data_image0
_chemical_formula_structural       TaSe2TaSe2TaSe2TaSe2TaSe2TaSe2Ta3
_chemical_formula_sum              "Ta9 Se12"
_cell_length_a       5.88788080074542
_cell_length_b       5.885694125766052
_cell_length_c       25.556148492420373
_cell_angle_alpha    90.0
_cell_angle_beta     90.0
_cell_angle_gamma    60.03391598895937

_space_group_name_H-M_alt    "P 1"
_space_group_IT_number       1

loop_
  _space_group_symop_operation_xyz
  '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  Ta1       1.0  0.00029753260426639873  0.00048094140324795025  0.3598053811875131  1.0000
  Se  Se1       1.0  4.3753543307555974e-05  0.33327785750718786  0.4309588936402724  1.0000
  Se  Se2       1.0  0.6666071744094204  0.3332395761718612  0.29326352490958596  1.0000
  Ta  Ta2       1.0  0.0001948987018008943  0.9995022200627475  0.6401935371776553  1.0000
  Se  Se3       1.0  0.9999844513174656  0.33325085028654033  0.7066884552402892  1.0000
  Se  Se4       1.0  0.6667207034173104  0.3333060702812632  0.5690879857860223  1.0000
  Ta  Ta3       1.0  0.33273158882294346  0.3336104944706314  0.3598042926040746  1.0000
  Se  Se5       1.0  0.3333334494509726  0.6666325511524192  0.4309252872460908  1.0000
  Se  Se6       1.0  0.9999653407098271  0.6668750252173267  0.2932884140277639  1.0000
  Ta  Ta4       1.0  0.33316822723852146  0.3333040326912499  0.6401726854440634  1.0000
  Se  Se7       1.0  0.3334252426676493  0.6665124830623055  0.7067195162587457  1.0000
  Se  Se8       1.0  0.9999895603495335  0.6665982922696083  0.5690595550543642  1.0000
  Ta  Ta5       1.0  0.6670986139545333  0.6658640391567711  0.3598049816750434  1.0000
  Se  Se9       1.0  0.6666749116208741  0.9999530432716317  0.4308948026055656  1.0000
  Se  Se10      1.0  0.3335998090580193  0.9998798294265501  0.2932814888840924  1.0000
  Ta  Ta6       1.0  0.6666657923067149  0.667056459861925  0.6402033082118184  1.0000
  Se  Se11      1.0  0.6666053803983927  0.00011865566340043372  0.7067416749185362  1.0000
  Se  Se12      1.0  0.33333197205435033  0.9999166671749177  0.5690609163706053  1.0000
  Ta  Ta7       1.0  0.33321380755682095  0.33333338901707943  0.5000030843376042  1.0000
  Ta  Ta8       1.0  0.6667716204779923  0.6665335317575056  0.499992312761438  1.0000
  Ta  Ta9       1.0  4.624177637059311e-05  0.9999427198233414  0.4999989107822646  1.0000