data_Mn(VRe)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.08
_cell_length_b   6.08
_cell_length_c   6.08
_cell_angle_alpha   142.0
_cell_angle_beta   142.0
_cell_angle_gamma   54.82
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn(VRe)2
_chemical_formula_sum   'Mn1 V2 Re2'
_cell_volume   84.75
_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  0.0  0.0  1.0
  V  V3  1  0.0  0.98  0.7  1.0
  V  V4  1  0.98  0.0  0.7  1.0
  Re  Re1  1  0.0  0.0  0.65  1.0
  Re  Re2  1  0.0  0.0  0.15  1.0

data_Mn(VRe)2
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.6
_cell_length_b   5.6
_cell_length_c   6.08
_cell_angle_alpha   90.0
_cell_angle_beta   117.41
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   Mn(VRe)2
_chemical_formula_sum   'Mn2 V4 Re4'
_cell_volume   169.5
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  2  0.0  0.0  0.0  1.0
  V  V1  4  0.49  0.49  0.28  1.0
  Re  Re2  2  0.0  0.0  0.35  1.0
  Re  Re3  2  0.0  0.0  0.85  1.0

Mn V V Re Re
Mn V V Re Re 0 4 o o o 1 2 - + o 1 3 o + o 2 3 + o o 