data_V3Fe4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.63
_cell_length_b   5.63
_cell_length_c   6.17
_cell_angle_alpha   111.42
_cell_angle_beta   111.42
_cell_angle_gamma   25.84
_symmetry_Int_Tables_number   1
_chemical_formula_structural   V3Fe4
_chemical_formula_sum   'V3 Fe4'
_cell_volume   78.96
_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  V4  1  0.0  0.0  0.0  1.0
  V  V5  1  0.58  0.0  0.45  1.0
  V  V6  1  0.09  0.0  0.27  1.0
  Fe  Fe0  1  0.62  0.0  0.08  1.0
  Fe  Fe1  1  0.16  0.0  0.9  1.0
  Fe  Fe2  1  0.51  0.0  0.82  1.0
  Fe  Fe3  1  0.04  0.0  0.63  1.0

data_V3Fe4
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.52
_cell_length_b   5.63
_cell_length_c   6.17
_cell_angle_alpha   111.42
_cell_angle_beta   90.0
_cell_angle_gamma   102.92
_symmetry_Int_Tables_number   1
_chemical_formula_structural   V3Fe4
_chemical_formula_sum   'V3 Fe4'
_cell_volume   78.96
_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
  V  V1  1  0.0  0.42  0.55  1.0
  V  V2  1  0.0  0.91  0.73  1.0
  Fe  Fe3  1  0.0  0.38  0.92  1.0
  Fe  Fe4  1  0.0  0.49  0.18  1.0
  Fe  Fe5  1  0.0  0.84  0.1  1.0
  Fe  Fe6  1  0.0  0.96  0.37  1.0

V V V Fe Fe Fe Fe