data_image0
_chemical_formula_structural       P4S6
_chemical_formula_sum              "P4 S6"
_cell_length_a       5.345863811348538
_cell_length_b       6.650176176889885
_cell_length_c       33.86447668799999
_cell_angle_alpha    90.0
_cell_angle_beta     90.0
_cell_angle_gamma    92.83053007562317

_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  0.0022819513668856117  0.030431642276335946  0.5646918786368345  1.0000
  P   P2        1.0  0.5022819513871147  0.5304316423504282  0.4353081214222248  1.0000
  P   P3        1.0  0.024507484166414194  0.8760402742136805  0.4595709915551377  1.0000
  P   P4        1.0  0.5245074843825724  0.3760402745129997  0.5404290082086269  1.0000
  S   S1        1.0  0.9459793362118315  0.7995353493292909  0.5209660693280874  1.0000
  S   S2        1.0  0.4459793361916024  0.29953534925519865  0.4790339307309719  1.0000
  S   S3        1.0  0.9003313224356602  0.5977481148371574  0.430476213594221  1.0000
  S   S4        1.0  0.4003313224154311  0.09774811476306519  0.5695237861695436  1.0000
  S   S5        1.0  0.9205436697594807  0.3322906840188371  0.5478520560329294  1.0000
  S   S6        1.0  0.4205436695433226  0.832290683719518  0.4521479437308352  1.0000