data_image0
_chemical_formula_structural       As2
_chemical_formula_sum              "As2"
_cell_length_a       3.607522096600583
_cell_length_b       3.607522096600582
_cell_length_c       15.458797983036568
_cell_angle_alpha    90.0
_cell_angle_beta     90.0
_cell_angle_gamma    119.99999999999999

_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
  As  As1       1.0  2.697478615961638e-16  2.361511457661159e-16  0.5451548868867054  1.0000
  As  As2       1.0  0.6666666666666669  0.33333333333333376  0.4548451529243686  1.0000