data_Zn2TcNi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.61
_cell_length_b   4.61
_cell_length_c   4.71
_cell_angle_alpha   99.23
_cell_angle_beta   99.23
_cell_angle_gamma   32.82
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zn2TcNi
_chemical_formula_sum   'Zn2 Tc1 Ni1'
_cell_volume   53.54
_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  Zn2  1  0.22  0.0  0.64  1.0
  Zn  Zn3  1  0.57  0.0  0.48  1.0
  Tc  Tc1  1  0.48  0.0  0.21  1.0
  Ni  Ni0  1  0.03  0.0  0.28  1.0

data_Zn2TcNi
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.61
_cell_length_b   4.61
_cell_length_c   4.71
_cell_angle_alpha   99.23
_cell_angle_beta   90.0
_cell_angle_gamma   106.41
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zn2TcNi
_chemical_formula_sum   'Zn2 Tc1 Ni1'
_cell_volume   53.54
_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  0.43  0.52  1.0
  Zn  Zn1  1  0.0  0.78  0.36  1.0
  Tc  Tc2  1  0.0  0.52  0.79  1.0
  Ni  Ni3  1  0.0  0.97  0.72  1.0

Zn Zn Tc Ni