data_[Co6Tc8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Co  1.8800  1.3500  0.7683
  Tc  1.9000  1.3500  0.7417
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [7.6436]
_cell_length_b [4.8548]
_cell_length_c [18.1102]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Co3Tc4]
_chemical_formula_sum '[Co6 Tc8]'
_cell_volume [672.0297]
_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
[
  Co  Co0  4  0.4569  0.2546  0.5283  1
  Co  Co1  2  0.4206  0.5000  0.4118  1
  Tc  Tc2  2  0.1079  0.5000  0.4300  1
  Tc  Tc3  2  0.2026  0.5000  0.5734  1
  Tc  Tc4  2  0.2103  0.0000  0.5835  1
  Tc  Tc5  2  0.2405  0.0000  0.4444  1
]