data_[Tc4Sb2P2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tc  1.9000  1.3500  0.7417
  Sb  2.0500  1.4500  0.8300
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [8.3892]
_cell_length_b [3.1525]
_cell_length_c [5.3315]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.6319]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Tc2SbP]
_chemical_formula_sum '[Tc4 Sb2 P2]'
_cell_volume [134.3761]
_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
[
  Tc  Tc0  2  0.2246  0.0000  0.6172  1
  Tc  Tc1  2  0.4958  0.5000  0.9886  1
  Sb  Sb2  2  0.2635  0.5000  0.2218  1
  P  P3  2  0.0161  0.5000  0.6724  1
]