data_Mn3Co
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.68
_cell_length_b   4.68
_cell_length_c   4.68
_cell_angle_alpha   149.43
_cell_angle_beta   64.22
_cell_angle_gamma   125.03
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn3Co
_chemical_formula_sum   'Mn3 Co1'
_cell_volume   42.28
_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  0.0  0.95  0.72  1.0
  Mn  Mn2  1  0.0  0.0  0.15  1.0
  Mn  Mn3  1  0.0  0.98  0.72  1.0
  Co  Co0  1  0.23  0.0  0.0  1.0

data_Mn3Co
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.47
_cell_length_b   4.32
_cell_length_c   4.68
_cell_angle_alpha   117.49
_cell_angle_beta   105.29
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn3Co
_chemical_formula_sum   'Mn3 Co1'
_cell_volume   42.28
_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  0.15  0.15  0.15  1.0
  Mn  Mn1  1  0.72  0.74  0.74  1.0
  Mn  Mn2  1  0.72  0.77  0.77  1.0
  Co  Co3  1  0.0  0.0  0.24  1.0

Mn Mn Mn Co