data_ZnTc2Os
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.78
_cell_length_b   4.36
_cell_length_c   4.73
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnTc2Os
_chemical_formula_sum   'Zn1 Tc2 Os1'
_cell_volume   57.3
_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
  Zn  Zn3  1  0.0  0.0  0.56  1.0
  Tc  Tc1  1  0.39  0.0  0.15  1.0
  Tc  Tc2  1  0.39  0.18  0.35  1.0
  Os  Os0  1  0.0  0.18  0.03  1.0

data_ZnTc2Os
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.78
_cell_length_b   4.36
_cell_length_c   4.73
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnTc2Os
_chemical_formula_sum   'Zn1 Tc2 Os1'
_cell_volume   57.3
_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
  Zn  Zn0  1  0.0  0.0  0.56  1.0
  Tc  Tc1  1  0.39  0.0  0.15  1.0
  Tc  Tc2  1  0.39  0.18  0.35  1.0
  Os  Os3  1  0.0  0.18  0.03  1.0

Zn Tc Tc Os
Zn Tc Tc Os 0 2 o o o 1 3 o o o 1 2 o o o 