# generated using pymatgen
data_Ta3Ti(B2Mo)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.07123566
_cell_length_b   6.07123612
_cell_length_c   3.25197563
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   89.59958766
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta3Ti(B2Mo)2
_chemical_formula_sum   'Ta3 Ti1 B4 Mo2'
_cell_volume   119.86458658
_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
  Ta  Ta0  1  0.82018228  0.67934717  0.50000000  1.0
  Ta  Ta1  1  0.32128882  0.82128882  0.50000000  1.0
  Ta  Ta2  1  0.17934717  0.32018228  0.50000000  1.0
  Ti  Ti3  1  0.67888341  0.17888341  0.50000000  1.0
  B  B4  1  0.10885642  0.60885642  0.00000000  1.0
  B  B5  1  0.60848472  0.89413566  0.00000000  1.0
  B  B6  1  0.39413566  0.10848472  0.00000000  1.0
  B  B7  1  0.89019700  0.39019700  0.00000000  1.0
  Mo  Mo8  1  0.50161326  0.49701327  0.00000000  1.0
  Mo  Mo9  1  0.99701327  0.00161326  0.00000000  1.0