# generated using pymatgen
data_Ti3Se4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.60460922
_cell_length_b   6.47724267
_cell_length_c   7.04817060
_cell_angle_alpha   116.65628553
_cell_angle_beta   104.81579783
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti3Se4
_chemical_formula_sum   'Ti3 Se4'
_cell_volume   140.92116134
_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  0.00000000  0.00000000  0.00000000  1.0
  Ti  Ti1  1  0.74751295  0.70352276  0.49502691  1.0
  Ti  Ti2  1  0.25248705  0.29647724  0.50497309  1.0
  Se  Se3  1  0.63504788  0.97094225  0.27009376  1.0
  Se  Se4  1  0.36495212  0.02905775  0.72990624  1.0
  Se  Se5  1  0.88764598  0.54798772  0.77529096  1.0
  Se  Se6  1  0.11235402  0.45201228  0.22470904  1.0