# generated using pymatgen data_MgAl3(FeRh3)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.23575340 _cell_length_b 5.98978553 _cell_length_c 12.72527696 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00065206 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural MgAl3(FeRh3)2 _chemical_formula_sum 'Mg2 Al6 Fe4 Rh12' _cell_volume 322.85623908 _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 Mg Mg0 1 0.00004932 0.00000000 0.99867862 1.0 Mg Mg1 1 0.49971918 0.50000000 0.16797927 1.0 Al Al2 1 0.99999837 0.50000000 0.00084594 1.0 Al Al3 1 0.49995003 0.00000000 0.16579867 1.0 Al Al4 1 0.99995767 0.50000000 0.33279006 1.0 Al Al5 1 0.50002817 0.00000000 0.50073180 1.0 Al Al6 1 0.00005010 0.50000000 0.66594707 1.0 Al Al7 1 0.50005514 0.00000000 0.83388392 1.0 Fe Fe8 1 0.99997706 0.00000000 0.33342642 1.0 Fe Fe9 1 0.50002614 0.50000000 0.49985582 1.0 Fe Fe10 1 0.00006896 0.00000000 0.66681453 1.0 Fe Fe11 1 0.50006661 0.50000000 0.83323835 1.0 Rh Rh12 1 0.50001047 0.25420636 0.99667404 1.0 Rh Rh13 1 0.50001047 0.74579464 0.99667404 1.0 Rh Rh14 1 0.99991339 0.24578754 0.16995077 1.0 Rh Rh15 1 0.99991339 0.75421346 0.16995077 1.0 Rh Rh16 1 0.49996331 0.24613310 0.33813164 1.0 Rh Rh17 1 0.49996331 0.75386790 0.33813164 1.0 Rh Rh18 1 0.00001907 0.25071270 0.50113581 1.0 Rh Rh19 1 0.00001907 0.74928830 0.50113581 1.0 Rh Rh20 1 0.50006089 0.24926805 0.66557480 1.0 Rh Rh21 1 0.50006089 0.75073295 0.66557480 1.0 Rh Rh22 1 0.00006100 0.25389819 0.82853770 1.0 Rh Rh23 1 0.00006100 0.74610281 0.82853770 1.0