data_[V6Co10B4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  V  1.6300  1.3500  0.7775
  Co  1.8800  1.3500  0.7683
  B  2.0400  0.8500  0.4100
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [8.1059]
_cell_length_b [8.1059]
_cell_length_c [3.1049]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [127]
_chemical_formula_structural [V3Co5B2]
_chemical_formula_sum '[V6 Co10 B4]'
_cell_volume [204.0064]
_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
[
  V  V0  4  0.1746  0.6746  0.0000  1
  V  V1  2  0.0000  0.0000  0.0000  1
  Co  Co2  8  0.0704  0.2134  0.5000  1
  Co  Co3  2  0.0000  0.5000  0.5000  1
  B  B4  4  0.1213  0.3787  0.0000  1
]