# generated using pymatgen
data_Ba2Cu5F14
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.71429700
_cell_length_b   9.83189242
_cell_length_c   10.49201738
_cell_angle_alpha   114.79963839
_cell_angle_beta   90.00000000
_cell_angle_gamma   109.96554642
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2Cu5F14
_chemical_formula_sum   'Ba4 Cu10 F28'
_cell_volume   582.57476931
_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  0.77990800  0.32532700  0.62993800  1.0
  Ba  Ba1  1  0.45458200  0.67467300  0.87006200  1.0
  Ba  Ba2  1  0.22009200  0.67467300  0.37006200  1.0
  Ba  Ba3  1  0.54541800  0.32532700  0.12993800  1.0
  Cu  Cu4  1  0.64573800  0.00000000  0.75000000  1.0
  Cu  Cu5  1  0.35426200  0.00000000  0.25000000  1.0
  Cu  Cu6  1  0.17658600  0.06985200  0.64025800  1.0
  Cu  Cu7  1  0.10673400  0.93014800  0.85974200  1.0
  Cu  Cu8  1  0.82341400  0.93014800  0.35974200  1.0
  Cu  Cu9  1  0.89326600  0.06985200  0.14025800  1.0
  Cu  Cu10  1  0.29504900  0.35072800  0.49254200  1.0
  Cu  Cu11  1  0.94432100  0.64927200  0.00745800  1.0
  Cu  Cu12  1  0.70495100  0.64927200  0.50745800  1.0
  Cu  Cu13  1  0.05567900  0.35072800  0.99254200  1.0
  F  F14  1  0.01712200  0.72100400  0.86093200  1.0
  F  F15  1  0.29611800  0.27899600  0.63906800  1.0
  F  F16  1  0.98287800  0.27899600  0.13906800  1.0
  F  F17  1  0.70388200  0.72100400  0.36093200  1.0
  F  F18  1  0.11372200  0.92947100  0.36713400  1.0
  F  F19  1  0.18425000  0.07052900  0.13286600  1.0
  F  F20  1  0.88627800  0.07052900  0.63286600  1.0
  F  F21  1  0.81575000  0.92947100  0.86713400  1.0
  F  F22  1  0.82938700  0.50086100  0.39478400  1.0
  F  F23  1  0.32852600  0.49913900  0.10521600  1.0
  F  F24  1  0.17061300  0.49913900  0.60521600  1.0
  F  F25  1  0.67147400  0.50086100  0.89478400  1.0
  F  F26  1  0.05896400  0.84658000  0.61106300  1.0
  F  F27  1  0.21238300  0.15342000  0.88893700  1.0
  F  F28  1  0.53694700  0.93260700  0.35550600  1.0
  F  F29  1  0.60434000  0.06739300  0.14449400  1.0
  F  F30  1  0.46305300  0.06739300  0.64449400  1.0
  F  F31  1  0.39566000  0.93260700  0.85550600  1.0
  F  F32  1  0.54127200  0.78080500  0.60286000  1.0
  F  F33  1  0.76046800  0.21919500  0.89714000  1.0
  F  F34  1  0.45872800  0.21919500  0.39714000  1.0
  F  F35  1  0.23953200  0.78080500  0.10286000  1.0
  F  F36  1  0.64407400  0.55521000  0.63723800  1.0
  F  F37  1  0.08886300  0.44479000  0.86276200  1.0
  F  F38  1  0.35592600  0.44479000  0.36276200  1.0
  F  F39  1  0.91113700  0.55521000  0.13723800  1.0
  F  F40  1  0.78761700  0.84658000  0.11106300  1.0
  F  F41  1  0.94103700  0.15342000  0.38893700  1.0