data_V4Fe5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.68
_cell_length_b   5.68
_cell_length_c   5.68
_cell_angle_alpha   95.93
_cell_angle_beta   95.93
_cell_angle_gamma   142.5
_symmetry_Int_Tables_number   1
_chemical_formula_structural   V4Fe5
_chemical_formula_sum   'V4 Fe5'
_cell_volume   105.49
_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  V5  1  0.0  0.38  0.0  1.0
  V  V6  1  0.0  0.23  0.0  1.0
  V  V7  1  0.38  0.0  0.0  1.0
  V  V8  1  0.23  0.0  0.0  1.0
  Fe  Fe0  1  0.0  0.0  0.0  1.0
  Fe  Fe1  1  0.56  0.56  0.0  1.0
  Fe  Fe2  1  0.76  0.24  0.82  1.0
  Fe  Fe3  1  0.24  0.76  0.82  1.0
  Fe  Fe4  1  0.24  0.24  0.82  1.0

data_V4Fe5
_symmetry_space_group_name_H-M   Cm
_cell_length_a   3.65
_cell_length_b   10.75
_cell_length_c   5.68
_cell_angle_alpha   90.0
_cell_angle_beta   108.75
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   V4Fe5
_chemical_formula_sum   'V8 Fe10'
_cell_volume   210.98
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  4  0.31  0.31  -0.0  1.0
  V  V1  4  0.39  0.39  -0.0  1.0
  Fe  Fe2  4  0.32  0.26  0.82  1.0
  Fe  Fe3  2  0.0  0.0  0.0  1.0
  Fe  Fe4  2  0.09  0.5  0.82  1.0
  Fe  Fe5  2  0.44  0.0  -0.0  1.0

V V V V Fe Fe Fe Fe Fe