# generated using pymatgen
data_Ti3B4W
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.04474198
_cell_length_b   4.54246133
_cell_length_c   6.02541243
_cell_angle_alpha   90.45103322
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti3B4W
_chemical_formula_sum   'Ti3 B4 W1'
_cell_volume   83.33262381
_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
  Ti  Ti0  1  0.25000000  0.12510681  0.17498927  1.0
  Ti  Ti1  1  0.75000000  0.62113979  0.32627867  1.0
  Ti  Ti2  1  0.75000000  0.88062298  0.82329740  1.0
  B  B3  1  0.25000000  0.89712385  0.53063757  1.0
  B  B4  1  0.25000000  0.60174451  0.02828060  1.0
  B  B5  1  0.75000000  0.09987603  0.47044752  1.0
  B  B6  1  0.75000000  0.39636169  0.96820978  1.0
  W  W7  1  0.25000000  0.37802434  0.67785920  1.0