# generated using pymatgen
data_ZrW2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.40125862
_cell_length_b   5.40125907
_cell_length_c   5.40126043
_cell_angle_alpha   60.00000425
_cell_angle_beta   60.00000145
_cell_angle_gamma   60.00000006
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrW2
_chemical_formula_sum   'Zr2 W4'
_cell_volume   111.42178720
_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
  Zr  Zr0  1  0.87500000  0.87500000  0.87500000  1.0
  Zr  Zr1  1  0.12500000  0.12500000  0.12500000  1.0
  W  W2  1  0.50000000  0.50000000  0.50000000  1.0
  W  W3  1  0.50000000  0.50000000  0.00000000  1.0
  W  W4  1  -0.00000000  0.50000000  0.50000000  1.0
  W  W5  1  0.50000000  -0.00000000  0.50000000  1.0