[CIF]
data_Ba2TcSe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.56502677
_cell_length_b   3.56502677
_cell_length_c   9.75611165
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2TcSe
_chemical_formula_sum   'Ba2 Tc1 Se1'
_cell_volume   123.99448040
_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
  Ba  Ba0  1  0.00000000  0.00000000  8.95503664  1
  Ba  Ba1  1  1.78251339  1.78251339  3.23987336  1
  Se  Se2  1  0.00000000  0.00000000  5.65214787  1
  Tc  Tc3  1  1.78251339  1.78251339  6.54322116  1
[/CIF]
