data_MnNiGe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.54
_cell_length_b   2.69
_cell_length_c   5.51
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnNiGe
_chemical_formula_sum   'Mn2 Ni2 Ge2'
_cell_volume   111.93
_cell_formula_units_Z   2
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
  Mn  Mn2  1  0.0  0.0  0.0  1.0
  Mn  Mn3  1  0.77  0.0  0.0  1.0
  Ni  Ni4  1  0.89  0.0  0.03  1.0
  Ni  Ni5  1  0.66  0.0  0.48  1.0
  Ge  Ge0  1  0.66  0.0  0.97  1.0
  Ge  Ge1  1  0.89  0.0  0.54  1.0

data_MnNiGe
_symmetry_space_group_name_H-M   Pm
_cell_length_a   5.51
_cell_length_b   2.69
_cell_length_c   7.54
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   MnNiGe
_chemical_formula_sum   'Mn2 Ni2 Ge2'
_cell_volume   111.93
_cell_formula_units_Z   2
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
  Mn  Mn0  1  0.0  0.0  0.0  1.0
  Mn  Mn1  1  0.0  0.0  0.77  1.0
  Ni  Ni2  1  0.03  0.0  0.89  1.0
  Ni  Ni3  1  0.48  0.0  0.66  1.0
  Ge  Ge4  1  0.54  0.0  0.89  1.0
  Ge  Ge5  1  0.97  0.0  0.66  1.0

Mn Mn Ni Ni Ge Ge
Mn Mn Ni Ni Ge Ge 0 2 - o o 1 4 o o - 1 2 o o o 3 5 o o o 