# generated using pymatgen data_Li6Al13Cu8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.95783700 _cell_length_b 12.71417800 _cell_length_c 12.71417800 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li6Al13Cu8 _chemical_formula_sum 'Li12 Al26 Cu16' _cell_volume 801.43594854 _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 Li Li0 1 0.00000000 0.58314400 0.08314400 1.0 Li Li1 1 0.00000000 0.41685600 0.91685600 1.0 Li Li2 1 0.00000000 0.91685600 0.58314400 1.0 Li Li3 1 0.00000000 0.08314400 0.41685600 1.0 Li Li4 1 0.50000000 0.21647900 0.71647900 1.0 Li Li5 1 0.50000000 0.78352100 0.28352100 1.0 Li Li6 1 0.50000000 0.28352100 0.21647900 1.0 Li Li7 1 0.50000000 0.71647900 0.78352100 1.0 Li Li8 1 0.50000000 0.64172600 0.14172600 1.0 Li Li9 1 0.50000000 0.35827400 0.85827400 1.0 Li Li10 1 0.50000000 0.85827400 0.64172600 1.0 Li Li11 1 0.50000000 0.14172600 0.35827400 1.0 Al Al12 1 0.50000000 0.09435500 0.11691700 1.0 Al Al13 1 0.50000000 0.90564500 0.88308300 1.0 Al Al14 1 0.50000000 0.88308300 0.09435500 1.0 Al Al15 1 0.50000000 0.40564500 0.61691700 1.0 Al Al16 1 0.50000000 0.11691700 0.90564500 1.0 Al Al17 1 0.50000000 0.59435500 0.38308300 1.0 Al Al18 1 0.50000000 0.61691700 0.59435500 1.0 Al Al19 1 0.50000000 0.38308300 0.40564500 1.0 Al Al20 1 0.00000000 0.15016200 0.19316700 1.0 Al Al21 1 0.00000000 0.84983800 0.80683300 1.0 Al Al22 1 0.00000000 0.80683300 0.15016200 1.0 Al Al23 1 0.00000000 0.34983800 0.69316700 1.0 Al Al24 1 0.00000000 0.19316700 0.84983800 1.0 Al Al25 1 0.00000000 0.65016200 0.30683300 1.0 Al Al26 1 0.00000000 0.69316700 0.65016200 1.0 Al Al27 1 0.00000000 0.30683300 0.34983800 1.0 Al Al28 1 0.50000000 0.07354400 0.57354400 1.0 Al Al29 1 0.50000000 0.92645600 0.42645600 1.0 Al Al30 1 0.50000000 0.42645600 0.07354400 1.0 Al Al31 1 0.50000000 0.57354400 0.92645600 1.0 Al Al32 1 0.00000000 0.13724700 0.63724700 1.0 Al Al33 1 0.00000000 0.86275300 0.36275300 1.0 Al Al34 1 0.00000000 0.36275300 0.13724700 1.0 Al Al35 1 0.00000000 0.63724700 0.86275300 1.0 Al Al36 1 0.00000000 0.00000000 0.00000000 1.0 Al Al37 1 0.00000000 0.50000000 0.50000000 1.0 Cu Cu38 1 0.25087900 0.24274700 0.02250300 1.0 Cu Cu39 1 0.74912100 0.75725300 0.97749700 1.0 Cu Cu40 1 0.25087900 0.75725300 0.97749700 1.0 Cu Cu41 1 0.25087900 0.97749700 0.24274700 1.0 Cu Cu42 1 0.74912100 0.25725300 0.52250300 1.0 Cu Cu43 1 0.74912100 0.24274700 0.02250300 1.0 Cu Cu44 1 0.74912100 0.02250300 0.75725300 1.0 Cu Cu45 1 0.25087900 0.74274700 0.47749700 1.0 Cu Cu46 1 0.25087900 0.02250300 0.75725300 1.0 Cu Cu47 1 0.74912100 0.74274700 0.47749700 1.0 Cu Cu48 1 0.74912100 0.97749700 0.24274700 1.0 Cu Cu49 1 0.25087900 0.25725300 0.52250300 1.0 Cu Cu50 1 0.74912100 0.52250300 0.74274700 1.0 Cu Cu51 1 0.25087900 0.47749700 0.25725300 1.0 Cu Cu52 1 0.74912100 0.47749700 0.25725300 1.0 Cu Cu53 1 0.25087900 0.52250300 0.74274700 1.0