data_MnCo2Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.45
_cell_length_b   2.45
_cell_length_c   8.46
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   114.96
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnCo2Cu
_chemical_formula_sum   'Mn1 Co2 Cu1'
_cell_volume   45.89
_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  0.07  1.0
  Co  Co0  1  0.32  0.0  0.4  1.0
  Co  Co1  1  0.0  0.0  0.41  1.0
  Cu  Cu2  1  0.32  0.0  0.26  1.0

data_MnCo2Cu
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.45
_cell_length_b   2.45
_cell_length_c   8.46
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   114.96
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnCo2Cu
_chemical_formula_sum   'Mn1 Co2 Cu1'
_cell_volume   45.89
_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  0.07  1.0
  Co  Co1  1  0.0  0.0  0.41  1.0
  Co  Co2  1  0.32  0.0  0.4  1.0
  Cu  Cu3  1  0.32  0.0  0.26  1.0

Mn Co Co Cu