# generated using pymatgen
data_ScNiGe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.06859255
_cell_length_b   6.46959684
_cell_length_c   7.03810110
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScNiGe
_chemical_formula_sum   'Sc4 Ni4 Ge4'
_cell_volume   185.25797754
_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
  Sc  Sc0  1  0.75000000  0.50632177  0.70714468  1.0
  Sc  Sc1  1  0.25000000  0.49367823  0.29285532  1.0
  Sc  Sc2  1  0.75000000  0.00632177  0.79285532  1.0
  Sc  Sc3  1  0.25000000  0.99367823  0.20714468  1.0
  Ni  Ni4  1  0.75000000  0.81154276  0.42057627  1.0
  Ni  Ni5  1  0.25000000  0.18845724  0.57942373  1.0
  Ni  Ni6  1  0.75000000  0.31154276  0.07942373  1.0
  Ni  Ni7  1  0.25000000  0.68845724  0.92057627  1.0
  Ge  Ge8  1  0.75000000  0.20335945  0.40758445  1.0
  Ge  Ge9  1  0.25000000  0.79664055  0.59241555  1.0
  Ge  Ge10  1  0.75000000  0.70335945  0.09241555  1.0
  Ge  Ge11  1  0.25000000  0.29664055  0.90758445  1.0