# generated using pymatgen
data_TiCr2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.84101424
_cell_length_b   4.84101423
_cell_length_c   15.68383809
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00072729
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiCr2
_chemical_formula_sum   'Ti8 Cr16'
_cell_volume   318.31163854
_cell_formula_units_Z   8
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  0.33333302  0.66666698  0.84354303  1.0
  Ti  Ti1  1  0.99999884  0.00000116  0.09487636  1.0
  Ti  Ti2  1  0.00000116  0.99999884  0.90512364  1.0
  Ti  Ti3  1  0.66666698  0.33333302  0.15645697  1.0
  Ti  Ti4  1  0.00000116  0.99999884  0.59487636  1.0
  Ti  Ti5  1  0.66666698  0.33333302  0.34354303  1.0
  Ti  Ti6  1  0.99999884  0.00000116  0.40512364  1.0
  Ti  Ti7  1  0.33333302  0.66666698  0.65645697  1.0
  Cr  Cr8  1  0.00000000  0.50000000  0.50000000  1.0
  Cr  Cr9  1  0.83638678  0.16361322  0.75000000  1.0
  Cr  Cr10  1  0.66666603  0.33333297  0.62349763  1.0
  Cr  Cr11  1  0.16361256  0.32722379  0.25000000  1.0
  Cr  Cr12  1  0.32722479  0.16361256  0.75000000  1.0
  Cr  Cr13  1  0.83638744  0.67277621  0.75000000  1.0
  Cr  Cr14  1  0.50000000  0.50000000  -0.00000000  1.0
  Cr  Cr15  1  0.67277521  0.83638744  0.25000000  1.0
  Cr  Cr16  1  0.50000000  0.50000000  0.50000000  1.0
  Cr  Cr17  1  0.16361322  0.83638678  0.25000000  1.0
  Cr  Cr18  1  0.33333397  0.66666703  0.37650237  1.0
  Cr  Cr19  1  0.00000000  0.50000000  -0.00000000  1.0
  Cr  Cr20  1  0.66666603  0.33333297  0.87650237  1.0
  Cr  Cr21  1  0.50000000  0.00000000  0.50000000  1.0
  Cr  Cr22  1  0.33333397  0.66666703  0.12349763  1.0
  Cr  Cr23  1  0.50000000  0.00000000  -0.00000000  1.0