# generated using pymatgen data_Gd6Ta4Al43 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.91499707 _cell_length_b 10.91499683 _cell_length_c 17.26109006 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000077 _symmetry_Int_Tables_number 1 _chemical_formula_structural Gd6Ta4Al43 _chemical_formula_sum 'Gd12 Ta8 Al86' _cell_volume 1780.92686013 _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 Gd Gd0 1 0.52997652 0.00000000 0.09489567 1.0 Gd Gd1 1 0.52997652 0.52997652 0.59489567 1.0 Gd Gd2 1 0.52997652 0.52997652 0.90510433 1.0 Gd Gd3 1 0.47002348 0.00000000 0.90510433 1.0 Gd Gd4 1 0.47002348 0.47002348 0.40510433 1.0 Gd Gd5 1 0.00000000 0.47002348 0.59489567 1.0 Gd Gd6 1 0.47002348 0.47002348 0.09489567 1.0 Gd Gd7 1 0.47002348 0.00000000 0.59489567 1.0 Gd Gd8 1 0.00000000 0.52997652 0.09489567 1.0 Gd Gd9 1 0.52997652 0.00000000 0.40510433 1.0 Gd Gd10 1 0.00000000 0.52997652 0.40510433 1.0 Gd Gd11 1 0.00000000 0.47002348 0.90510433 1.0 Ta Ta12 1 0.72782833 0.00000000 0.25000000 1.0 Ta Ta13 1 0.72782833 0.72782833 0.75000000 1.0 Ta Ta14 1 0.27217167 0.00000000 0.75000000 1.0 Ta Ta15 1 0.00000000 0.72782833 0.25000000 1.0 Ta Ta16 1 0.00000000 0.00000000 0.00000000 1.0 Ta Ta17 1 0.27217167 0.27217167 0.25000000 1.0 Ta Ta18 1 0.00000000 0.27217167 0.75000000 1.0 Ta Ta19 1 0.00000000 0.00000000 0.50000000 1.0 Al Al20 1 0.76304367 0.60491648 0.33685197 1.0 Al Al21 1 0.23695633 0.84187281 0.33685197 1.0 Al Al22 1 0.75316428 0.24683572 0.50000000 1.0 Al Al23 1 0.55371371 0.40435745 0.25000000 1.0 Al Al24 1 0.74513142 0.74513142 0.03017139 1.0 Al Al25 1 0.49367143 0.24683572 0.50000000 1.0 Al Al26 1 0.23695633 0.84187281 0.16314803 1.0 Al Al27 1 0.85064374 0.40435745 0.75000000 1.0 Al Al28 1 0.39508352 0.23695633 0.83685197 1.0 Al Al29 1 0.75316428 0.50632857 0.50000000 1.0 Al Al30 1 0.15868784 0.00000000 0.61534666 1.0 Al Al31 1 0.60491648 0.84187281 0.83685197 1.0 Al Al32 1 0.84131216 0.00000000 0.38465334 1.0 Al Al33 1 0.74513142 0.00000000 0.53017139 1.0 Al Al34 1 0.60491648 0.76304367 0.33685197 1.0 Al Al35 1 0.00000000 0.15868784 0.88465334 1.0 Al Al36 1 0.00000000 0.25486858 0.03017139 1.0 Al Al37 1 0.24683572 0.75316428 0.50000000 1.0 Al Al38 1 0.76304367 0.15812719 0.66314803 1.0 Al Al39 1 0.33333300 0.66666700 0.37437996 1.0 Al Al40 1 0.14879493 0.00000000 0.25000000 1.0 Al Al41 1 0.60491648 0.76304367 0.16314803 1.0 Al Al42 1 0.15868784 0.00000000 0.88465334 1.0 Al Al43 1 0.33333300 0.66666700 0.87437996 1.0 Al Al44 1 0.14935626 0.59564255 0.25000000 1.0 Al Al45 1 0.84131216 0.00000000 0.11534666 1.0 Al Al46 1 0.76304367 0.15812719 0.83685197 1.0 Al Al47 1 0.60491648 0.84187281 0.66314803 1.0 Al Al48 1 0.49367143 0.24683572 