data_VRe2Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.62
_cell_length_b   4.26
_cell_length_c   5.02
_cell_angle_alpha   90.0
_cell_angle_beta   101.41
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VRe2Ni
_chemical_formula_sum   'V1 Re2 Ni1'
_cell_volume   54.83
_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  V3  1  0.69  0.0  0.49  1.0
  Re  Re1  1  0.57  0.0  0.9  1.0
  Re  Re2  1  0.57  0.13  0.27  1.0
  Ni  Ni0  1  0.23  0.13  0.65  1.0

data_VRe2Ni
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.62
_cell_length_b   4.26
_cell_length_c   5.02
_cell_angle_alpha   90.0
_cell_angle_beta   101.41
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VRe2Ni
_chemical_formula_sum   'V1 Re2 Ni1'
_cell_volume   54.83
_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  0.69  0.0  0.49  1.0
  Re  Re1  1  0.57  0.0  0.9  1.0
  Re  Re2  1  0.57  0.13  0.27  1.0
  Ni  Ni3  1  0.23  0.13  0.65  1.0

V Re Re Ni