# generated using pymatgen data_U6Ta4Al43 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.13942162 _cell_length_b 11.13942162 _cell_length_c 17.55578800 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999776 _symmetry_Int_Tables_number 1 _chemical_formula_structural U6Ta4Al43 _chemical_formula_sum 'U12 Ta8 Al86' _cell_volume 1886.58446323 _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 U U0 1 0.52679300 0.00000000 0.59048000 1.0 U U1 1 0.47320700 0.00000000 0.40952000 1.0 U U2 1 0.00000000 0.52679300 0.59048000 1.0 U U3 1 0.47320700 0.00000000 0.09048000 1.0 U U4 1 0.00000000 0.52679300 0.90952000 1.0 U U5 1 0.00000000 0.47320700 0.40952000 1.0 U U6 1 0.52679300 0.00000000 0.90952000 1.0 U U7 1 0.00000000 0.47320700 0.09048000 1.0 U U8 1 0.47320700 0.47320700 0.59048000 1.0 U U9 1 0.52679300 0.52679300 0.40952000 1.0 U U10 1 0.52679300 0.52679300 0.09048000 1.0 U U11 1 0.47320700 0.47320700 0.90952000 1.0 Ta Ta12 1 0.00000000 0.00000000 0.50000000 1.0 Ta Ta13 1 0.00000000 0.00000000 0.00000000 1.0 Ta Ta14 1 0.72430700 0.00000000 0.75000000 1.0 Ta Ta15 1 0.27569300 0.00000000 0.25000000 1.0 Ta Ta16 1 0.00000000 0.72430700 0.75000000 1.0 Ta Ta17 1 0.00000000 0.27569300 0.25000000 1.0 Ta Ta18 1 0.27569300 0.27569300 0.75000000 1.0 Ta Ta19 1 0.72430700 0.72430700 0.25000000 1.0 Al Al20 1 0.14842800 0.59298700 0.75000000 1.0 Al Al21 1 0.85157200 0.40701300 0.25000000 1.0 Al Al22 1 0.40701300 0.55544100 0.75000000 1.0 Al Al23 1 0.59298700 0.14842800 0.75000000 1.0 Al Al24 1 0.59298700 0.44455900 0.25000000 1.0 Al Al25 1 0.40701300 0.85157200 0.25000000 1.0 Al Al26 1 0.44455900 0.85157200 0.75000000 1.0 Al Al27 1 0.55544100 0.40701300 0.75000000 1.0 Al Al28 1 0.55544100 0.14842800 0.25000000 1.0 Al Al29 1 0.44455900 0.59298700 0.25000000 1.0 Al Al30 1 0.85157200 0.44455900 0.75000000 1.0 Al Al31 1 0.14842800 0.55544100 0.25000000 1.0 Al Al32 1 0.16074000 0.00000000 0.11490600 1.0 Al Al33 1 0.83926000 0.00000000 0.88509400 1.0 Al Al34 1 0.00000000 0.16074000 0.11490600 1.0 Al Al35 1 0.83926000 0.00000000 0.61490600 1.0 Al Al36 1 0.00000000 0.16074000 0.38509400 1.0 Al Al37 1 0.00000000 0.83926000 0.88509400 1.0 Al Al38 1 0.16074000 0.00000000 0.38509400 1.0 Al Al39 1 0.00000000 0.83926000 0.61490600 1.0 Al Al40 1 0.83926000 0.83926000 0.11490600 1.0 Al Al41 1 0.16074000 0.16074000 0.88509400 1.0 Al Al42 1 0.16074000 0.16074000 0.61490600 1.0 Al Al43 1 0.83926000 0.83926000 0.38509400 1.0 Al Al44 1 0.24705600 0.49411100 0.50000000 1.0 Al Al45 1 0.75294400 0.50588900 0.50000000 1.0 Al Al46 1 0.50588900 0.75294400 0.50000000 1.0 Al Al47 1 0.75294400 0.50588900 0.00000000 1.0 Al Al48 1 0.49411100 0.24705600 0.00000000 1.0 Al