# generated using pymatgen
data_Ti3(NbSe2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.14800351
_cell_length_b   7.14800403
_cell_length_c   7.15896462
_cell_angle_alpha   91.48989094
_cell_angle_beta   95.29729850
_cell_angle_gamma   151.82315333
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti3(NbSe2)2
_chemical_formula_sum   'Ti3 Nb2 Se4'
_cell_volume   167.43611488
_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  0.30818662  0.62059118  0.92877780  1.0
  Ti  Ti1  1  0.69373988  0.37831453  0.07205441  1.0
  Ti  Ti2  1  0.63524098  0.69621986  0.33146084  1.0
  Nb  Nb3  1  0.99906312  0.99972287  0.99878599  1.0
  Nb  Nb4  1  0.36783261  0.30924377  0.67707638  1.0
  Se  Se5  1  0.27796883  0.05520400  0.33317383  1.0
  Se  Se6  1  0.06459634  0.72749511  0.79209245  1.0
  Se  Se7  1  0.94074243  0.26867466  0.20941610  1.0
  Se  Se8  1  0.71262918  0.94453402  0.65716320  1.0