# generated using pymatgen
data_Ti2VSe4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.63156290
_cell_length_b   6.39420347
_cell_length_c   7.02475792
_cell_angle_alpha   115.97956953
_cell_angle_beta   104.97984278
_cell_angle_gamma   90.01327670
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti2VSe4
_chemical_formula_sum   'Ti2 V1 Se4'
_cell_volume   140.44071801
_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
  Ti  Ti0  1  0.25448227  0.29077277  0.50856641  1.0
  Ti  Ti1  1  0.74553222  0.70922571  0.49143601  1.0
  V  V2  1  -0.00000748  -0.00000936  0.00000189  1.0
  Se  Se3  1  0.11414205  0.45194067  0.22891694  1.0
  Se  Se4  1  0.88585893  0.54803350  0.77105820  1.0
  Se  Se5  1  0.36579004  0.02605611  0.73111589  1.0
  Se  Se6  1  0.63420197  0.97398159  0.26890466  1.0