data_SrZr2Cl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.94
_cell_length_b   6.94
_cell_length_c   6.94
_cell_angle_alpha   152.83
_cell_angle_beta   137.63
_cell_angle_gamma   51.06
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrZr2Cl
_chemical_formula_sum   'Sr1 Zr2 Cl1'
_cell_volume   102.21
_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
  Sr  Sr1  1  0.0  0.0  0.26  1.0
  Zr  Zr2  1  0.0  0.51  0.56  1.0
  Zr  Zr3  1  0.63  0.0  0.7  1.0
  Cl  Cl0  1  0.0  0.0  0.0  1.0

data_SrZr2Cl
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.26
_cell_length_b   5.01
_cell_length_c   6.94
_cell_angle_alpha   111.19
_cell_angle_beta   103.58
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrZr2Cl
_chemical_formula_sum   'Sr1 Zr2 Cl1'
_cell_volume   102.21
_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
  Sr  Sr0  1  0.0  0.26  0.26  1.0
  Zr  Zr1  1  0.0  0.7  0.07  1.0
  Zr  Zr2  1  0.49  0.05  0.05  1.0
  Cl  Cl3  1  0.0  0.0  0.0  1.0

Sr Zr Zr Cl