data_Ta5Zn3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.69
_cell_length_b   7.69
_cell_length_c   7.69
_cell_angle_alpha   96.19
_cell_angle_beta   96.19
_cell_angle_gamma   141.66
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta5Zn3
_chemical_formula_sum   'Ta10 Zn6'
_cell_volume   266.64
_cell_formula_units_Z   2
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
  Ta  Ta0  1  0.0  0.14  0.26  1.0
  Ta  Ta1  1  0.14  0.0  0.26  1.0
  Ta  Ta2  1  0.79  0.27  0.0  1.0
  Ta  Ta3  1  0.35  0.86  0.53  1.0
  Ta  Ta4  1  0.93  0.86  0.0  1.0
  Ta  Ta5  1  0.21  0.27  0.53  1.0
  Ta  Ta6  1  0.86  0.35  0.0  1.0
  Ta  Ta7  1  0.27  0.79  0.53  1.0
  Ta  Ta8  1  0.14  0.35  0.53  1.0
  Ta  Ta9  1  1.0  0.79  0.0  1.0
  Zn  Zn10  1  0.0  0.0  0.26  1.0
  Zn  Zn11  1  0.0  0.0  0.79  1.0
  Zn  Zn12  1  0.71  0.84  0.0  1.0
  Zn  Zn13  1  0.43  0.29  0.53  1.0
  Zn  Zn14  1  0.71  0.43  0.53  1.0
  Zn  Zn15  1  0.43  0.71  0.0  1.0

data_Ta5Zn3
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.05
_cell_length_b   7.69
_cell_length_c   7.69
_cell_angle_alpha   83.81
_cell_angle_beta   70.83
_cell_angle_gamma   70.83
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta5Zn3
_chemical_formula_sum   'Ta10 Zn6'
_cell_volume   266.64
_cell_formula_units_Z   2
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
  Ta  Ta0  1  0.0  0.14  0.74  1.0
  Ta  Ta1  1  0.14  0.86  0.74  1.0
  Ta  Ta2  1  0.27  0.52  -0.0  1.0
  Ta  Ta3  1  0.27  0.93  0.47  1.0
  Ta  Ta4  1  0.35  0.52  -0.0  1.0
  Ta  Ta5  1  0.35  0.79  0.47  1.0
  Ta  Ta6  1  0.79  0.21  -0.0  1.0
  Ta  Ta7  1  0.79  0.48  0.47  1.0
  Ta  Ta8  1  0.86  0.07  -0.0  1.0
  Ta  Ta9  1  0.86  0.48  0.47  1.0
  Zn  Zn10  1  0.0  0.0  0.21  1.0
  Zn  Zn11  1  0.0  0.0  0.74  1.0
  Zn  Zn12  1  0.29  0.14  0.47  1.0
  Zn  Zn13  1  0.43  0.28  0.47  1.0
  Zn  Zn14  1  0.71  0.72  -0.0  1.0
  Zn  Zn15  1  0.84  0.86  -0.0  1.0

Ta Ta Ta Ta Ta Ta Ta Ta Ta Ta Zn Zn Zn Zn Zn Zn