data_LiZnP2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.44
_cell_length_b   5.44
_cell_length_c   3.85
_cell_angle_alpha   110.39
_cell_angle_beta   110.39
_cell_angle_gamma   36.57
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiZnP2
_chemical_formula_sum   'Li1 Zn1 P2'
_cell_volume   63.25
_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
  Li  Li0  1  0.57  0.0  0.13  1.0
  Zn  Zn3  1  0.39  0.0  0.22  1.0
  P  P1  1  0.08  0.0  0.31  1.0
  P  P2  1  0.93  0.0  0.3  1.0

data_LiZnP2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.42
_cell_length_b   3.85
_cell_length_c   5.44
_cell_angle_alpha   110.39
_cell_angle_beta   108.29
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiZnP2
_chemical_formula_sum   'Li1 Zn1 P2'
_cell_volume   63.25
_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
  Li  Li0  1  0.0  0.13  0.57  1.0
  Zn  Zn1  1  0.0  0.22  0.39  1.0
  P  P2  1  0.0  0.3  0.93  1.0
  P  P3  1  0.0  0.31  0.08  1.0

Li Zn P P