# generated using pymatgen data_Y6Al43Cr4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.91824788 _cell_length_b 10.91824788 _cell_length_c 17.49226000 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999930 _symmetry_Int_Tables_number 1 _chemical_formula_structural Y6Al43Cr4 _chemical_formula_sum 'Y12 Al86 Cr8' _cell_volume 1805.85326647 _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 Y Y0 1 0.47127000 0.47127000 0.90486400 1.0 Y Y1 1 0.52873000 0.00000000 0.90486400 1.0 Y Y2 1 0.00000000 0.52873000 0.90486400 1.0 Y Y3 1 0.52873000 0.52873000 0.09513600 1.0 Y Y4 1 0.47127000 0.00000000 0.09513600 1.0 Y Y5 1 0.00000000 0.47127000 0.09513600 1.0 Y Y6 1 0.52873000 0.52873000 0.40486400 1.0 Y Y7 1 0.47127000 0.00000000 0.40486400 1.0 Y Y8 1 0.00000000 0.47127000 0.40486400 1.0 Y Y9 1 0.47127000 0.47127000 0.59513600 1.0 Y Y10 1 0.52873000 0.00000000 0.59513600 1.0 Y Y11 1 0.00000000 0.52873000 0.59513600 1.0 Al Al12 1 0.84125000 0.23210100 0.83417500 1.0 Al Al13 1 0.76789900 0.60914900 0.83417500 1.0 Al Al14 1 0.39085100 0.15875000 0.83417500 1.0 Al Al15 1 0.23210100 0.84125000 0.83417500 1.0 Al Al16 1 0.60914900 0.76789900 0.83417500 1.0 Al Al17 1 0.15875000 0.39085100 0.83417500 1.0 Al Al18 1 0.15875000 0.76789900 0.16582500 1.0 Al Al19 1 0.23210100 0.39085100 0.16582500 1.0 Al Al20 1 0.60914900 0.84125000 0.16582500 1.0 Al Al21 1 0.76789900 0.15875000 0.16582500 1.0 Al Al22 1 0.39085100 0.23210100 0.16582500 1.0 Al Al23 1 0.84125000 0.60914900 0.16582500 1.0 Al Al24 1 0.15875000 0.76789900 0.33417500 1.0 Al Al25 1 0.23210100 0.39085100 0.33417500 1.0 Al Al26 1 0.60914900 0.84125000 0.33417500 1.0 Al Al27 1 0.76789900 0.15875000 0.33417500 1.0 Al Al28 1 0.39085100 0.23210100 0.33417500 1.0 Al Al29 1 0.84125000 0.60914900 0.33417500 1.0 Al Al30 1 0.84125000 0.23210100 0.66582500 1.0 Al Al31 1 0.76789900 0.60914900 0.66582500 1.0 Al Al32 1 0.39085100 0.15875000 0.66582500 1.0 Al Al33 1 0.23210100 0.84125000 0.66582500 1.0 Al Al34 1 0.60914900 0.76789900 0.66582500 1.0 Al Al35 1 0.15875000 0.39085100 0.66582500 1.0 Al Al36 1 0.84554900 0.84554900 0.38357400 1.0 Al Al37 1 0.15445100 0.00000000 0.38357400 1.0 Al Al38 1 0.00000000 0.15445100 0.38357400 1.0 Al Al39 1 0.15445100 0.15445100 0.61642600 1.0 Al Al40 1 0.84554900 0.00000000 0.61642600 1.0 Al Al41 1 0.00000000 0.84554900 0.61642600 1.0 Al Al42 1 0.15445100 0.15445100 0.88357400 1.0 Al Al43 1 0.84554900 0.00000000 0.88357400 1.0 Al Al44 1 0.00000000 0.84554900 0.88357400 1.0 Al Al45 1 0.84554900 0.84554900 0.11642600 1.0 Al Al46 1 0.15445100 0.00000000 0.11642600 1.0 Al Al47 1 0.00000000 0.15445100 0.11642600 1.0 Al Al48 1 0.75045600 0.75045600 0.96926200 1.0 Al