data_LaVZn
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.88
_cell_length_b   5.88
_cell_length_c   5.88
_cell_angle_alpha   148.58
_cell_angle_beta   143.11
_cell_angle_gamma   49.22
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaVZn
_chemical_formula_sum   'La1 V1 Zn1'
_cell_volume   63.46
_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
  La  La0  1  0.0  0.0  0.02  1.0
  V  V1  1  0.0  0.0  0.52  1.0
  Zn  Zn2  1  0.0  0.0  0.16  1.0

data_LaVZn
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.19
_cell_length_b   3.72
_cell_length_c   5.88
_cell_angle_alpha   108.45
_cell_angle_beta   105.71
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaVZn
_chemical_formula_sum   'La1 V1 Zn1'
_cell_volume   63.46
_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
  La  La0  1  0.98  0.98  0.98  1.0
  V  V1  1  0.48  0.48  0.48  1.0
  Zn  Zn2  1  0.84  0.84  0.84  1.0

La V Zn
La V Zn 0 2 o o o 1 2 o o o 