data_TcNiPd2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.66
_cell_length_b   4.66
_cell_length_c   4.73
_cell_angle_alpha   99.33
_cell_angle_beta   99.33
_cell_angle_gamma   33.73
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TcNiPd2
_chemical_formula_sum   'Tc1 Ni1 Pd2'
_cell_volume   56.23
_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  0.02  0.0  0.3  1.0
  Ni  Ni0  1  0.51  0.0  0.21  1.0
  Pd  Pd1  1  0.03  0.0  0.05  1.0
  Pd  Pd2  1  0.62  0.0  0.44  1.0

data_TcNiPd2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.7
_cell_length_b   4.66
_cell_length_c   4.73
_cell_angle_alpha   99.33
_cell_angle_beta   90.0
_cell_angle_gamma   106.86
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TcNiPd2
_chemical_formula_sum   'Tc1 Ni1 Pd2'
_cell_volume   56.23
_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  0.98  0.7  1.0
  Ni  Ni1  1  0.0  0.49  0.79  1.0
  Pd  Pd2  1  0.0  0.38  0.56  1.0
  Pd  Pd3  1  0.0  0.97  0.95  1.0

Tc Ni Pd Pd