data_Zr2VGe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.39
_cell_length_b   5.39
_cell_length_c   4.4
_cell_angle_alpha   112.15
_cell_angle_beta   112.15
_cell_angle_gamma   39.2
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr2VGe
_chemical_formula_sum   'Zr2 V1 Ge1'
_cell_volume   74.15
_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  Zr2  1  0.33  0.0  0.03  1.0
  Zr  Zr3  1  0.16  0.0  0.05  1.0
  V  V1  1  0.28  0.0  0.13  1.0
  Ge  Ge0  1  0.06  0.0  0.88  1.0

data_Zr2VGe
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.62
_cell_length_b   4.4
_cell_length_c   5.39
_cell_angle_alpha   112.15
_cell_angle_beta   109.6
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr2VGe
_chemical_formula_sum   'Zr2 V1 Ge1'
_cell_volume   74.15
_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  0.0  0.03  0.33  1.0
  Zr  Zr1  1  0.0  0.05  0.16  1.0
  V  V2  1  0.0  0.13  0.28  1.0
  Ge  Ge3  1  0.0  0.88  0.06  1.0

Zr Zr V Ge