# generated using pymatgen
data_GaAs
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.18930883
_cell_length_b   9.18930883
_cell_length_c   9.29552328
_cell_angle_alpha   71.35524773
_cell_angle_beta   71.35524773
_cell_angle_gamma   73.87318544
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaAs
_chemical_formula_sum   'Ga8 As8'
_cell_volume   691.11361409
_cell_formula_units_Z   8
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  1  0.13669600  0.13669600  0.21854000  1.0
  Ga  Ga1  1  0.47510000  0.47510000  0.13605800  1.0
  Ga  Ga2  1  0.13848000  0.46753700  0.47923900  1.0
  Ga  Ga3  1  0.42609700  0.70796000  0.42670200  1.0
  Ga  Ga4  1  0.46753700  0.13848000  0.47923900  1.0
  Ga  Ga5  1  0.70796000  0.42609700  0.42670200  1.0
  Ga  Ga6  1  0.42583300  0.42583300  0.72006900  1.0
  Ga  Ga7  1  0.71587700  0.71587700  0.68381300  1.0
  As  As8  1  0.29485700  0.29485700  0.30547300  1.0
  As  As9  1  0.61909400  0.61909400  0.20216300  1.0
  As  As10  1  0.20041200  0.60829100  0.62639300  1.0
  As  As11  1  0.53302400  0.86687400  0.51627500  1.0
  As  As12  1  0.60829100  0.20041200  0.62639300  1.0
  As  As13  1  0.86687400  0.53302400  0.51627500  1.0
  As  As14  1  0.53420100  0.53420100  0.86078800  1.0
  As  As15  1  0.84966900  0.84966900  0.77588400  1.0