data_[Ga2Ni14As4H4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ga  1.8100  1.3000  0.7600
  Ni  1.9100  1.3500  0.7400
  As  2.1800  1.1500  0.6600
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [I4/mmm]
_cell_length_a [3.6104]
_cell_length_b [3.6104]
_cell_length_c [19.2958]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [139]
_chemical_formula_structural [GaNi7(AsH)2]
_chemical_formula_sum '[Ga2 Ni14 As4 H4]'
_cell_volume [251.5189]
_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
[
  Ga  Ga0  2  0.0000  0.0000  0.0000  1.0
  Ni  Ni1  8  0.0000  0.5000  0.0961  1.0
  Ni  Ni2  4  0.0000  0.0000  0.3080  1.0
  Ni  Ni3  2  0.0000  0.0000  0.5000  1.0
  As  As4  4  0.0000  0.0000  0.1866  1.0
  H  H5  4  0.0000  0.0000  0.4103  1.0
]