Al49 1 0.49411100 0.24705600 0.50000000 1.0 Al Al50 1 0.24705600 0.49411100 0.00000000 1.0 Al Al51 1 0.50588900 0.75294400 0.00000000 1.0 Al Al52 1 0.24705600 0.75294400 0.50000000 1.0 Al Al53 1 0.75294400 0.24705600 0.50000000 1.0 Al Al54 1 0.75294400 0.24705600 0.00000000 1.0 Al Al55 1 0.24705600 0.75294400 0.00000000 1.0 Al Al56 1 0.14633800 0.00000000 0.75000000 1.0 Al Al57 1 0.85366200 0.00000000 0.25000000 1.0 Al Al58 1 0.00000000 0.14633800 0.75000000 1.0 Al Al59 1 0.00000000 0.85366200 0.25000000 1.0 Al Al60 1 0.85366200 0.85366200 0.75000000 1.0 Al Al61 1 0.14633800 0.14633800 0.25000000 1.0 Al Al62 1 0.33333300 0.66666700 0.62678200 1.0 Al Al63 1 0.66666700 0.33333300 0.37321800 1.0 Al Al64 1 0.66666700 0.33333300 0.12678200 1.0 Al Al65 1 0.66666700 0.33333300 0.87321800 1.0 Al Al66 1 0.33333300 0.66666700 0.87321800 1.0 Al Al67 1 0.33333300 0.66666700 0.12678200 1.0 Al Al68 1 0.33333300 0.66666700 0.37321800 1.0 Al Al69 1 0.66666700 0.33333300 0.62678200 1.0 Al Al70 1 0.25696000 0.00000000 0.52949000 1.0 Al Al71 1 0.74304000 0.00000000 0.47051000 1.0 Al Al72 1 0.00000000 0.25696000 0.52949000 1.0 Al Al73 1 0.74304000 0.00000000 0.02949000 1.0 Al Al74 1 0.00000000 0.25696000 0.97051000 1.0 Al Al75 1 0.00000000 0.74304000 0.47051000 1.0 Al Al76 1 0.25696000 0.00000000 0.97051000 1.0 Al Al77 1 0.00000000 0.74304000 0.02949000 1.0 Al Al78 1 0.74304000 0.74304000 0.52949000 1.0 Al Al79 1 0.25696000 0.25696000 0.47051000 1.0 Al Al80 1 0.25696000 0.25696000 0.02949000 1.0 Al Al81 1 0.74304000 0.74304000 0.97051000 1.0 Al Al82 1 0.15748400 0.39536200 0.66308100 1.0 Al Al83 1 0.84251600 0.60463800 0.33691900 1.0 Al Al84 1 0.60463800 0.76212200 0.66308100 1.0 Al Al85 1 0.84251600 0.60463800 0.16308100 1.0 Al Al86 1 0.39536200 0.15748400 0.83691900 1.0 Al Al87 1 0.39536200 0.23787800 0.33691900 1.0 Al Al88 1 0.15748400 0.39536200 0.83691900 1.0 Al Al89 1 0.60463800 0.84251600 0.16308100 1.0 Al Al90 1 0.23787800 0.84251600 0.66308100 1.0 Al Al91 1 0.39536200 0.23787800 0.16308100 1.0 Al Al92 1 0.76212200 0.60463800 0.83691900 1.0 Al Al93 1 0.76212200 0.15748400 0.33691900 1.0 Al Al94 1 0.60463800 0.76212200 0.83691900 1.0 Al Al95 1 0.23787800 0.39536200 0.16308100 1.0 Al Al96 1 0.60463800 0.84251600 0.33691900 1.0 Al Al97 1 0.39536200 0.15748400 0.66308100 1.0 Al Al98 1 0.76212200 0.15748400 0.16308100 1.0 Al Al99 1 0.23787800 0.39536200 0.33691900 1.0 Al Al100 1 0.23787800 0.84251600 0.83691900 1.0 Al Al101 1 0.76212200 0.60463800 0.66308100 1.0 Al Al102 1 0.84251600 0.23787800 0.83691900 1.0 Al Al103 1 0.15748400 0.76212200 0.16308100 1.0 Al Al104 1 0.15748400 0.76212200 0.33691900 1.0 Al Al105 1 0.84251600 0.23787800 0.66308100 1.0