1 0.57916300 0.48023600 0.01649800 1.0 S S20 1 0.48023600 0.90107300 0.51649800 1.0 S S21 1 0.09892700 0.57916300 0.51649800 1.0 S S22 1 0.90107300 0.42083700 0.01649800 1.0 S S23 1 0.51976400 0.09892700 0.01649800 1.0