# generated using pymatgen
data_LiCa2Ge3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.41095098
_cell_length_b   10.71034719
_cell_length_c   11.35727260
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCa2Ge3
_chemical_formula_sum   'Li4 Ca8 Ge12'
_cell_volume   536.54954463
_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
  Li  Li0  1  0.50000000  0.13786262  0.71783311  1
  Li  Li1  1  0.50000000  0.86213738  0.28216689  1
  Li  Li2  1  -0.00000000  0.36213738  0.21783311  1
  Li  Li3  1  -0.00000000  0.63786262  0.78216689  1
  Ca  Ca4  1  0.00000000  0.05256619  0.14770604  1
  Ca  Ca5  1  0.50000000  0.17829292  0.42809288  1
  Ca  Ca6  1  0.00000000  0.94743381  0.85229396  1
  Ca  Ca7  1  -0.00000000  0.67829292  0.07190712  1
  Ca  Ca8  1  0.50000000  0.82170708  0.57190712  1
  Ca  Ca9  1  0.50000000  0.55256619  0.35229396  1
  Ca  Ca10  1  -0.00000000  0.32170708  0.92809288  1
  Ca  Ca11  1  0.50000000  0.44743381  0.64770604  1
  Ge  Ge12  1  0.00000000  0.25632276  0.64124909  1
  Ge  Ge13  1  0.50000000  0.47126660  0.10421750  1
  Ge  Ge14  1  0.50000000  0.24367724  0.14124909  1
  Ge  Ge15  1  0.50000000  0.52873340  0.89578250  1
  Ge  Ge16  1  0.50000000  0.11077986  0.95552080  1
  Ge  Ge17  1  0.50000000  0.75632276  0.85875091  1
  Ge  Ge18  1  0.00000000  0.02873340  0.60421750  1
  Ge  Ge19  1  0.00000000  0.61077986  0.54447920  1
  Ge  Ge20  1  0.00000000  0.74367724  0.35875091  1
  Ge  Ge21  1  -0.00000000  0.38922014  0.45552080  1
  Ge  Ge22  1  0.50000000  0.88922014  0.04447920  1
  Ge  Ge23  1  -0.00000000  0.97126660  0.39578250  1
