# generated using pymatgen data_Sm6Ta4Al43 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.08063728 _cell_length_b 11.08063792 _cell_length_c 17.88903732 _cell_angle_alpha 90.00001840 _cell_angle_beta 90.00001813 _cell_angle_gamma 120.00012970 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sm6Ta4Al43 _chemical_formula_sum 'Sm12 Ta8 Al86' _cell_volume 1902.15777517 _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 0.53038133 -0.00000002 0.59601767 1.0 Sm Sm1 1 0.46961769 -0.00000007 0.40397906 1.0 Sm Sm2 1 -0.00000017 0.53038141 0.59601801 1.0 Sm Sm3 1 0.46961932 0.00000024 0.09600727 1.0 Sm Sm4 1 -0.00000020 0.53037819 0.90399437 1.0 Sm Sm5 1 0.00000027 0.46961710 0.40397893 1.0 Sm Sm6 1 0.53037830 -0.00000015 0.90399488 1.0 Sm Sm7 1 0.00000051 0.46961865 0.09600753 1.0 Sm Sm8 1 0.46961850 0.46961856 0.59601819 1.0 Sm Sm9 1 0.53038217 0.53038181 0.40397914 1.0 Sm Sm10 1 0.53038052 0.53038044 0.09600789 1.0 Sm Sm11 1 0.46962224 0.46962256 0.90399423 1.0 Ta Ta12 1 0.00000003 -0.00000038 0.50000077 1.0 Ta Ta13 1 0.00000001 -0.00000027 -0.00000177 1.0 Ta Ta14 1 0.72726381 0.00000063 0.75000557 1.0 Ta Ta15 1 0.27273124 0.00000012 0.24999517 1.0 Ta Ta16 1 0.00000025 0.72726416 0.75000552 1.0 Ta Ta17 1 0.00000170 0.27273191 0.24999314 1.0 Ta Ta18 1 0.27273685 0.27273699 0.75000572 1.0 Ta Ta19 1 0.72726977 0.72727048 0.24999498 1.0 Al Al20 1 0.15340752 0.59773250 0.75000082 1.0 Al Al21 1 0.84659756 0.40227291 0.24999812 1.0 Al Al22 1 0.40227273 0.55567629 0.75000134 1.0 Al Al23 1 0.59772660 0.15340304 0.75000130 1.0 Al Al24 1 0.59772742 0.44432558 0.24999925 1.0 Al Al25 1 0.40227382 0.84659721 0.24999803 1.0 Al Al26 1 0.44432440 0.84659755 0.75000146 1.0 Al Al27 1 0.55567584 0.40227274 0.75000130 1.0 Al Al28 1 0.55567602 0.15340232 0.24999781 1.0 Al Al29 1 0.44432525 0.59772632 0.24999925 1.0 Al Al30 1 0.84659269 0.44432505 0.75000075 1.0 Al Al31 1 0.15340700 0.55567332 0.24999839 1.0 Al Al32 1 0.15823373 0.99999946 0.11558775 1.0 Al Al33 1 0.84174978 0.00000037 0.88441745 1.0 Al Al34 1 -0.00000069 0.15823194 0.11558841 1.0 Al Al35 1 0.84175989 -0.00000008 0.61559289 1.0 Al Al36 1 -0.00000147 0.15822322 0.38440103 1.0 Al Al37 1 0.00000001 0.84174871 0.88441772 1.0 Al Al38 1 0.15822415 0.99999818 0.38440039 1.0 Al Al39 1 0.00000002 0.84175906 0.61559247 1.0 Al Al40 1 0.84176707 0.84176698 0.11558810 1.0 Al Al41 1 0.15825067 0.15825084 0.88441732 1.0 Al Al42 1 0.15823934 0.15823954 0.61559326 1.0 Al Al43 1 0.84177672 0.84177581 0.38440004 1.0 Al Al44 1 0.24744745 0.49489015 0.49999684 1.0 Al Al45 1 0.75255607 0.50511178 0.49999543 1.0 Al Al46 1 0.50510950 0.75255267 0.49999636 1.0 Al Al47 1 0.75255447 0.50510836 0.00000414 1.0 Al Al48 1 0.49488628 0.24745011 