data_Mn5Co4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.88
_cell_length_b   6.88
_cell_length_c   4.94
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn5Co4
_chemical_formula_sum   'Mn10 Co8'
_cell_volume   202.48
_cell_formula_units_Z   2
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  Mn8  1  0.25  0.0  0.7  1.0
  Mn  Mn9  1  0.88  0.95  0.7  1.0
  Mn  Mn10  1  0.32  0.01  0.7  1.0
  Mn  Mn11  1  0.63  0.0  0.23  1.0
  Mn  Mn12  1  0.68  0.01  0.23  1.0
  Mn  Mn13  1  0.12  0.95  0.23  1.0
  Mn  Mn14  1  0.0  0.97  0.47  1.0
  Mn  Mn15  1  0.44  0.99  0.0  1.0
  Mn  Mn16  1  0.44  0.99  0.47  1.0
  Mn  Mn17  1  0.0  0.97  0.0  1.0
  Co  Co0  1  0.0  0.0  0.47  1.0
  Co  Co1  1  0.0  0.0  0.0  1.0
  Co  Co2  1  0.56  0.0  0.7  1.0
  Co  Co3  1  0.72  0.95  0.7  1.0
  Co  Co4  1  0.16  0.01  0.7  1.0
  Co  Co5  1  0.32  0.0  0.23  1.0
  Co  Co6  1  0.84  0.01  0.23  1.0
  Co  Co7  1  0.28  0.95  0.23  1.0

data_Mn5Co4
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.94
_cell_length_b   6.88
_cell_length_c   6.88
_cell_angle_alpha   120.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn5Co4
_chemical_formula_sum   'Mn10 Co8'
_cell_volume   202.48
_cell_formula_units_Z   2
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  0.44  0.99  1.0
  Mn  Mn1  1  -0.0  0.0  0.97  1.0
  Mn  Mn2  1  0.23  0.12  0.95  1.0
  Mn  Mn3  1  0.23  0.63  0.0  1.0
  Mn  Mn4  1  0.23  0.68  0.01  1.0
  Mn  Mn5  1  0.47  0.0  0.97  1.0
  Mn  Mn6  1  0.47  0.44  0.99  1.0
  Mn  Mn7  1  0.7  0.25  0.0  1.0
  Mn  Mn8  1  0.7  0.32  0.01  1.0
  Mn  Mn9  1  0.7  0.88  0.95  1.0
  Co  Co10  1  0.0  0.0  0.0  1.0
  Co  Co11  1  0.23  0.28  0.95  1.0
  Co  Co12  1  0.23  0.32  0.0  1.0
  Co  Co13  1  0.23  0.84  0.01  1.0
  Co  Co14  1  0.47  0.0  0.0  1.0
  Co  Co15  1  0.7  0.16  0.01  1.0
  Co  Co16  1  0.7  0.56  0.0  1.0
  Co  Co17  1  0.7  0.72  0.95  1.0

Mn Mn Mn Mn Mn Mn Mn Mn Mn Mn Co Co Co Co Co Co Co Co
Mn Mn Mn Mn Mn Mn Mn Mn Mn Mn Co Co Co Co Co Co Co Co 0 2 o o o 0 14 o o o 1 13 o o o 2 7 o - + 2 8 o - o 3 4 o o o 3 7 o - o 3 8 o - o 4 16 o o o 5 15 o + o 5 17 o o o 6 10 o + o 7 17 o o o 7 15 o + o 7 12 o + - 8 17 o o o 8 15 o + o 8 12 o + o 9 11 o + o 12 13 o - o 15 17 o - o 