# generated using pymatgen data_Nd6Al43V4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.06945951 _cell_length_b 11.06945951 _cell_length_c 17.83025300 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999707 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd6Al43V4 _chemical_formula_sum 'Nd12 Al86 V8' _cell_volume 1892.08647873 _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 Nd Nd0 1 0.52854300 0.00000000 0.59554600 1.0 Nd Nd1 1 0.47145700 0.00000000 0.40445400 1.0 Nd Nd2 1 0.00000000 0.52854300 0.59554600 1.0 Nd Nd3 1 0.47145700 0.00000000 0.09554600 1.0 Nd Nd4 1 0.00000000 0.52854300 0.90445400 1.0 Nd Nd5 1 0.00000000 0.47145700 0.40445400 1.0 Nd Nd6 1 0.52854300 0.00000000 0.90445400 1.0 Nd Nd7 1 0.00000000 0.47145700 0.09554600 1.0 Nd Nd8 1 0.47145700 0.47145700 0.59554600 1.0 Nd Nd9 1 0.52854300 0.52854300 0.40445400 1.0 Nd Nd10 1 0.52854300 0.52854300 0.09554600 1.0 Nd Nd11 1 0.47145700 0.47145700 0.90445400 1.0 Al Al12 1 0.14609900 0.59796900 0.75000000 1.0 Al Al13 1 0.85390100 0.40203100 0.25000000 1.0 Al Al14 1 0.40203100 0.54813000 0.75000000 1.0 Al Al15 1 0.59796900 0.14609900 0.75000000 1.0 Al Al16 1 0.59796900 0.45187000 0.25000000 1.0 Al Al17 1 0.40203100 0.85390100 0.25000000 1.0 Al Al18 1 0.45187000 0.85390100 0.75000000 1.0 Al Al19 1 0.54813000 0.40203100 0.75000000 1.0 Al Al20 1 0.54813000 0.14609900 0.25000000 1.0 Al Al21 1 0.45187000 0.59796900 0.25000000 1.0 Al Al22 1 0.85390100 0.45187000 0.75000000 1.0 Al Al23 1 0.14609900 0.54813000 0.25000000 1.0 Al Al24 1 0.15461100 0.00000000 0.11617500 1.0 Al Al25 1 0.84538900 0.00000000 0.88382500 1.0 Al Al26 1 0.00000000 0.15461100 0.11617500 1.0 Al Al27 1 0.84538900 0.00000000 0.61617500 1.0 Al Al28 1 0.00000000 0.15461100 0.38382500 1.0 Al Al29 1 0.00000000 0.84538900 0.88382500 1.0 Al Al30 1 0.15461100 0.00000000 0.38382500 1.0 Al Al31 1 0.00000000 0.84538900 0.61617500 1.0 Al Al32 1 0.84538900 0.84538900 0.11617500 1.0 Al Al33 1 0.15461100 0.15461100 0.88382500 1.0 Al Al34 1 0.15461100 0.15461100 0.61617500 1.0 Al Al35 1 0.84538900 0.84538900 0.38382500 1.0 Al Al36 1 0.24709100 0.49418200 0.50000000 1.0 Al Al37 1 0.75290900 0.50581800 0.50000000 1.0 Al Al38 1 0.50581800 0.75290900 0.50000000 1.0 Al Al39 1 0.75290900 0.50581800 0.00000000 1.0 Al Al40 1 0.49418200 0.24709100 0.00000000 1.0 Al Al41 1 0.49418200 0.24709100 0.50000000 1.0 Al Al42 1 0.24709100 0.49418200 0.00000000 1.0 Al Al43 1 0.50581800 0.75290900 0.00000000 1.0 Al Al44 1 0.24709100 0.75290900 0.50000000 1.0 Al Al45 1 0.75290900 0.24709100 0.50000000 1.0 Al Al46 1 0.75290900 0.24709100 0.00000000 1.0 Al Al47 1 0.24709100 0.75290900 0.00000000 1.0 Al Al48 1 0.14398200 0.00000000 