0.00000445 1.0 Al Al49 1 0.49489015 0.24744741 0.49999672 1.0 Al Al50 1 0.24745006 0.49488625 0.00000442 1.0 Al Al51 1 0.50510835 0.75255438 0.00000430 1.0 Al Al52 1 0.24744335 0.75255105 0.49999487 1.0 Al Al53 1 0.75255190 0.24744632 0.49999567 1.0 Al Al54 1 0.75255264 0.24744439 0.00000407 1.0 Al Al55 1 0.24744431 0.75255239 0.00000383 1.0 Al Al56 1 0.14740592 0.00000074 0.75000128 1.0 Al Al57 1 0.85259558 0.00000321 0.24999881 1.0 Al Al58 1 0.00000036 0.14740603 0.75000135 1.0 Al Al59 1 0.00000012 0.85259381 0.24999897 1.0 Al Al60 1 0.85259542 0.85259544 0.75000076 1.0 Al Al61 1 0.14740247 0.14741093 0.24999738 1.0 Al Al62 1 0.33333362 0.66666686 0.62530378 1.0 Al Al63 1 0.66666911 0.33333144 0.37469189 1.0 Al Al64 1 0.66666562 0.33333275 0.12530739 1.0 Al Al65 1 0.66666568 0.33333277 0.87469735 1.0 Al Al66 1 0.33333433 0.66666636 0.87469715 1.0 Al Al67 1 0.33333312 0.66666552 0.12530732 1.0 Al Al68 1 0.33333135 0.66666865 0.37469214 1.0 Al Al69 1 0.66666629 0.33333315 0.62530369 1.0 Al Al70 1 0.25306421 0.00000023 0.52973483 1.0 Al Al71 1 0.74693785 -0.00000070 0.47026158 1.0 Al Al72 1 -0.00000001 0.25306356 0.52973483 1.0 Al Al73 1 0.74693683 -0.00000076 0.02973873 1.0 Al Al74 1 -0.00000091 0.25306348 0.97026310 1.0 Al Al75 1 -0.00000030 0.74693773 0.47026149 1.0 Al Al76 1 0.25306400 -0.00000069 0.97026273 1.0 Al Al77 1 -0.00000097 0.74693628 0.02973873 1.0 Al Al78 1 0.74693619 0.74693634 0.52973463 1.0 Al Al79 1 0.25306082 0.25306088 0.47026210 1.0 Al Al80 1 0.25306009 0.25306032 0.02973945 1.0 Al Al81 1 0.74693501 0.74693540 0.97026317 1.0 Al Al82 1 0.15814616 0.39409818 0.66371327 1.0 Al Al83 1 0.84185121 0.60590283 0.33628466 1.0 Al Al84 1 0.60590231 0.76404897 0.66371251 1.0 Al Al85 1 0.84185408 0.60589920 0.16371714 1.0 Al Al86 1 0.39410714 0.15815532 0.83628873 1.0 Al Al87 1 0.39409699 0.23594788 0.33628559 1.0 Al Al88 1 0.15815524 0.39410825 0.83628792 1.0 Al Al89 1 0.60589946 0.84185437 0.16371673 1.0 Al Al90 1 0.23595182 0.84185496 0.66371192 1.0 Al Al91 1 0.39410077 0.23595529 0.16371691 1.0 Al Al92 1 0.76404778 0.60589345 0.83628877 1.0 Al Al93 1 0.76404944 0.15815064 0.33628510 1.0 Al Al94 1 0.60589896 0.76404526 0.83628566 1.0 Al Al95 1 0.23595456 0.39409930 0.16371694 1.0 Al Al96 1 0.60590217 0.84185018 0.33628579 1.0 Al Al97 1 0.39409743 0.15814633 0.66371272 1.0 Al Al98 1 0.76404513 0.15814529 0.16371708 1.0 Al Al99 1 0.23594859 0.39409515 0.33628568 1.0 Al Al100 1 0.23595247 0.84184574 0.83628894 1.0 Al Al101 1 0.76404801 0.60590297 0.66371206 1.0 Al Al102 1 0.84184518 0.23595326 0.83628784 1.0 Al Al103 1 0.15814606 0.76404389 0.16371775 1.0 Al Al104 1 0.15815058 0.76404899 0.33628363 1.0 Al Al105 1 0.84185395 0.23595206 0.66371300 1.0