data_[Ga4P8H4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ga  1.8100  1.3000  0.7600
  P  2.1900  1.0000  0.5500
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [C2]
_cell_length_a [9.8156]
_cell_length_b [5.3265]
_cell_length_c [5.4489]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.4378]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [5]
_chemical_formula_structural [GaP2H]
_chemical_formula_sum '[Ga4 P8 H4]'
_cell_volume [277.0819]
_cell_formula_units_Z [4]
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  4  0.2384  0.6865  0.2313  1
  P  P1  4  0.1178  0.8526  0.8349  1
  P  P2  4  0.1208  0.5516  0.5647  1
  H  H3  2  0.0000  0.2571  0.0000  1
  H  H4  2  0.0000  0.3997  0.0000  1
]