Al49 1 0.24954400 0.00000000 0.96926200 1.0 Al Al50 1 0.00000000 0.24954400 0.96926200 1.0 Al Al51 1 0.24954400 0.24954400 0.03073800 1.0 Al Al52 1 0.75045600 0.00000000 0.03073800 1.0 Al Al53 1 0.00000000 0.75045600 0.03073800 1.0 Al Al54 1 0.24954400 0.24954400 0.46926200 1.0 Al Al55 1 0.75045600 0.00000000 0.46926200 1.0 Al Al56 1 0.00000000 0.75045600 0.46926200 1.0 Al Al57 1 0.75045600 0.75045600 0.53073800 1.0 Al Al58 1 0.24954400 0.00000000 0.53073800 1.0 Al Al59 1 0.00000000 0.24954400 0.53073800 1.0 Al Al60 1 0.85541600 0.45265700 0.75000000 1.0 Al Al61 1 0.54734300 0.40276000 0.75000000 1.0 Al Al62 1 0.59724000 0.14458400 0.75000000 1.0 Al Al63 1 0.45265700 0.85541600 0.75000000 1.0 Al Al64 1 0.40276000 0.54734300 0.75000000 1.0 Al Al65 1 0.14458400 0.59724000 0.75000000 1.0 Al Al66 1 0.14458400 0.54734300 0.25000000 1.0 Al Al67 1 0.45265700 0.59724000 0.25000000 1.0 Al Al68 1 0.40276000 0.85541600 0.25000000 1.0 Al Al69 1 0.54734300 0.14458400 0.25000000 1.0 Al Al70 1 0.59724000 0.45265700 0.25000000 1.0 Al Al71 1 0.85541600 0.40276000 0.25000000 1.0 Al Al72 1 0.75338900 0.24661100 0.00000000 1.0 Al Al73 1 0.75338900 0.50677800 0.00000000 1.0 Al Al74 1 0.49322200 0.24661100 0.00000000 1.0 Al Al75 1 0.24661100 0.75338900 0.00000000 1.0 Al Al76 1 0.50677800 0.75338900 0.00000000 1.0 Al Al77 1 0.24661100 0.49322200 0.00000000 1.0 Al Al78 1 0.24661100 0.75338900 0.50000000 1.0 Al Al79 1 0.24661100 0.49322200 0.50000000 1.0 Al Al80 1 0.50677800 0.75338900 0.50000000 1.0 Al Al81 1 0.75338900 0.24661100 0.50000000 1.0 Al Al82 1 0.49322200 0.24661100 0.50000000 1.0 Al Al83 1 0.75338900 0.50677800 0.50000000 1.0 Al Al84 1 0.66666700 0.33333300 0.87242500 1.0 Al Al85 1 0.33333300 0.66666700 0.87242500 1.0 Al Al86 1 0.33333300 0.66666700 0.12757500 1.0 Al Al87 1 0.66666700 0.33333300 0.12757500 1.0 Al Al88 1 0.33333300 0.66666700 0.37242500 1.0 Al Al89 1 0.66666700 0.33333300 0.37242500 1.0 Al Al90 1 0.66666700 0.33333300 0.62757500 1.0 Al Al91 1 0.33333300 0.66666700 0.62757500 1.0 Al Al92 1 0.85525800 0.85525800 0.75000000 1.0 Al Al93 1 0.14474200 0.00000000 0.75000000 1.0 Al Al94 1 0.00000000 0.14474200 0.75000000 1.0 Al Al95 1 0.14474200 0.14474200 0.25000000 1.0 Al Al96 1 0.85525800 0.00000000 0.25000000 1.0 Al Al97 1 0.00000000 0.85525800 0.25000000 1.0 Cr Cr98 1 0.26969100 0.26969100 0.75000000 1.0 Cr Cr99 1 0.73030900 0.00000000 0.75000000 1.0 Cr Cr100 1 0.00000000 0.73030900 0.75000000 1.0 Cr Cr101 1 0.73030900 0.73030900 0.25000000 1.0 Cr Cr102 1 0.26969100 0.00000000 0.25000000 1.0 Cr Cr103 1 0.00000000 0.26969100 0.25000000 1.0 Cr Cr104 1 0.00000000 0.00000000 0.00000000 1.0 Cr Cr105 1 0.00000000 0.00000000 0.50000000 1.0