data_VZn3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.43
_cell_length_b   5.43
_cell_length_c   8.92
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VZn3
_chemical_formula_sum   'V4 Zn12'
_cell_volume   227.52
_cell_formula_units_Z   4
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  0.0  0.46  1.0
  V  V2  1  0.0  0.13  0.23  1.0
  V  V3  1  0.71  0.57  0.69  1.0
  Zn  Zn4  1  0.64  0.35  0.0  1.0
  Zn  Zn5  1  0.64  0.35  0.46  1.0
  Zn  Zn6  1  0.0  0.57  0.69  1.0
  Zn  Zn7  1  0.64  0.92  0.69  1.0
  Zn  Zn8  1  0.36  0.78  0.23  1.0
  Zn  Zn9  1  0.71  0.0  0.0  1.0
  Zn  Zn10  1  0.71  0.0  0.46  1.0
  Zn  Zn11  1  0.36  0.35  0.0  1.0
  Zn  Zn12  1  0.36  0.35  0.46  1.0
  Zn  Zn13  1  0.36  0.92  0.69  1.0
  Zn  Zn14  1  0.07  0.78  0.23  1.0
  Zn  Zn15  1  0.71  0.13  0.23  1.0

data_VZn3
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.43
_cell_length_b   5.43
_cell_length_c   8.92
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VZn3
_chemical_formula_sum   'V4 Zn12'
_cell_volume   227.52
_cell_formula_units_Z   4
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  0.0  0.46  1.0
  V  V2  1  0.0  0.13  0.23  1.0
  V  V3  1  0.71  0.57  0.69  1.0
  Zn  Zn4  1  0.0  0.57  0.69  1.0
  Zn  Zn5  1  0.07  0.78  0.23  1.0
  Zn  Zn6  1  0.36  0.78  0.23  1.0
  Zn  Zn7  1  0.36  0.35  -0.0  1.0
  Zn  Zn8  1  0.36  0.35  0.46  1.0
  Zn  Zn9  1  0.36  0.92  0.69  1.0
  Zn  Zn10  1  0.64  0.92  0.69  1.0
  Zn  Zn11  1  0.64  0.35  0.0  1.0
  Zn  Zn12  1  0.64  0.35  0.46  1.0
  Zn  Zn13  1  0.71  0.0  -0.0  1.0
  Zn  Zn14  1  0.71  0.0  0.46  1.0
  Zn  Zn15  1  0.71  0.13  0.23  1.0

V V V V Zn Zn Zn Zn Zn Zn Zn Zn Zn Zn Zn Zn
V V V V Zn Zn Zn Zn Zn Zn Zn Zn Zn Zn Zn Zn 0 9 - o o 1 10 - o o 2 15 - o o 3 6 + o o 4 11 o o o 5 12 o o o 7 13 o o o 8 14 o o o 