data_Mn2VGe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.65
_cell_length_b   4.65
_cell_length_c   4.65
_cell_angle_alpha   141.89
_cell_angle_beta   127.2
_cell_angle_gamma   66.95
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2VGe
_chemical_formula_sum   'Mn2 V1 Ge1'
_cell_volume   48.56
_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  Mn1  1  0.52  0.0  0.89  1.0
  Mn  Mn2  1  0.0  0.07  0.99  1.0
  V  V3  1  0.0  0.0  0.0  1.0
  Ge  Ge0  1  0.0  0.0  0.88  1.0

data_Mn2VGe
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.03
_cell_length_b   4.13
_cell_length_c   4.65
_cell_angle_alpha   116.4
_cell_angle_beta   109.05
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2VGe
_chemical_formula_sum   'Mn2 V1 Ge1'
_cell_volume   48.56
_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  0.89  0.37  1.0
  Mn  Mn1  1  0.93  0.92  0.92  1.0
  V  V2  1  0.0  0.0  0.0  1.0
  Ge  Ge3  1  0.0  0.88  0.88  1.0

Mn Mn V Ge
Mn Mn V Ge 0 3 o o o 0 3 + o o 0 2 + o + 0 1 + o o 1 3 o o o 1 2 o o + 