# generated using pymatgen data_Sm3MnAlS7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.86617149 _cell_length_b 9.86617149 _cell_length_c 6.14412800 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999657 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sm3MnAlS7 _chemical_formula_sum 'Sm6 Mn2 Al2 S14' _cell_volume 517.95045772 _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 Sm Sm0 1 0.14918700 0.37763100 0.23720600 1.0 Sm Sm1 1 0.85081300 0.62236900 0.73720600 1.0 Sm Sm2 1 0.62236900 0.77155700 0.23720600 1.0 Sm Sm3 1 0.22844300 0.85081300 0.23720600 1.0 Sm Sm4 1 0.77155700 0.14918700 0.73720600 1.0 Sm Sm5 1 0.37763100 0.22844300 0.73720600 1.0 Mn Mn6 1 0.00000000 0.00000000 0.02951200 1.0 Mn Mn7 1 0.00000000 0.00000000 0.52951200 1.0 Al Al8 1 0.33333300 0.66666700 0.65991500 1.0 Al Al9 1 0.66666700 0.33333300 0.15991500 1.0 S S10 1 0.33333300 0.66666700 0.02455800 1.0 S S11 1 0.66666700 0.33333300 0.52455800 1.0 S S12 1 0.09867700 0.24159200 0.80416000 1.0 S S13 1 0.90132300 0.75840800 0.30416000 1.0 S S14 1 0.75840800 0.85708600 0.80416000 1.0 S S15 1 0.14291400 0.90132300 0.80416000 1.0 S S16 1 0.85708600 0.09867700 0.30416000 1.0 S S17 1 0.24159200 0.14291400 0.30416000 1.0 S S18 1 0.42558000 0.52066200 0.50865900 1.0 S S19 1 0.57442000 0.47933800 0.00865900 1.0 S S20 1 0.47933800 0.90491700 0.50865900 1.0 S S21 1 0.09508300 0.57442000 0.50865900 1.0 S S22 1 0.90491700 0.42558000 0.00865900 1.0 S S23 1 0.52066200 0.09508300 0.00865900 1.0