data_image0
_chemical_formula_structural       I3Ag3
_chemical_formula_sum              "I3 Ag3"
_cell_length_a       4.653719605019263
_cell_length_b       6.467547003700276
_cell_length_c       20.49584668
_cell_angle_alpha    90.0
_cell_angle_beta     90.0
_cell_angle_gamma    90.0

_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
  I   I1        1.0  0.7854292695369364  0.2541580801901471  0.6330761994166129  1.0000
  I   I2        1.0  0.7854292695369364  0.2903695201481416  0.3669249203224426  1.0000
  I   I3        1.0  0.06492543505932806  0.7722645103533702  0.499998879773041  1.0000
  Ag  Ag1       1.0  0.3220620551318747  0.07711912564603518  0.5721670040322531  1.0000
  Ag  Ag2       1.0  0.3220620551318747  0.46740846541516584  0.4278341157068023  1.0000
  Ag  Ag3       1.0  0.8164374505722445  0.272264510639435  0.499998879773041  1.0000