data_TcPdSe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.67
_cell_length_b   4.24
_cell_length_c   6.21
_cell_angle_alpha   90.0
_cell_angle_beta   97.2
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TcPdSe2
_chemical_formula_sum   'Tc1 Pd1 Se2'
_cell_volume   69.88
_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
  Tc  Tc3  1  0.0  0.0  0.0  1.0
  Pd  Pd0  1  0.61  0.0  0.08  1.0
  Se  Se1  1  0.99  0.12  0.66  1.0
  Se  Se2  1  0.91  0.12  0.49  1.0

data_TcPdSe2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.67
_cell_length_b   4.24
_cell_length_c   6.21
_cell_angle_alpha   90.0
_cell_angle_beta   97.2
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TcPdSe2
_chemical_formula_sum   'Tc1 Pd1 Se2'
_cell_volume   69.88
_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
  Tc  Tc0  1  0.0  0.0  0.0  1.0
  Pd  Pd1  1  0.61  0.0  0.08  1.0
  Se  Se2  1  0.91  0.12  0.49  1.0
  Se  Se3  1  0.99  0.12  0.66  1.0

Tc Pd Se Se
Tc Pd Se Se 0 1 - o o 2 3 o o o 