data_[La2Zr2Ge2As2H2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Zr  1.3300  1.5500  0.8600
  Ge  2.0100  1.2500  0.7700
  As  2.1800  1.1500  0.6600
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [Imm2]
_cell_length_a [3.5592]
_cell_length_b [3.8809]
_cell_length_c [14.5403]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [44]
_chemical_formula_structural [LaZrGeAsH]
_chemical_formula_sum '[La2 Zr2 Ge2 As2 H2]'
_cell_volume [200.8421]
_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
[
  La  La0  2  0.0000  0.0000  0.7194  1
  Zr  Zr1  2  0.0000  0.5000  0.4663  1
  Ge  Ge2  2  0.0000  0.0000  0.3291  1
  As  As3  2  0.0000  0.5000  0.0453  1
  H  H4  2  0.0000  0.0000  0.8913  1
]