data_AgP2Br
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.66
_cell_length_b   6.66
_cell_length_c   4.71
_cell_angle_alpha   92.14
_cell_angle_beta   92.14
_cell_angle_gamma   29.11
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AgP2Br
_chemical_formula_sum   'Ag1 P2 Br1'
_cell_volume   101.64
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  '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
  Ag  Ag0  1  0.36  0.0  0.35  1.0
  P  P2  1  0.94  0.0  0.5  1.0
  P  P3  1  0.78  0.0  0.2  1.0
  Br  Br1  1  0.0  0.0  0.0  1.0

data_AgP2Br
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.35
_cell_length_b   4.71
_cell_length_c   6.66
_cell_angle_alpha   92.14
_cell_angle_beta   104.55
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AgP2Br
_chemical_formula_sum   'Ag1 P2 Br1'
_cell_volume   101.64
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  '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
  Ag  Ag0  1  0.0  0.35  0.36  1.0
  P  P1  1  0.0  0.2  0.78  1.0
  P  P2  1  0.0  0.5  0.94  1.0
  Br  Br3  1  0.0  0.0  0.0  1.0

Ag P P Br