data_MnFe2Co
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.45
_cell_length_b   2.45
_cell_length_c   6.97
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnFe2Co
_chemical_formula_sum   'Mn1 Fe2 Co1'
_cell_volume   41.8
_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  0.49  1.0
  Fe  Fe1  1  0.0  0.0  0.02  1.0
  Fe  Fe2  1  0.22  0.22  0.72  1.0
  Co  Co0  1  0.22  0.22  0.23  1.0

data_MnFe2Co
_symmetry_space_group_name_H-M   Cm
_cell_length_a   3.46
_cell_length_b   3.46
_cell_length_c   6.97
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   MnFe2Co
_chemical_formula_sum   'Mn2 Fe4 Co2'
_cell_volume   83.59
_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  0.49  1.0
  Fe  Fe1  2  0.0  0.0  0.02  1.0
  Fe  Fe2  2  0.22  0.0  0.72  1.0
  Co  Co3  2  0.22  0.0  0.23  1.0

Mn Fe Fe Co