data_ZrVZn2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.0
_cell_length_b   4.3
_cell_length_c   5.24
_cell_angle_alpha   90.0
_cell_angle_beta   98.44
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrVZn2
_chemical_formula_sum   'Zr1 V1 Zn2'
_cell_volume   66.77
_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
  Zr  Zr3  1  0.08  0.15  0.46  1.0
  V  V0  1  0.15  0.0  0.11  1.0
  Zn  Zn1  1  0.81  0.15  0.07  1.0
  Zn  Zn2  1  0.53  0.0  0.32  1.0

data_ZrVZn2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.0
_cell_length_b   4.3
_cell_length_c   5.24
_cell_angle_alpha   90.0
_cell_angle_beta   98.44
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrVZn2
_chemical_formula_sum   'Zr1 V1 Zn2'
_cell_volume   66.77
_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
  Zr  Zr0  1  0.08  0.15  0.46  1.0
  V  V1  1  0.15  0.0  0.11  1.0
  Zn  Zn2  1  0.53  0.0  0.32  1.0
  Zn  Zn3  1  0.81  0.15  0.07  1.0

Zr V Zn Zn