data_VGa2As
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.02
_cell_length_b   5.02
_cell_length_c   4.86
_cell_angle_alpha   100.31
_cell_angle_beta   100.31
_cell_angle_gamma   33.53
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VGa2As
_chemical_formula_sum   'V1 Ga2 As1'
_cell_volume   66.52
_cell_formula_units_Z   1
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
  V  V3  1  0.0  0.0  0.0  1.0
  Ga  Ga1  1  0.73  0.0  0.6  1.0
  Ga  Ga2  1  0.97  0.0  0.18  1.0
  As  As0  1  0.35  0.0  0.39  1.0

data_VGa2As
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.9
_cell_length_b   4.86
_cell_length_c   5.02
_cell_angle_alpha   100.31
_cell_angle_beta   106.77
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VGa2As
_chemical_formula_sum   'V1 Ga2 As1'
_cell_volume   66.52
_cell_formula_units_Z   1
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
  V  V0  1  0.0  0.0  0.0  1.0
  Ga  Ga1  1  0.0  0.18  0.97  1.0
  Ga  Ga2  1  0.0  0.6  0.73  1.0
  As  As3  1  0.0  0.39  0.35  1.0

V Ga Ga As