# generated using pymatgen
data_Ba3Li2V2Cl4O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.68413069
_cell_length_b   8.68413069
_cell_length_c   14.60865299
_cell_angle_alpha   89.50977416
_cell_angle_beta   89.50977416
_cell_angle_gamma   39.59141187
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba3Li2V2Cl4O7
_chemical_formula_sum   'Ba6 Li4 V4 Cl8 O14'
_cell_volume   702.09296557
_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
  Ba  Ba0  1  0.13584900  0.13584900  0.27400400  1
  Ba  Ba1  1  0.86587400  0.86587400  0.28023300  1
  Ba  Ba2  1  0.86415100  0.86415100  0.72599600  1
  Ba  Ba3  1  0.50000000  0.50000000  0.50000000  1
  Ba  Ba4  1  0.13412600  0.13412600  0.71976700  1
  Ba  Ba5  1  0.50000000  0.50000000  0.00000000  1
  Li  Li6  1  0.00000000  0.50000000  0.50000000  1
  Li  Li7  1  0.30200000  0.30200000  0.88332100  1
  Li  Li8  1  0.69800000  0.69800000  0.11667900  1
  Li  Li9  1  0.50000000  0.00000000  0.50000000  1
  V  V10  1  0.50381900  0.50381900  0.25167600  1
  V  V11  1  0.68873800  0.68873800  0.87278200  1
  V  V12  1  0.49618100  0.49618100  0.74832400  1
  V  V13  1  0.31126200  0.31126200  0.12721800  1
  Cl  Cl14  1  0.99821800  0.99821800  0.11577600  1
  Cl  Cl15  1  0.31472000  0.31472000  0.38018900  1
  Cl  Cl16  1  0.11718400  0.11718400  0.49870400  1
  Cl  Cl17  1  0.00178200  0.00178200  0.88422400  1
  Cl  Cl18  1  0.88281600  0.88281600  0.50129600  1
  Cl  Cl19  1  0.31071500  0.31071500  0.62039000  1
  Cl  Cl20  1  0.68928500  0.68928500  0.37961000  1
  Cl  Cl21  1  0.68528000  0.68528000  0.61981100  1
  O  O22  1  0.73576200  0.26958200  0.32278800  1
  O  O23  1  0.26958200  0.73576200  0.32278800  1
  O  O24  1  0.41286800  0.41286800  0.17879300  1
  O  O25  1  0.58840800  0.58840800  0.18190000  1
  O  O26  1  0.26423800  0.73041800  0.67721200  1
  O  O27  1  0.50576900  0.97734400  0.83432400  1
  O  O28  1  0.02265600  0.49423100  0.16567600  1
  O  O29  1  0.58713200  0.58713200  0.82120700  1
  O  O30  1  0.41159200  0.41159200  0.81810000  1
  O  O31  1  0.49423100  0.02265600  0.16567600  1
  O  O32  1  0.66946400  0.66946400  0.98750200  1
  O  O33  1  0.73041800  0.26423800  0.67721200  1
  O  O34  1  0.33053600  0.33053600  0.01249800  1
  O  O35  1  0.97734400  0.50576900  0.83432400  1
