data_NbGe2Pd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.86
_cell_length_b   2.86
_cell_length_c   8.48
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   92.29
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbGe2Pd
_chemical_formula_sum   'Nb1 Ge2 Pd1'
_cell_volume   69.12
_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
  Nb  Nb2  1  0.0  0.0  0.15  1.0
  Ge  Ge0  1  0.0  0.0  0.25  1.0
  Ge  Ge1  1  0.98  0.0  0.19  1.0
  Pd  Pd3  1  0.98  0.0  0.12  1.0

data_NbGe2Pd
_symmetry_space_group_name_H-M   Pm
_cell_length_a   2.86
_cell_length_b   2.86
_cell_length_c   8.48
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   NbGe2Pd
_chemical_formula_sum   'Nb1 Ge2 Pd1'
_cell_volume   69.17
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '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
  Nb  Nb0  1  0.0  0.0  0.15  1.0
  Ge  Ge1  1  0.0  0.0  0.25  1.0
  Ge  Ge2  1  0.98  0.0  0.19  1.0
  Pd  Pd3  1  0.98  0.0  0.12  1.0

Nb Ge Ge Pd