data_Ni2TeOs
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.87
_cell_length_b   3.63
_cell_length_c   5.64
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni2TeOs
_chemical_formula_sum   'Ni2 Te1 Os1'
_cell_volume   58.91
_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
  Ni  Ni0  1  0.44  0.82  0.57  1.0
  Ni  Ni1  1  0.44  0.82  0.07  1.0
  Te  Te3  1  0.0  0.0  0.0  1.0
  Os  Os2  1  0.0  0.0  0.82  1.0

data_Ni2TeOs
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.87
_cell_length_b   3.63
_cell_length_c   5.64
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni2TeOs
_chemical_formula_sum   'Ni2 Te1 Os1'
_cell_volume   58.91
_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
  Ni  Ni0  1  0.44  0.82  0.07  1.0
  Ni  Ni1  1  0.44  0.82  0.57  1.0
  Te  Te2  1  0.0  0.0  0.0  1.0
  Os  Os3  1  0.0  0.0  0.82  1.0

Ni Ni Te Os
Ni Ni Te Os 0 3 o + o 0 3 + + o 1 2 o + o 2 3 o o - 