data_MnGe3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.54
_cell_length_b   4.86
_cell_length_c   4.05
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnGe3
_chemical_formula_sum   'Mn1 Ge3'
_cell_volume   69.74
_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
  Mn  Mn3  1  0.0  0.0  0.19  1.0
  Ge  Ge0  1  0.0  0.43  0.16  1.0
  Ge  Ge1  1  0.77  0.43  0.09  1.0
  Ge  Ge2  1  0.77  0.0  0.31  1.0

data_MnGe3
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.54
_cell_length_b   4.05
_cell_length_c   4.86
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnGe3
_chemical_formula_sum   'Mn1 Ge3'
_cell_volume   69.74
_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
  Mn  Mn0  1  0.0  0.81  0.0  1.0
  Ge  Ge1  1  -0.0  0.84  0.57  1.0
  Ge  Ge2  1  0.23  0.69  0.0  1.0
  Ge  Ge3  1  0.23  0.91  0.57  1.0

Mn Ge Ge Ge