data_La5V3S6O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.81
_cell_length_b   18.0
_cell_length_c   10.23
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La5V3S6O7
_chemical_formula_sum   'La10 V6 S12 O14'
_cell_volume   700.93
_cell_formula_units_Z   2
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  0.9  0.08  0.31  1.0
  La  La1  1  0.9  0.92  0.31  1.0
  La  La2  1  0.9  0.0  0.35  1.0
  La  La3  1  0.9  0.94  1.0  1.0
  La  La4  1  0.9  0.06  1.0  1.0
  La  La5  1  0.0  0.94  0.23  1.0
  La  La6  1  0.0  0.06  0.23  1.0
  La  La7  1  0.0  1.0  0.88  1.0
  La  La8  1  0.0  0.08  0.92  1.0
  La  La9  1  0.0  0.91  0.92  1.0
  V  V36  1  0.9  0.47  0.54  1.0
  V  V37  1  0.9  0.53  0.54  1.0
  V  V38  1  0.9  1.0  0.18  1.0
  V  V39  1  0.0  0.0  0.05  1.0
  V  V40  1  0.0  0.47  0.69  1.0
  V  V41  1  0.0  0.53  0.69  1.0
  S  S24  1  0.9  0.0  0.51  1.0
  S  S25  1  0.9  0.14  0.61  1.0
  S  S26  1  0.9  0.86  0.61  1.0
  S  S27  1  0.9  0.27  0.72  1.0
  S  S28  1  0.9  0.73  0.72  1.0
  S  S29  1  0.9  0.0  0.77  1.0
  S  S30  1  0.0  1.0  0.46  1.0
  S  S31  1  0.0  0.26  0.51  1.0
  S  S32  1  0.0  0.73  0.51  1.0
  S  S33  1  0.0  0.14  0.62  1.0
  S  S34  1  0.0  0.86  0.62  1.0
  S  S35  1  0.0  1.0  0.72  1.0
  O  O10  1  0.9  0.19  0.1  1.0
  O  O11  1  0.9  0.81  0.1  1.0
  O  O12  1  0.9  0.82  0.96  1.0
  O  O13  1  0.9  0.17  0.96  1.0
  O  O14  1  0.9  0.43  0.07  1.0
  O  O15  1  0.9  0.56  0.07  1.0
  O  O16  1  0.9  1.0  0.24  1.0
  O  O17  1  0.0  0.0  0.99  1.0
  O  O18  1  0.0  0.44  0.16  1.0
  O  O19  1  0.0  0.56  0.16  1.0
  O  O20  1  0.0  0.82  0.27  1.0
  O  O21  1  0.0  0.17  0.27  1.0
  O  O22  1  0.0  0.19  0.13  1.0
  O  O23  1  0.0  0.81  0.13  1.0

data_La5V3S6O7
_symmetry_space_group_name_H-M   P2/m
_cell_length_a   3.81
_cell_length_b   18.0
_cell_length_c   10.23
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   10
_chemical_formula_structural   La5V3S6O7
_chemical_formula_sum   'La10 V6 S12 O14'
_cell_volume   700.93
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-x, -y, -z'
  3  '-x, y, -z'
  4  '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  4  0.45  0.06  0.88  1.0
  La  La1  4  0.45  0.08  0.19  1.0
  La  La2  2  0.45  0.0  0.24  1.0
  V  V3  4  0.45  0.47  0.43  1.0
  V  V4  2  0.45  0.0  0.07  1.0
  S  S5  4  0.45  0.14  0.49  1.0
  S  S6  4  0.45  0.27  0.6  1.0
  S  S7  2  0.45  0.0  0.4  1.0
  S  S8  2  0.45  0.0  0.66  1.0
  O  O9  4  0.45  0.18  0.85  1.0
  O  O10  4  0.45  0.19  0.99  1.0
  O  O11  4  0.45  0.43  0.96  1.0
  O  O12  2  0.45  0.0  0.13  1.0

La La La La La La La La La La V V V V V V S S S S S S S S S S S S O O O O O O O O O O O O O O