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 [Cm]
_cell_length_a [8.7615]
_cell_length_b [6.3728]
_cell_length_c [6.7671]
_cell_angle_alpha [90.0000]
_cell_angle_beta [127.4457]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [GaP2H]
_chemical_formula_sum '[Ga4 P8 H4]'
_cell_volume [299.9811]
_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  2  0.0889  0.5000  0.8799  1
  Ga  Ga1  2  0.3627  0.5000  0.3347  1
  P  P2  4  0.1250  0.2506  0.6393  1
  P  P3  2  0.3030  0.5000  0.6448  1
  P  P4  2  0.3198  0.0000  0.8958  1
  H  H5  2  0.1853  0.0000  0.2030  1
  H  H6  2  0.2076  0.0000  0.3300  1
]