[CIF]
data_TiBAs2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.33337525
_cell_length_b   5.33337525
_cell_length_c   5.33337525
_cell_angle_alpha   140.83015339
_cell_angle_beta   140.83015339
_cell_angle_gamma   56.59497158
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiBAs2
_chemical_formula_sum   'Ti1 B1 As2'
_cell_volume   60.03608818
_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
  As  As0  1  0.00000000  -0.00000000  4.69602707  1
  As  As1  1  -0.00000000  1.78776694  2.34801354  1
  B  B2  1  0.00000000  0.00000000  0.00000000  1
  Ti  Ti3  1  1.78776694  -0.00000000  2.34801354  1
[/CIF]
