data_MnVCo2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.71
_cell_length_b   4.71
_cell_length_c   4.71
_cell_angle_alpha   143.57
_cell_angle_beta   130.48
_cell_angle_gamma   63.02
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnVCo2
_chemical_formula_sum   'Mn1 V1 Co2'
_cell_volume   46.71
_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  0.0  0.02  1.0
  V  V3  1  0.0  0.0  0.0  1.0
  Co  Co0  1  0.47  0.0  1.0  1.0
  Co  Co1  1  0.0  0.97  0.02  1.0

data_MnVCo2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.95
_cell_length_b   3.95
_cell_length_c   4.71
_cell_angle_alpha   114.76
_cell_angle_beta   108.21
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnVCo2
_chemical_formula_sum   'Mn1 V1 Co2'
_cell_volume   46.71
_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  0.02  0.02  1.0
  V  V1  1  0.0  0.0  0.0  1.0
  Co  Co2  1  0.0  1.0  0.53  1.0
  Co  Co3  1  0.03  0.04  0.04  1.0

Mn V Co Co
Mn V Co Co 0 1 o o o 0 2 o o - 0 2 - o - 0 3 o - o 1 2 o o - 1 2 - o - 2 3 o - + 2 3 + - + 