data_BeAgP2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.64
_cell_length_b   2.64
_cell_length_c   9.34
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   99.27
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BeAgP2
_chemical_formula_sum   'Be1 Ag1 P2'
_cell_volume   64.05
_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
  Be  Be1  1  0.0  0.0  0.35  1.0
  Ag  Ag0  1  0.71  0.0  0.26  1.0
  P  P2  1  0.71  0.0  0.83  1.0
  P  P3  1  0.0  0.0  0.58  1.0

data_BeAgP2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.64
_cell_length_b   2.64
_cell_length_c   9.34
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   99.27
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BeAgP2
_chemical_formula_sum   'Be1 Ag1 P2'
_cell_volume   64.05
_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
  Be  Be0  1  0.0  0.0  0.35  1.0
  Ag  Ag1  1  0.71  0.0  0.26  1.0
  P  P2  1  0.0  0.0  0.58  1.0
  P  P3  1  0.71  0.0  0.83  1.0

Be Ag P P
Be Ag P P 0 1 - o o 0 3 o o o 2 3 o o o 2 3 + o o 2 2 o + o 2 2 + o o 3 3 o + o 3 3 + o o 