# generated using pymatgen
data_TaSe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.97066441
_cell_length_b   9.64979642
_cell_length_c   11.38336515
_cell_angle_alpha   73.43997494
_cell_angle_beta   75.85392141
_cell_angle_gamma   85.51599081
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaSe2
_chemical_formula_sum   'Ta13 Se26'
_cell_volume   915.84852020
_cell_formula_units_Z   13
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
  Ta  Ta0  1  -0.00000000  0.00000000  0.00000000  1.0
  Ta  Ta1  1  0.21341324  0.71724978  0.06976932  1.0
  Ta  Ta2  1  0.78658676  0.28275022  0.93023068  1.0
  Ta  Ta3  1  0.71764912  0.07021422  0.21353470  1.0
  Ta  Ta4  1  0.28235088  0.92978578  0.78646530  1.0
  Ta  Ta5  1  0.93033637  0.78683804  0.28327652  1.0
  Ta  Ta6  1  0.06966363  0.21316196  0.71672348  1.0
  Ta  Ta7  1  0.15081866  0.48752248  0.36035142  1.0
  Ta  Ta8  1  0.84918134  0.51247752  0.63964858  1.0
  Ta  Ta9  1  0.48806765  0.36044688  0.15181649  1.0
  Ta  Ta10  1  0.51193235  0.63955312  0.84818351  1.0
  Ta  Ta11  1  0.64076889  0.84937725  0.51267791  1.0
  Ta  Ta12  1  0.35923111  0.15062275  0.48732209  1.0
  Se  Se13  1  0.92589778  0.72310248  0.08246614  1.0
  Se  Se14  1  0.07410222  0.27689752  0.91753386  1.0
  Se  Se15  1  0.70162198  0.02062654  0.00878623  1.0
  Se  Se16  1  0.29837802  0.97937346  0.99121377  1.0
  Se  Se17  1  0.99895461  0.94691406  0.78423026  1.0
  Se  Se18  1  0.00104539  0.05308594  0.21576974  1.0
  Se  Se19  1  0.62955154  0.79912006  0.31102022  1.0
  Se  Se20  1  0.37044846  0.20087994  0.68897978  1.0
  Se  Se21  1  0.77783628  0.25102871  0.70916377  1.0
  Se  Se22  1  0.22216372  0.74897129  0.29083623  1.0
  Se  Se23  1  0.22928366  0.64924627  0.85834236  1.0
  Se  Se24  1  0.77071634  0.35075373  0.14165764  1.0
  Se  Se25  1  0.86471061  0.50579934  0.39930671  1.0
  Se  Se26  1  0.13528939  0.49420066  0.60069329  1.0
  Se  Se27  1  0.48763152  0.34672626  0.93609220  1.0
  Se  Se28  1  0.51236848  0.65327374  0.06390780  1.0
  Se  Se29  1  0.32878565  0.88255281  0.55767170  1.0
  Se  Se30  1  0.67121435  0.11744719  0.44232830  1.0
  Se  Se31  1  0.18170463  0.42592679  0.16029821  1.0
  Se  Se32  1  0.81829537  0.57407321  0.83970179  1.0
  Se  Se33  1  0.40765508  0.10769318  0.25213748  1.0
  Se  Se34  1  0.59234492  0.89230682  0.74786252  1.0
  Se  Se35  1  0.08799462  0.19861641  0.47830742  1.0
  Se  Se36  1  0.91200538  0.80138359  0.52169258  1.0
  Se  Se37  1  0.55962633  0.57819761  0.63027578  1.0
  Se  Se38  1  0.44037367  0.42180239  0.36972422  1.0