data_MnFeW2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.64
_cell_length_b   4.34
_cell_length_c   4.95
_cell_angle_alpha   90.0
_cell_angle_beta   99.4
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnFeW2
_chemical_formula_sum   'Mn1 Fe1 W2'
_cell_volume   55.98
_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  0.05  0.0  0.68  1.0
  Fe  Fe0  1  0.91  0.17  0.44  1.0
  W  W2  1  0.21  0.17  0.81  1.0
  W  W3  1  0.77  0.0  0.29  1.0

data_MnFeW2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.64
_cell_length_b   4.34
_cell_length_c   4.95
_cell_angle_alpha   90.0
_cell_angle_beta   99.4
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnFeW2
_chemical_formula_sum   'Mn1 Fe1 W2'
_cell_volume   55.98
_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  0.05  0.0  0.68  1.0
  Fe  Fe1  1  0.91  0.17  0.44  1.0
  W  W2  1  0.21  0.17  0.81  1.0
  W  W3  1  0.77  0.0  0.29  1.0

Mn Fe W W
Mn Fe W W 0 2 o o o 1 3 o o o 