data_Mn2AlCo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.82
_cell_length_b   4.82
_cell_length_c   4.82
_cell_angle_alpha   146.31
_cell_angle_beta   130.73
_cell_angle_gamma   61.02
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2AlCo
_chemical_formula_sum   'Mn2 Al1 Co1'
_cell_volume   46.52
_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  Mn2  1  0.0  0.01  0.99  1.0
  Mn  Mn3  1  0.4  0.0  0.16  1.0
  Al  Al0  1  0.0  0.0  0.0  1.0
  Co  Co1  1  0.0  0.0  0.15  1.0

data_Mn2AlCo
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.79
_cell_length_b   4.02
_cell_length_c   4.82
_cell_angle_alpha   114.64
_cell_angle_beta   106.85
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2AlCo
_chemical_formula_sum   'Mn2 Al1 Co1'
_cell_volume   46.52
_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  0.16  0.77  1.0
  Mn  Mn1  1  0.99  0.98  0.98  1.0
  Al  Al2  1  0.0  0.0  0.0  1.0
  Co  Co3  1  0.0  0.15  0.15  1.0

Mn Mn Al Co