0.00000000 1.0 Al Al49 1 0.84187281 0.23695633 0.16314803 1.0 Al Al50 1 0.00000000 0.15868784 0.61534666 1.0 Al Al51 1 0.25486858 0.25486858 0.53017139 1.0 Al Al52 1 0.74513142 0.00000000 0.96982861 1.0 Al Al53 1 0.75316428 0.24683572 0.00000000 1.0 Al Al54 1 0.75316428 0.50632857 0.00000000 1.0 Al Al55 1 0.44628629 0.85064374 0.25000000 1.0 Al Al56 1 0.00000000 0.74513142 0.96982861 1.0 Al Al57 1 0.39508352 0.23695633 0.66314803 1.0 Al Al58 1 0.00000000 0.25486858 0.46982861 1.0 Al Al59 1 0.50632857 0.75316428 0.00000000 1.0 Al Al60 1 0.33333300 0.66666700 0.12562004 1.0 Al Al61 1 0.40435745 0.85064374 0.75000000 1.0 Al Al62 1 0.24683572 0.49367143 0.50000000 1.0 Al Al63 1 0.25486858 0.00000000 0.46982861 1.0 Al Al64 1 0.00000000 0.84131216 0.11534666 1.0 Al Al65 1 0.15868784 0.15868784 0.38465334 1.0 Al Al66 1 0.24683572 0.75316428 0.00000000 1.0 Al Al67 1 0.59564255 0.14935626 0.25000000 1.0 Al Al68 1 0.39508352 0.15812719 0.16314803 1.0 Al Al69 1 0.14935626 0.55371371 0.75000000 1.0 Al Al70 1 0.15812719 0.39508352 0.16314803 1.0 Al Al71 1 0.55371371 0.14935626 0.75000000 1.0 Al Al72 1 0.39508352 0.15812719 0.33685197 1.0 Al Al73 1 0.15812719 0.76304367 0.83685197 1.0 Al Al74 1 0.84187281 0.60491648 0.83685197 1.0 Al Al75 1 0.84187281 0.23695633 0.33685197 1.0 Al Al76 1 0.15812719 0.39508352 0.33685197 1.0 Al Al77 1 0.66666700 0.33333300 0.37437996 1.0 Al Al78 1 0.66666700 0.33333300 0.12562004 1.0 Al Al79 1 0.23695633 0.39508352 0.66314803 1.0 Al Al80 1 0.74513142 0.74513142 0.46982861 1.0 Al Al81 1 0.00000000 0.74513142 0.53017139 1.0 Al Al82 1 0.85064374 0.44628629 0.25000000 1.0 Al Al83 1 0.66666700 0.33333300 0.87437996 1.0 Al Al84 1 0.84131216 0.84131216 0.88465334 1.0 Al Al85 1 0.84131216 0.84131216 0.61534666 1.0 Al Al86 1 0.66666700 0.33333300 0.62562004 1.0 Al Al87 1 0.24683572 0.49367143 0.00000000 1.0 Al Al88 1 0.40435745 0.55371371 0.25000000 1.0 Al Al89 1 0.23695633 0.39508352 0.83685197 1.0 Al Al90 1 0.14879493 0.14879493 0.75000000 1.0 Al Al91 1 0.85120507 0.00000000 0.75000000 1.0 Al Al92 1 0.76304367 0.60491648 0.16314803 1.0 Al Al93 1 0.84187281 0.60491648 0.66314803 1.0 Al Al94 1 0.33333300 0.66666700 0.62562004 1.0 Al Al95 1 0.15812719 0.76304367 0.66314803 1.0 Al Al96 1 0.25486858 0.00000000 0.03017139 1.0 Al Al97 1 0.59564255 0.44628629 0.75000000 1.0 Al Al98 1 0.15868784 0.15868784 0.11534666 1.0 Al Al99 1 0.00000000 0.85120507 0.75000000 1.0 Al Al100 1 0.00000000 0.84131216 0.38465334 1.0 Al Al101 1 0.00000000 0.14879493 0.25000000 1.0 Al Al102 1 0.25486858 0.25486858 0.96982861 1.0 Al Al103 1 0.50632857 0.75316428 0.50000000 1.0 Al Al104 1 0.44628629 0.59564255 0.75000000 1.0 Al Al105 1 0.85120507 0.85120507 0.25000000 1.0