data_LiVP2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.55
_cell_length_b   6.96
_cell_length_c   6.96
_cell_angle_alpha   21.99
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiVP2
_chemical_formula_sum   'Li1 V1 P2'
_cell_volume   64.35
_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  0.0  0.66  1.0
  V  V3  1  0.77  0.0  0.41  1.0
  P  P1  1  0.77  0.0  0.21  1.0
  P  P2  1  0.0  0.0  0.18  1.0

data_LiVP2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.65
_cell_length_b   3.55
_cell_length_c   6.96
_cell_angle_alpha   90.0
_cell_angle_beta   101.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiVP2
_chemical_formula_sum   'Li1 V1 P2'
_cell_volume   64.35
_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  0.34  0.0  0.34  1.0
  V  V1  1  0.59  0.77  0.59  1.0
  P  P2  1  0.79  0.77  0.79  1.0
  P  P3  1  0.82  0.0  0.82  1.0

Li V P P
Li V P P 0 1 - o o 1 2 o o o 2 3 + o o 