data_VFe2Bi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.31
_cell_length_b   4.31
_cell_length_c   5.12
_cell_angle_alpha   101.15
_cell_angle_beta   101.15
_cell_angle_gamma   41.42
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VFe2Bi
_chemical_formula_sum   'V1 Fe2 Bi1'
_cell_volume   61.5
_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
  Fe  Fe1  1  0.7  0.0  0.9  1.0
  Fe  Fe2  1  0.29  0.0  0.11  1.0
  Bi  Bi0  1  0.5  0.0  0.51  1.0

data_VFe2Bi
_symmetry_space_group_name_H-M   P-1
_cell_length_a   3.05
_cell_length_b   4.31
_cell_length_c   5.12
_cell_angle_alpha   101.15
_cell_angle_beta   90.0
_cell_angle_gamma   110.71
_symmetry_Int_Tables_number   2
_chemical_formula_structural   VFe2Bi
_chemical_formula_sum   'V1 Fe2 Bi1'
_cell_volume   61.5
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-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
  Fe  Fe1  2  0.0  0.3  0.1  1.0
  Bi  Bi2  1  0.0  0.5  0.5  1.0

V Fe Fe Bi