data_[Tc2Sn2P2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tc  1.9000  1.3500  0.7417
  Sn  1.9600  1.4500  0.8300
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [3.2547]
_cell_length_b [4.9816]
_cell_length_c [6.9914]
_cell_angle_alpha [72.2348]
_cell_angle_beta [78.7656]
_cell_angle_gamma [83.8967]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [TcSnP]
_chemical_formula_sum '[Tc2 Sn2 P2]'
_cell_volume [105.7490]
_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  0.3369  0.8637  0.2160  1
  Sn  Sn1  2  0.2932  0.2861  0.4180  1
  P  P2  2  0.0659  0.2783  0.9829  1
]