# generated using pymatgen
data_Sc5Si2GeH
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.91809141
_cell_length_b   7.91751031
_cell_length_c   5.78020224
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99757300
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc5Si2GeH
_chemical_formula_sum   'Sc10 Si4 Ge2 H2'
_cell_volume   313.82926128
_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  0.66782320  0.33426375  0.00258879  1.0
  Sc  Sc1  1  0.33217680  0.66644155  0.00258879  1.0
  Sc  Sc2  1  0.33217680  0.66644155  0.49741121  1.0
  Sc  Sc3  1  0.66782320  0.33426375  0.49741121  1.0
  Sc  Sc4  1  0.75273164  0.75071953  0.75000000  1.0
  Sc  Sc5  1  0.24726836  0.99798788  0.75000000  1.0
  Sc  Sc6  1  0.00000000  0.25056407  0.75000000  1.0
  Sc  Sc7  1  0.24953936  0.24923034  0.25000000  1.0
  Sc  Sc8  1  0.75046064  0.99969097  0.25000000  1.0
  Sc  Sc9  1  0.00000000  0.75109187  0.25000000  1.0
  Si  Si10  1  0.00000000  0.60947162  0.75000000  1.0
  Si  Si11  1  0.61084546  0.61126412  0.25000000  1.0
  Si  Si12  1  0.38915454  0.00041766  0.25000000  1.0
  Si  Si13  1  0.00000000  0.38952762  0.25000000  1.0
  Ge  Ge14  1  0.38944933  0.38904492  0.75000000  1.0
  Ge  Ge15  1  0.61055067  0.99959559  0.75000000  1.0
  H  H16  1  0.00000000  0.99999061  0.50118118  1.0
  H  H17  1  0.00000000  0.99999061  0.99881882  1.0