data_ReNiGe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.07
_cell_length_b   5.07
_cell_length_c   5.07
_cell_angle_alpha   143.07
_cell_angle_beta   133.37
_cell_angle_gamma   60.92
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ReNiGe2
_chemical_formula_sum   'Re1 Ni1 Ge2'
_cell_volume   56.22
_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
  Re  Re3  1  0.0  0.01  0.13  1.0
  Ni  Ni2  1  0.0  0.0  0.19  1.0
  Ge  Ge0  1  0.0  0.0  0.03  1.0
  Ge  Ge1  1  0.6  0.0  0.38  1.0

data_ReNiGe2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.21
_cell_length_b   4.01
_cell_length_c   5.07
_cell_angle_alpha   113.32
_cell_angle_beta   108.47
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ReNiGe2
_chemical_formula_sum   'Re1 Ni1 Ge2'
_cell_volume   56.22
_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
  Re  Re0  1  0.99  0.13  0.13  1.0
  Ni  Ni1  1  0.0  0.19  0.19  1.0
  Ge  Ge2  1  0.0  0.03  0.03  1.0
  Ge  Ge3  1  0.0  0.38  0.77  1.0

Re Ni Ge Ge