data_image0
_chemical_formula_structural       Te6Fe3
_chemical_formula_sum              "Te6 Fe3"
_cell_length_a       6.119894357036908
_cell_length_b       6.119894363770876
_cell_length_c       18.38875593
_cell_angle_alpha    90.0
_cell_angle_beta     90.0
_cell_angle_gamma    120.0000000177094

_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
  Te  Te1       1.0  0.36268143541548037  4.0664253572525236e-13  0.41777312175136366  1.0000
  Te  Te2       1.0  1.120533044409862e-09  0.3626814354297016  0.41777312175136366  1.0000
  Te  Te3       1.0  0.6373185648481735  0.6373185652200783  0.41777312175136366  1.0000
  Te  Te4       1.0  0.3333333310792993  0.666666670873347  0.5722299023411966  1.0000
  Te  Te5       1.0  0.6666666703048877  0.3333333297768396  0.5722299023411966  1.0000
  Te  Te6       1.0  2.1190587978899576e-21  1.142096160724062e-33  0.6019984773379936  1.0000
  Fe  Fe1       1.0  0.7315317469254659  8.202016852407052e-13  0.5000741526509564  1.0000
  Fe  Fe2       1.0  0.9999999993690509  0.7315317461018399  0.5000741526509564  1.0000
  Fe  Fe3       1.0  0.26846825251225603  0.26846825266072843  0.5000741526509564  1.0000