data_BePCl2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.3
_cell_length_b   6.3
_cell_length_c   6.3
_cell_angle_alpha   147.96
_cell_angle_beta   147.96
_cell_angle_gamma   45.94
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BePCl2
_chemical_formula_sum   'Be1 P1 Cl2'
_cell_volume   70.01
_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  0.0  1.0
  P  P3  1  0.0  0.74  0.9  1.0
  Cl  Cl1  1  0.74  0.0  0.9  1.0
  Cl  Cl2  1  0.0  0.0  0.8  1.0

data_BePCl2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.48
_cell_length_b   3.48
_cell_length_c   6.3
_cell_angle_alpha   106.02
_cell_angle_beta   106.02
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BePCl2
_chemical_formula_sum   'Be1 P1 Cl2'
_cell_volume   70.01
_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  0.0  1.0
  P  P1  1  0.84  0.74  0.84  1.0
  Cl  Cl2  1  0.1  0.0  0.84  1.0
  Cl  Cl3  1  0.2  0.0  0.2  1.0

Be P Cl Cl