0.75000000 1.0 Al Al49 1 0.85601800 0.00000000 0.25000000 1.0 Al Al50 1 0.00000000 0.14398200 0.75000000 1.0 Al Al51 1 0.00000000 0.85601800 0.25000000 1.0 Al Al52 1 0.85601800 0.85601800 0.75000000 1.0 Al Al53 1 0.14398200 0.14398200 0.25000000 1.0 Al Al54 1 0.33333300 0.66666700 0.62848100 1.0 Al Al55 1 0.66666700 0.33333300 0.37151900 1.0 Al Al56 1 0.66666700 0.33333300 0.12848100 1.0 Al Al57 1 0.66666700 0.33333300 0.87151900 1.0 Al Al58 1 0.33333300 0.66666700 0.87151900 1.0 Al Al59 1 0.33333300 0.66666700 0.12848100 1.0 Al Al60 1 0.33333300 0.66666700 0.37151900 1.0 Al Al61 1 0.66666700 0.33333300 0.62848100 1.0 Al Al62 1 0.24965900 0.00000000 0.52965800 1.0 Al Al63 1 0.75034100 0.00000000 0.47034200 1.0 Al Al64 1 0.00000000 0.24965900 0.52965800 1.0 Al Al65 1 0.75034100 0.00000000 0.02965800 1.0 Al Al66 1 0.00000000 0.24965900 0.97034200 1.0 Al Al67 1 0.00000000 0.75034100 0.47034200 1.0 Al Al68 1 0.24965900 0.00000000 0.97034200 1.0 Al Al69 1 0.00000000 0.75034100 0.02965800 1.0 Al Al70 1 0.75034100 0.75034100 0.52965800 1.0 Al Al71 1 0.24965900 0.24965900 0.47034200 1.0 Al Al72 1 0.24965900 0.24965900 0.02965800 1.0 Al Al73 1 0.75034100 0.75034100 0.97034200 1.0 Al Al74 1 0.15696400 0.39033300 0.66746700 1.0 Al Al75 1 0.84303600 0.60966700 0.33253300 1.0 Al Al76 1 0.60966700 0.76663200 0.66746700 1.0 Al Al77 1 0.84303600 0.60966700 0.16746700 1.0 Al Al78 1 0.39033300 0.15696400 0.83253300 1.0 Al Al79 1 0.39033300 0.23336800 0.33253300 1.0 Al Al80 1 0.15696400 0.39033300 0.83253300 1.0 Al Al81 1 0.60966700 0.84303600 0.16746700 1.0 Al Al82 1 0.23336800 0.84303600 0.66746700 1.0 Al Al83 1 0.39033300 0.23336800 0.16746700 1.0 Al Al84 1 0.76663200 0.60966700 0.83253300 1.0 Al Al85 1 0.76663200 0.15696400 0.33253300 1.0 Al Al86 1 0.60966700 0.76663200 0.83253300 1.0 Al Al87 1 0.23336800 0.39033300 0.16746700 1.0 Al Al88 1 0.60966700 0.84303600 0.33253300 1.0 Al Al89 1 0.39033300 0.15696400 0.66746700 1.0 Al Al90 1 0.76663200 0.15696400 0.16746700 1.0 Al Al91 1 0.23336800 0.39033300 0.33253300 1.0 Al Al92 1 0.23336800 0.84303600 0.83253300 1.0 Al Al93 1 0.76663200 0.60966700 0.66746700 1.0 Al Al94 1 0.84303600 0.23336800 0.83253300 1.0 Al Al95 1 0.15696400 0.76663200 0.16746700 1.0 Al Al96 1 0.15696400 0.76663200 0.33253300 1.0 Al Al97 1 0.84303600 0.23336800 0.66746700 1.0 V V98 1 0.00000000 0.00000000 0.50000000 1.0 V V99 1 0.00000000 0.00000000 0.00000000 1.0 V V100 1 0.73258000 0.00000000 0.75000000 1.0 V V101 1 0.26742000 0.00000000 0.25000000 1.0 V V102 1 0.00000000 0.73258000 0.75000000 1.0 V V103 1 0.00000000 0.26742000 0.25000000 1.0 V V104 1 0.26742000 0.26742000 0.75000000 1.0 V V105 1 0.73258000 0.73258000 0.25000000 1.0