# generated using pymatgen
data_Ca(BeGe)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.02963500
_cell_length_b   4.02963500
_cell_length_c   9.88658700
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca(BeGe)2
_chemical_formula_sum   'Ca2 Be4 Ge4'
_cell_volume   160.53798678
_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
  Ca  Ca0  1  0.50000000  0.00000000  0.74568300  1.0
  Ca  Ca1  1  0.00000000  0.50000000  0.25431700  1.0
  Be  Be2  1  0.00000000  0.50000000  0.86466300  1.0
  Be  Be3  1  0.50000000  0.00000000  0.13533700  1.0
  Be  Be4  1  0.50000000  0.50000000  0.50000000  1.0
  Be  Be5  1  0.00000000  0.00000000  0.50000000  1.0
  Ge  Ge6  1  0.50000000  0.50000000  0.00000000  1.0
  Ge  Ge7  1  0.00000000  0.00000000  0.00000000  1.0
  Ge  Ge8  1  0.50000000  0.00000000  0.36765700  1.0
  Ge  Ge9  1  0.00000000  0.50000000  0.63234300  1.0