data_image0
_chemical_formula_structural       ZrSe2ZrSe2ZrSe2ZrSe2ZrSe2ZrSe2Zr3
_chemical_formula_sum              "Zr9 Se12"
_cell_length_a       6.297217530018254
_cell_length_b       6.296207373507483
_cell_length_c       25.556523130129584
_cell_angle_alpha    90.0
_cell_angle_beta     90.0
_cell_angle_gamma    59.993622506929164

_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
  Zr  Zr1       1.0  2.5234804317146505e-06  0.9999738066948844  0.35657853588293614  1.0000
  Se  Se1       1.0  0.00015008522102187536  0.3332772430529449  0.4291991670442999  1.0000
  Se  Se2       1.0  0.6665796363065299  0.3333083867970486  0.292625084872493  1.0000
  Zr  Zr2       1.0  0.9999701100248924  0.9999382756553148  0.6433838823175094  1.0000
  Se  Se3       1.0  0.0001803027681945774  0.333225927450229  0.7073251947440606  1.0000
  Se  Se4       1.0  0.6666469126459713  0.33331862761004855  0.5707796047108868  1.0000
  Zr  Zr3       1.0  0.33334051007310944  0.33331049390810696  0.35657930515815794  1.0000
  Se  Se5       1.0  0.33346057454180333  0.6666402311384453  0.42920530324675593  1.0000
  Se  Se6       1.0  0.9999399828333789  0.6666356821686519  0.29262321372594635  1.0000
  Zr  Zr4       1.0  0.3333456638869403  0.3333515471646486  0.6433628505051121  1.0000
  Se  Se7       1.0  0.3333799268040008  0.6666451034814733  0.7073365143589601  1.0000
  Se  Se8       1.0  0.999913215224171  0.6666399714234443  0.5707802996410974  1.0000
  Zr  Zr5       1.0  0.6666894957248789  0.6666356582374218  0.35657455529451726  1.0000
  Se  Se9       1.0  0.6667575864219414  0.9999790041789871  0.42919602225032333  1.0000
  Se  Se10      1.0  0.33325040699299263  0.9999724407322594  0.2926263996053238  1.0000
  Zr  Zr6       1.0  0.6667040202396044  0.6666037417308635  0.6434055988865894  1.0000
  Se  Se11      1.0  0.6666617534311461  4.7506488876721266e-05  0.707333225179146  1.0000
  Se  Se12      1.0  0.33330802683358507  0.9998898651440188  0.5707753893487482  1.0000
  Zr  Zr7       1.0  0.33339775676265  0.3332770280172198  0.49999955960109543  1.0000
  Zr  Zr8       1.0  0.666792081655181  0.6666029495145933  0.4999871772438244  1.0000
  Zr  Zr9       1.0  0.9999631437979818  0.9999800308394508  0.4999909539703967  1.0000