data_[Ca2Zr2Ge2O10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ca  1.0000  1.8000  1.1400
  Zr  1.3300  1.5500  0.8600
  Ge  2.0100  1.2500  0.7700
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.6718]
_cell_length_b [5.8192]
_cell_length_c [7.5447]
_cell_angle_alpha [104.1294]
_cell_angle_beta [102.0241]
_cell_angle_gamma [107.2027]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [CaZrGeO5]
_chemical_formula_sum '[Ca2 Zr2 Ge2 O10]'
_cell_volume [219.8506]
_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  2  0.1576  0.8233  0.7782  1.0
  Zr  Zr1  1  0.5000  0.5000  0.0000  1.0
  Zr  Zr2  1  0.5000  0.5000  0.5000  1.0
  Ge  Ge3  2  0.1837  0.8245  0.2505  1.0
  O  O4  2  0.1069  0.2463  0.9342  1.0
  O  O5  2  0.1850  0.6067  0.3780  1.0
  O  O6  2  0.2207  0.1234  0.4043  1.0
  O  O7  2  0.4019  0.5758  0.7497  1.0
  O  O8  2  0.4208  0.8346  0.1271  1.0
]