# generated using pymatgen
data_MgSc2AlAu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.34713038
_cell_length_b   7.34713102
_cell_length_c   7.39864898
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000167
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgSc2AlAu2
_chemical_formula_sum   'Mg3 Sc6 Al3 Au6'
_cell_volume   345.87452741
_cell_formula_units_Z   3
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  0.75114282  0.75114282  0.00000000  1.0
  Mg  Mg1  1  0.24885718  1.00000000  0.00000000  1.0
  Mg  Mg2  1  0.00000000  0.24885718  0.00000000  1.0
  Sc  Sc3  1  0.59740822  0.99815859  0.74404634  1.0
  Sc  Sc4  1  0.00184141  0.59924963  0.74404634  1.0
  Sc  Sc5  1  0.40075037  0.40259178  0.74404634  1.0
  Sc  Sc6  1  0.99815859  0.59740822  0.25595366  1.0
  Sc  Sc7  1  0.59924963  0.00184141  0.25595366  1.0
  Sc  Sc8  1  0.40259178  0.40075037  0.25595366  1.0
  Al  Al9  1  0.72450861  0.72450861  0.50000000  1.0
  Al  Al10  1  0.27549139  0.00000000  0.50000000  1.0
  Al  Al11  1  1.00000000  0.27549139  0.50000000  1.0
  Au  Au12  1  0.00000000  0.00000000  0.72104898  1.0
  Au  Au13  1  0.00000000  0.00000000  0.27895102  1.0
  Au  Au14  1  0.66666700  0.33333300  0.99779894  1.0
  Au  Au15  1  0.66666700  0.33333300  0.50235413  1.0
  Au  Au16  1  0.33333300  0.66666700  0.49764587  1.0
  Au  Au17  1  0.33333300  0.66666700  0.00220106  1.0