data_V5Zn
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.3
_cell_length_b   5.3
_cell_length_c   6.68
_cell_angle_alpha   101.1
_cell_angle_beta   101.1
_cell_angle_gamma   26.48
_symmetry_Int_Tables_number   1
_chemical_formula_structural   V5Zn
_chemical_formula_sum   'V5 Zn1'
_cell_volume   81.96
_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  0.93  0.0  0.43  1.0
  V  V1  1  0.73  0.0  0.93  1.0
  V  V2  1  0.34  0.0  0.09  1.0
  V  V3  1  0.83  0.0  0.16  1.0
  V  V4  1  0.5  0.0  0.22  1.0
  Zn  Zn5  1  0.27  0.0  0.28  1.0

data_V5Zn
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.43
_cell_length_b   5.3
_cell_length_c   6.68
_cell_angle_alpha   101.1
_cell_angle_beta   90.0
_cell_angle_gamma   103.24
_symmetry_Int_Tables_number   1
_chemical_formula_structural   V5Zn
_chemical_formula_sum   'V5 Zn1'
_cell_volume   81.96
_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  0.07  0.57  1.0
  V  V1  1  0.0  0.17  0.84  1.0
  V  V2  1  0.0  0.27  0.07  1.0
  V  V3  1  0.0  0.5  0.78  1.0
  V  V4  1  0.0  0.66  0.91  1.0
  Zn  Zn5  1  0.0  0.73  0.72  1.0

V V V V V Zn
V V V V V Zn 0 3 o o o 1 3 o o + 2 4 o o o 2 5 o o o 3 4 o o o 4 5 o o o 