data_NiGe2Pd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.83
_cell_length_b   4.83
_cell_length_c   4.42
_cell_angle_alpha   98.54
_cell_angle_beta   98.54
_cell_angle_gamma   35.59
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NiGe2Pd
_chemical_formula_sum   'Ni1 Ge2 Pd1'
_cell_volume   59.24
_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
  Ni  Ni2  1  0.25  0.0  0.99  1.0
  Ge  Ge0  1  0.5  0.0  0.17  1.0
  Ge  Ge1  1  0.81  0.0  0.34  1.0
  Pd  Pd3  1  0.73  0.0  0.4  1.0

data_NiGe2Pd
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.95
_cell_length_b   4.42
_cell_length_c   4.83
_cell_angle_alpha   98.54
_cell_angle_beta   107.79
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NiGe2Pd
_chemical_formula_sum   'Ni1 Ge2 Pd1'
_cell_volume   59.24
_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
  Ni  Ni0  1  0.0  0.99  0.25  1.0
  Ge  Ge1  1  0.0  0.17  0.5  1.0
  Ge  Ge2  1  0.0  0.34  0.81  1.0
  Pd  Pd3  1  0.0  0.4  0.73  1.0

Ni Ge Ge Pd