data_ZnW3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.61
_cell_length_b   5.61
_cell_length_c   13.79
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnW3
_chemical_formula_sum   'Zn6 W18'
_cell_volume   375.96
_cell_formula_units_Z   6
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  Zn18  1  0.0  0.0  0.34  1.0
  Zn  Zn19  1  0.0  0.0  0.45  1.0
  Zn  Zn20  1  0.0  0.24  0.15  1.0
  Zn  Zn21  1  0.0  0.24  0.75  1.0
  Zn  Zn22  1  0.81  0.62  0.64  1.0
  Zn  Zn23  1  0.81  0.62  0.05  1.0
  W  W0  1  0.65  0.46  0.34  1.0
  W  W1  1  0.15  0.4  0.45  1.0
  W  W2  1  0.0  0.62  0.64  1.0
  W  W3  1  0.0  0.62  0.05  1.0
  W  W4  1  0.6  0.05  0.64  1.0
  W  W5  1  0.6  0.05  0.05  1.0
  W  W6  1  0.4  0.81  0.15  1.0
  W  W7  1  0.4  0.81  0.74  1.0
  W  W8  1  0.0  0.79  0.34  1.0
  W  W9  1  0.81  0.07  0.45  1.0
  W  W10  1  0.35  0.46  0.34  1.0
  W  W11  1  0.46  0.4  0.45  1.0
  W  W12  1  0.4  0.05  0.64  1.0
  W  W13  1  0.4  0.05  0.05  1.0
  W  W14  1  0.21  0.81  0.15  1.0
  W  W15  1  0.21  0.81  0.74  1.0
  W  W16  1  0.81  0.24  0.15  1.0
  W  W17  1  0.81  0.24  0.74  1.0

data_ZnW3
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.61
_cell_length_b   5.61
_cell_length_c   13.79
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnW3
_chemical_formula_sum   'Zn6 W18'
_cell_volume   375.96
_cell_formula_units_Z   6
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  0.34  1.0
  Zn  Zn1  1  0.0  0.0  0.45  1.0
  Zn  Zn2  1  0.0  0.24  0.15  1.0
  Zn  Zn3  1  0.0  0.24  0.75  1.0
  Zn  Zn4  1  0.81  0.62  0.05  1.0
  Zn  Zn5  1  0.81  0.62  0.64  1.0
  W  W6  1  0.0  0.62  0.05  1.0
  W  W7  1  0.0  0.62  0.64  1.0
  W  W8  1  0.0  0.79  0.34  1.0
  W  W9  1  0.15  0.4  0.45  1.0
  W  W10  1  0.21  0.81  0.15  1.0
  W  W11  1  0.21  0.81  0.74  1.0
  W  W12  1  0.35  0.46  0.34  1.0
  W  W13  1  0.4  0.81  0.15  1.0
  W  W14  1  0.4  0.81  0.74  1.0
  W  W15  1  0.4  0.05  0.05  1.0
  W  W16  1  0.4  0.05  0.64  1.0
  W  W17  1  0.46  0.4  0.45  1.0
  W  W18  1  0.6  0.05  0.05  1.0
  W  W19  1  0.6  0.05  0.64  1.0
  W  W20  1  0.65  0.46  0.34  1.0
  W  W21  1  0.81  0.07  0.45  1.0
  W  W22  1  0.81  0.24  0.15  1.0
  W  W23  1  0.81  0.24  0.74  1.0

Zn Zn Zn Zn Zn Zn W W W W W W W W W W W W W W W W W W