# generated using pymatgen
data_Ti4CrB2Se
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.92244721
_cell_length_b   5.92244738
_cell_length_c   7.11277047
_cell_angle_alpha   114.60277070
_cell_angle_beta   114.60278726
_cell_angle_gamma   89.99999349
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti4CrB2Se
_chemical_formula_sum   'Ti8 Cr2 B4 Se2'
_cell_volume   201.65696351
_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  0.04352853  0.54352853  0.73974994  1.0
  Ti  Ti1  1  0.69622141  0.19622141  0.73974994  1.0
  Ti  Ti2  1  0.19622141  0.04352853  0.73974994  1.0
  Ti  Ti3  1  0.54352853  0.69622141  0.73974994  1.0
  Ti  Ti4  1  0.95647147  0.45647147  0.26025006  1.0
  Ti  Ti5  1  0.30377859  0.80377859  0.26025006  1.0
  Ti  Ti6  1  0.80377859  0.95647147  0.26025006  1.0
  Ti  Ti7  1  0.45647147  0.30377859  0.26025006  1.0
  Cr  Cr8  1  0.50000000  0.50000000  0.00000000  1.0
  Cr  Cr9  1  0.00000000  0.00000000  0.00000000  1.0
  B  B10  1  0.38593701  0.88593701  1.00000000  1.0
  B  B11  1  0.61406299  0.11406299  0.00000000  1.0
  B  B12  1  0.11406299  0.38593701  1.00000000  1.0
  B  B13  1  0.88593701  0.61406299  0.00000000  1.0
  Se  Se14  1  0.25000000  0.25000000  0.50000000  1.0
  Se  Se15  1  0.75000000  0.75000000  0.50000000  1.0