# generated using pymatgen data_Al7FeCu2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.25899564 _cell_length_b 6.25899710 _cell_length_c 14.64083926 _cell_angle_alpha 89.99998916 _cell_angle_beta 89.99999578 _cell_angle_gamma 90.00003213 _symmetry_Int_Tables_number 1 _chemical_formula_structural Al7FeCu2 _chemical_formula_sum 'Al28 Fe4 Cu8' _cell_volume 573.55539863 _cell_formula_units_Z 4 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 -0.00000008 -0.00000002 0.13334820 1.0 Al Al1 1 0.50000002 0.50000007 0.36662047 1.0 Al Al2 1 0.00000005 0.00000014 0.86671851 1.0 Al Al3 1 0.50000006 0.49999981 0.63330671 1.0 Al Al4 1 0.91424923 0.70588772 0.60030248 1.0 Al Al5 1 0.08575086 0.29411221 0.60030248 1.0 Al Al6 1 0.20587996 0.41423716 0.89971359 1.0 Al Al7 1 0.70588746 0.08575047 0.60030247 1.0 Al Al8 1 0.29411246 0.91424981 0.60030249 1.0 Al Al9 1 0.58576232 0.20587981 0.89971356 1.0 Al Al10 1 0.41423755 0.79412025 0.89971357 1.0 Al Al11 1 0.79411993 0.58576260 0.89971348 1.0 Al Al12 1 0.08571877 0.29402349 0.39963939 1.0 Al Al13 1 0.91428133 0.70597651 0.39963946 1.0 Al Al14 1 0.79403788 0.58572534 0.10034431 1.0 Al Al15 1 0.29402370 0.91428164 0.39963944 1.0 Al Al16 1 0.16374948 0.66378117 0.24999819 1.0 Al Al17 1 0.33621882 0.16374948 0.24999818 1.0 Al Al18 1 0.66378128 0.83625057 0.24999817 1.0 Al Al19 1 0.83625062 0.33621874 0.24999817 1.0 Al Al20 1 0.83623912 0.33622992 0.75000603 1.0 Al Al21 1 0.66376987 0.83623928 0.75000602 1.0 Al Al22 1 0.33623020 0.16376074 0.75000602 1.0 Al Al23 1 0.16376085 0.66377001 0.75000602 1.0 Al Al24 1 0.20596209 0.41427488 0.10034429 1.0 Al Al25 1 0.58572493 0.20596182 0.10034427 1.0 Al Al26 1 0.41427527 0.79403800 0.10034422 1.0 Al Al27 1 0.70597651 0.08571817 0.39963942 1.0 Fe Fe28 1 -0.00000002 0.00000005 0.29943705 1.0 Fe Fe29 1 0.50000003 0.49999994 0.20064457 1.0 Fe Fe30 1 0.00000007 -0.00000006 0.70054945 1.0 Fe Fe31 1 0.50000000 0.49999996 0.79938160 1.0 Cu Cu32 1 0.77251375 0.41356693 0.49987832 1.0 Cu Cu33 1 0.08643150 0.72750856 0.00011599 1.0 Cu Cu34 1 0.91356785 0.27249154 0.00011615 1.0 Cu Cu35 1 0.27248989 0.08643134 0.00011647 1.0 Cu Cu36 1 0.22748612 0.58643299 0.49987867 1.0 Cu Cu37 1 0.72750990 0.91356885 0.00011553 1.0 Cu Cu38 1 0.58643238 0.77251193 0.49987873 1.0 Cu Cu39 1 0.41356798 0.22748819 0.49987784 1.0