data_[Ge2H8N2Cl6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ge  2.0100  1.2500  0.7700
  H  2.2000  0.2500  0.0000
  N  3.0400  0.6500  0.6300
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.6341]
_cell_length_b [7.3500]
_cell_length_c [8.5617]
_cell_angle_alpha [88.8020]
_cell_angle_beta [82.4087]
_cell_angle_gamma [86.3707]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [GeH4NCl3]
_chemical_formula_sum '[Ge2 H8 N2 Cl6]'
_cell_volume [350.7051]
_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
[
  Ge  Ge0  1  0.0938  0.0315  0.5014  1.0
  Ge  Ge1  1  0.1127  0.5110  0.0118  1.0
  H  H2  1  0.4539  0.4784  0.5731  1.0
  H  H3  1  0.5258  0.0694  0.0715  1.0
  H  H4  1  0.5733  0.6860  0.5448  1.0
  H  H5  1  0.5738  0.5720  0.7198  1.0
  H  H6  1  0.6977  0.8915  0.1341  1.0
  H  H7  1  0.7510  0.9610  0.9447  1.0
  H  H8  1  0.7566  0.4940  0.5616  1.0
  H  H9  1  0.8217  0.0901  0.0895  1.0
  N  N10  1  0.5898  0.5578  0.5977  1.0
  N  N11  1  0.6957  0.0036  0.0594  1.0
  Cl  Cl12  1  0.0188  0.6776  0.2438  1.0
  Cl  Cl13  1  0.0285  0.8532  0.7388  1.0
  Cl  Cl14  1  0.1018  0.3201  0.6255  1.0
  Cl  Cl15  1  0.1525  0.2146  0.1383  1.0
  Cl  Cl16  1  0.5181  0.9758  0.4645  1.0
  Cl  Cl17  1  0.5348  0.5507  0.9796  1.0
]