# generated using pymatgen
data_TiTeAs
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.59320306
_cell_length_b   5.27237324
_cell_length_c   7.17944660
_cell_angle_alpha   111.53860099
_cell_angle_beta   104.49366083
_cell_angle_gamma   89.98287962
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiTeAs
_chemical_formula_sum   'Ti2 Te2 As2'
_cell_volume   121.85350328
_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
  Ti  Ti0  1  0.38194395  0.88245798  0.76446021  1.0
  Ti  Ti1  1  0.61807121  0.11755046  0.23554972  1.0
  Te  Te2  1  0.71075582  0.71044372  0.42102792  1.0
  Te  Te3  1  0.28920356  0.28954788  0.57894814  1.0
  As  As4  1  -0.00024427  0.74633307  0.00003963  1.0
  As  As5  1  0.00026973  0.25366588  0.99997537  1.0