# generated using pymatgen
data_Ta3VSe6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.02129067
_cell_length_b   6.02129067
_cell_length_c   12.87082283
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000533
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta3VSe6
_chemical_formula_sum   'Ta6 V2 Se12'
_cell_volume   404.12536076
_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
  Ta  Ta0  1  0.00000000  -0.00000000  0.49999506  1.0
  Ta  Ta1  1  0.00000000  -0.00000000  0.00000494  1.0
  Ta  Ta2  1  0.33333300  0.66666700  0.00025485  1.0
  Ta  Ta3  1  0.66666700  0.33333300  0.99977725  1.0
  Ta  Ta4  1  0.66666700  0.33333300  0.50022275  1.0
  Ta  Ta5  1  0.33333300  0.66666700  0.49974515  1.0
  V  V6  1  0.33333300  0.66666700  0.25000000  1.0
  V  V7  1  0.66666700  0.33333300  0.75000000  1.0
  Se  Se8  1  0.33294405  0.32945318  0.37109779  1.0
  Se  Se9  1  0.67054682  0.00349088  0.37109779  1.0
  Se  Se10  1  0.99650912  0.66705595  0.37109779  1.0
  Se  Se11  1  0.32948527  0.33296488  0.62886516  1.0
  Se  Se12  1  0.00347961  0.67051473  0.62886516  1.0
  Se  Se13  1  0.66703512  0.99652039  0.62886516  1.0
  Se  Se14  1  0.66703512  0.67051473  0.87113484  1.0
  Se  Se15  1  0.32948527  0.99652039  0.87113484  1.0
  Se  Se16  1  0.00347961  0.33296488  0.87113484  1.0
  Se  Se17  1  0.67054682  0.66705595  0.12890221  1.0
  Se  Se18  1  0.99650912  0.32945318  0.12890221  1.0
  Se  Se19  1  0.33294405  0.00349088  0.12890221  1.0