# generated using pymatgen
data_ScFeGe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.58513716
_cell_length_b   6.58526444
_cell_length_c   3.95167433
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99833628
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScFeGe
_chemical_formula_sum   'Sc3 Fe3 Ge3'
_cell_volume   148.40792822
_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
  Sc  Sc0  1  0.58396357  -0.00001110  0.50000000  1.0
  Sc  Sc1  1  0.41602525  0.41599458  0.50000000  1.0
  Sc  Sc2  1  0.00001936  0.58403453  0.50000000  1.0
  Fe  Fe3  1  0.22948771  0.99999351  0.00000000  1.0
  Fe  Fe4  1  0.77050879  0.77050871  0.00000000  1.0
  Fe  Fe5  1  0.99999359  0.22947267  0.00000000  1.0
  Ge  Ge6  1  0.99999321  0.00000031  0.50000000  1.0
  Ge  Ge7  1  0.33333563  0.66666643  0.00000000  1.0
  Ge  Ge8  1  0.66667290  0.33333936  0.00000000  1.0