# generated using pymatgen
data_Nb3VSe6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.07608963
_cell_length_b   6.07608894
_cell_length_c   12.81984776
_cell_angle_alpha   90.00005352
_cell_angle_beta   90.00001287
_cell_angle_gamma   120.00016602
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb3VSe6
_chemical_formula_sum   'Nb6 V2 Se12'
_cell_volume   409.88409577
_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
  Nb  Nb0  1  0.00000019  -0.00000011  0.49998705  1.0
  Nb  Nb1  1  -0.00000143  -0.00000130  0.00001271  1.0
  Nb  Nb2  1  0.33333188  0.66666558  -0.00006423  1.0
  Nb  Nb3  1  0.66666539  0.33333205  0.00009178  1.0
  Nb  Nb4  1  0.66666665  0.33333278  0.49990725  1.0
  Nb  Nb5  1  0.33333298  0.66666634  0.50006458  1.0
  V  V6  1  0.33333265  0.66666598  0.25000040  1.0
  V  V7  1  0.66666591  0.33333256  0.74999927  1.0
  Se  Se8  1  0.33289205  0.33082846  0.37040414  1.0
  Se  Se9  1  0.66917137  0.00206209  0.37040445  1.0
  Se  Se10  1  0.99793641  0.66710790  0.37040400  1.0
  Se  Se11  1  0.33081631  0.33288371  0.62960272  1.0
  Se  Se12  1  0.00206711  0.66918383  0.62960252  1.0
  Se  Se13  1  0.66711654  0.99793203  0.62960291  1.0
  Se  Se14  1  0.66711460  0.66916895  0.87039757  1.0
  Se  Se15  1  0.33082829  0.99794452  0.87039777  1.0
  Se  Se16  1  0.00205321  0.33288251  0.87039742  1.0
  Se  Se17  1  0.66917092  0.66710644  0.12959561  1.0
  Se  Se18  1  0.99794831  0.33084090  0.12959619  1.0
  Se  Se19  1  0.33289066  0.00206379  0.12959588  1.0