# generated using pymatgen data_Al5Mo _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.94101567 _cell_length_b 4.94101567 _cell_length_c 43.98126600 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999563 _symmetry_Int_Tables_number 1 _chemical_formula_structural Al5Mo _chemical_formula_sum 'Al50 Mo10' _cell_volume 929.88842185 _cell_formula_units_Z 10 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 Al Al0 1 0.66655300 0.99167700 0.20000300 1.0 Al Al1 1 0.32315200 0.33431200 0.59984700 1.0 Al Al2 1 0.33333300 0.66666700 0.75023200 1.0 Al Al3 1 0.32512400 0.33344700 0.20000300 1.0 Al Al4 1 0.33136100 0.00864600 0.69987300 1.0 Al Al5 1 0.66666700 0.33333300 0.55163200 1.0 Al Al6 1 0.00000000 0.34439000 0.50000000 1.0 Al Al7 1 0.34439000 0.00000000 0.50000000 1.0 Al Al8 1 0.00000000 0.65762600 0.00000000 1.0 Al Al9 1 0.34237400 0.34237400 0.00000000 1.0 Al Al10 1 0.00000000 0.00000000 0.04849700 1.0 Al Al11 1 0.00000000 0.00000000 0.54837200 1.0 Al Al12 1 0.66666700 0.33333300 0.34824300 1.0 Al Al13 1 0.33333300 0.66666700 0.94819900 1.0 Al Al14 1 0.32271500 0.99135400 0.30012700 1.0 Al Al15 1 0.33333300 0.66666700 0.84985600 1.0 Al Al16 1 0.99167700 0.66655300 0.79999700 1.0 Al Al17 1 0.99135400 0.32271500 0.69987300 1.0 Al Al18 1 0.33333300 0.66666700 0.44836800 1.0 Al Al19 1 0.66543400 0.67549000 0.09988600 1.0 Al Al20 1 0.33456600 0.01005600 0.90011400 1.0 Al Al21 1 0.65561000 0.65561000 0.50000000 1.0 Al Al22 1 0.33431200 0.32315200 0.40015300 1.0 Al Al23 1 0.01116000 0.67684800 0.59984700 1.0 Al Al24 1 0.00000000 0.00000000 0.75008000 1.0 Al Al25 1 0.67728500 0.66863900 0.69987300 1.0 Al Al26 1 0.67487600 0.00832300 0.79999700 1.0 Al Al27 1 0.00832300 0.67487600 0.20000300 1.0 Al Al28 1 0.66666700 0.33333300 0.05180100 1.0 Al Al29 1 0.00000000 0.00000000 0.24992000 1.0 Al Al30 1 0.33333300 0.66666700 0.65175700 1.0 Al Al31 1 0.67549000 0.66543400 0.90011400 1.0 Al Al32 1 0.33344700 0.32512400 0.79999700 1.0 Al Al33 1 0.67684800 0.01116000 0.40015300 1.0 Al Al34 1 0.66568800 0.98884000 0.59984700 1.0 Al Al35 1 0.66666700 0.33333300 0.84986900 1.0 Al Al36 1 0.65762600 0.00000000 0.00000000 1.0 Al Al37 1 0.98884000 0.66568800 0.40015300 1.0 Al Al38 1 0.32451000 0.98994400 0.09988600 1.0 Al Al39 1 0.00000000 0.00000000 0.95150300 1.0 Al Al40 1 0.01005600 0.33456600 0.09988600 1.0 Al Al41 1 0.66666700 0.33333300 0.24976800 1.0 Al Al42 1 0.66666700 0.33333300 0.64854200 1.0 Al Al43 1 0.98994400 0.32451000 0.90011400 1.0 Al Al44 1 0.33333300 0.66666700 0.15013100 1.0 Al Al45 1 0.33333300 0.66666700 0.35145800 1.0 Al Al46 1 0.66863900 0.67728500 0.30012700 1.0 Al Al47 1 0.00000000 0.00000000 0.45162800 1.0 Al Al48 1 0.00864600 0.33136100 0.30012700 1.0 Al Al49 1 0.66666700 0.33333300 0.15014400 1.0 Mo Mo50 1 0.66666700 0.33333300 0.74921800 1.0 Mo Mo51 1 0.66666700 0.33333300 0.45024300 1.0 Mo Mo52 1 0.00000000 0.00000000 0.35098600 1.0 Mo Mo53 1 0.33333300 0.66666700 0.04929200 1.0 Mo Mo54 1 0.00000000 0.00000000 0.14934700 1.0 Mo Mo55 1 0.33333300 0.66666700 0.54975700 1.0 Mo Mo56 1 0.33333300 0.66666700 0.25078200 1.0 Mo Mo57 1 0.00000000 0.00000000 0.85065300 1.0 Mo Mo58 1 0.00000000 0.00000000 0.64901400 1.0 Mo Mo59 1 0.66666700 0.33333300 0.95070800 1.0