data_NbZnTe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.01
_cell_length_b   5.01
_cell_length_c   5.58
_cell_angle_alpha   96.65
_cell_angle_beta   96.65
_cell_angle_gamma   40.82
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbZnTe2
_chemical_formula_sum   'Nb1 Zn1 Te2'
_cell_volume   90.9
_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
  Nb  Nb0  1  0.35  0.0  0.77  1.0
  Zn  Zn3  1  0.0  0.0  0.0  1.0
  Te  Te1  1  0.21  0.0  0.5  1.0
  Te  Te2  1  0.5  0.0  0.04  1.0

data_NbZnTe2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.5
_cell_length_b   5.01
_cell_length_c   5.58
_cell_angle_alpha   96.65
_cell_angle_beta   90.0
_cell_angle_gamma   110.41
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbZnTe2
_chemical_formula_sum   'Nb1 Zn1 Te2'
_cell_volume   90.9
_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
  Nb  Nb0  1  0.0  0.65  0.23  1.0
  Zn  Zn1  1  0.0  0.0  0.0  1.0
  Te  Te2  1  0.0  0.5  0.96  1.0
  Te  Te3  1  0.0  0.79  0.5  1.0

Nb Zn Te Te