data_image0
_chemical_formula_structural       P2I6
_chemical_formula_sum              "P2 I6"
_cell_length_a       7.43417706185493
_cell_length_b       7.4326635105652405
_cell_length_c       8.22357
_cell_angle_alpha    90.0
_cell_angle_beta     90.0
_cell_angle_gamma    119.99195240576809

_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
  P   P1        1.0  0.04257756324534932  0.3517675956283501  0.00465004857987468  1.0000
  P   P2        1.0  0.9574220276820049  0.6482313169556378  0.504649440571431  1.0000
  I   I1        1.0  0.648185731540721  0.690737149344368  0.00465856069809097  1.0000
  I   I2        1.0  0.3092524753313361  0.9574867082159753  0.00466342476564315  1.0000
  I   I3        1.0  0.6907486686717589  0.04251531121364971  0.504662816757199  1.0000
  I   I4        1.0  0.35181385938663295  0.30926176323962  0.504660384723423  1.0000
  I   I5        1.0  0.333322818972619  0.666635856386023  0.132026601585443  1.0000
  I   I6        1.0  0.666675426916098  0.333363056398355  0.632025993576999  1.0000