data_LaVP4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.0
_cell_length_b   6.32
_cell_length_c   8.96
_cell_angle_alpha   90.0
_cell_angle_beta   114.75
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaVP4
_chemical_formula_sum   'La4 V4 P16'
_cell_volume   463.38
_cell_formula_units_Z   4
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
  La  La0  1  0.04  0.44  0.15  1.0
  La  La1  1  0.09  0.28  0.92  1.0
  La  La2  1  0.21  0.88  0.99  1.0
  La  La3  1  0.16  0.04  0.22  1.0
  V  V20  1  0.5  0.13  0.77  1.0
  V  V21  1  0.63  0.97  0.3  1.0
  V  V22  1  0.75  0.19  0.37  1.0
  V  V23  1  0.62  0.35  0.84  1.0
  P  P4  1  0.43  0.4  0.99  1.0
  P  P5  1  0.95  0.23  0.22  1.0
  P  P6  1  0.82  0.93  0.15  1.0
  P  P7  1  0.3  0.09  0.92  1.0
  P  P8  1  0.01  1.0  0.15  1.0
  P  P9  1  0.37  0.16  0.07  1.0
  P  P10  1  0.24  0.33  1.0  1.0
  P  P11  1  0.88  0.17  0.07  1.0
  P  P12  1  0.97  0.39  0.11  1.0
  P  P13  1  0.16  0.55  0.96  1.0
  P  P14  1  0.28  0.93  0.03  1.0
  P  P15  1  0.09  0.77  0.18  1.0
  P  P16  1  0.66  0.71  0.48  1.0
  P  P17  1  0.47  0.87  0.59  1.0
  P  P18  1  0.59  0.61  0.66  1.0
  P  P19  1  0.78  0.45  0.55  1.0

data_LaVP4
_symmetry_space_group_name_H-M   P-1
_cell_length_a   6.32
_cell_length_b   8.96
_cell_length_c   9.0
_cell_angle_alpha   114.75
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   2
_chemical_formula_structural   LaVP4
_chemical_formula_sum   'La4 V4 P16'
_cell_volume   463.38
_cell_formula_units_Z   4
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-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
  La  La0  2  0.12  0.85  0.96  1.0
  La  La1  2  0.28  0.08  0.91  1.0
  V  V2  2  0.03  0.3  0.63  1.0
  V  V3  2  0.19  0.77  0.5  1.0
  P  P4  2  0.0  0.0  0.76  1.0
  P  P5  2  0.07  0.15  0.82  1.0
  P  P6  2  0.17  0.93  0.12  1.0
  P  P7  2  0.23  0.04  0.84  1.0
  P  P8  2  0.23  0.92  0.3  1.0
  P  P9  2  0.29  0.48  0.66  1.0
  P  P10  2  0.39  0.89  0.04  1.0
  P  P11  2  0.45  0.59  0.47  1.0

La La La La V V V V P P P P P P P P P P P P P P P P
La La La La V V V V P P P P P P P P P P P P P P P P 0 16 - o o 1 14 o o o 1 17 o o o 2 18 o o + 3 12 o - o 3 19 o - o 4 7 o o o 4 21 o - o 5 6 o + o 5 20 o o o 6 23 o o o 7 22 o o o 8 13 o o + 8 14 o o o 9 15 o o o 9 16 o o o 10 12 + o o 10 15 o + o 11 18 o - + 11 13 o o + 12 15 - + o 12 19 o o o 13 18 o - o 13 14 o o - 14 17 o o o 15 16 o o o 20 22 o o o 20 23 o o o 21 22 o o o 