# generated using pymatgen
data_ScAlGe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.34805957
_cell_length_b   5.34805957
_cell_length_c   5.51323538
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   137.07189333
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScAlGe
_chemical_formula_sum   'Sc2 Al2 Ge2'
_cell_volume   107.39825423
_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
  Sc  Sc0  1  0.68782887  0.31217113  0.25000000  1.0
  Sc  Sc1  1  0.31217113  0.68782887  0.75000000  1.0
  Al  Al2  1  0.00000000  0.00000000  0.50000000  1.0
  Al  Al3  1  0.00000000  0.00000000  0.00000000  1.0
  Ge  Ge4  1  0.38544488  0.61455512  0.25000000  1.0
  Ge  Ge5  1  0.61455512  0.38544488  0.75000000  1.0