# generated using pymatgen
data_Ba19Na29Li13
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   19.32568890
_cell_length_b   19.32568895
_cell_length_c   19.32568860
_cell_angle_alpha   60.00000061
_cell_angle_beta   60.00000051
_cell_angle_gamma   59.99999944
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba19Na29Li13
_chemical_formula_sum   'Ba38 Na58 Li26'
_cell_volume   5103.75655571
_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  0.04240362  0.64117076  0.27402201  1
  Ba  Ba1  1  0.27402201  0.64117076  0.04240362  1
  Ba  Ba2  1  0.65572725  0.65572725  0.03281824  1
  Ba  Ba3  1  0.49681702  0.49681702  0.12693688  1
  Ba  Ba4  1  0.04240362  0.04240362  0.27402201  1
  Ba  Ba5  1  0.90696522  0.27910435  0.90696522  1
  Ba  Ba6  1  0.90696522  0.90696522  0.90696522  1
  Ba  Ba7  1  0.49681702  0.12693688  0.49681702  1
  Ba  Ba8  1  0.04240362  0.27402201  0.04240362  1
  Ba  Ba9  1  0.40540360  0.40540360  0.78378920  1
  Ba  Ba10  1  0.04240362  0.27402201  0.64117076  1
  Ba  Ba11  1  0.90696522  0.90696522  0.27910435  1
  Ba  Ba12  1  0.27910435  0.90696522  0.90696522  1
  Ba  Ba13  1  0.12693688  0.87942907  0.49681702  1
  Ba  Ba14  1  0.49681702  0.49681702  0.87942907  1
  Ba  Ba15  1  0.12693688  0.49681702  0.87942907  1
  Ba  Ba16  1  0.64117076  0.04240362  0.27402201  1
  Ba  Ba17  1  0.87942907  0.49681702  0.49681702  1
  Ba  Ba18  1  0.87942907  0.49681702  0.12693688  1
  Ba  Ba19  1  0.75000000  0.75000000  0.75000000  1
  Ba  Ba20  1  0.65572725  0.03281824  0.65572725  1
  Ba  Ba21  1  0.78378920  0.40540360  0.40540360  1
  Ba  Ba22  1  0.49681702  0.12693688  0.87942907  1
  Ba  Ba23  1  0.49681702  0.87942907  0.49681702  1
  Ba  Ba24  1  0.40540360  0.40540360  0.40540360  1
  Ba  Ba25  1  0.27402201  0.04240362  0.04240362  1
  Ba  Ba26  1  0.04240362  0.64117076  0.04240362  1
  Ba  Ba27  1  0.27402201  0.04240362  0.64117076  1
  Ba  Ba28  1  0.40540360  0.78378920  0.40540360  1
  Ba  Ba29  1  0.65572725  0.65572725  0.65572725  1
  Ba  Ba30  1  0.12693688  0.49681702  0.49681702  1
  Ba  Ba31  1  0.03281824  0.65572725  0.65572725  1
  Ba  Ba32  1  0.64117076  0.04240362  0.04240362  1
  Ba  Ba33  1  0.87942907  0.12693688  0.49681702  1
  Ba  Ba34  1  0.49681702  0.87942907  0.12693688  1
  Ba  Ba35  1  0.50000000  0.50000000  0.50000000  1
  Ba  Ba36  1  0.64117076  0.27402201  0.04240362  1
  Ba  Ba37  1  0.04240362  0.04240362  0.64117076  1
  Na  Na38  1  0.51195032  0.69880224  0.89462372  1
  Na  Na39  1  0.26765771  0.26765771  0.83204519  1
  Na  Na40  1  0.63263939  0.26765771  0.26765771  1
  Na  Na41  1  0.04931570  0.85205290  0.04931570  1
  Na  Na42  1  0.08176281  0.76290972  0.76290972  1
  Na  Na43  1  0.76290972  0.08176281  0.39241774  1
  Na  Na44  1  0.04931570  0.04931570  0.85205290  1
  Na  Na45  1  0.83204519  0.26765771  0.63263939  1
  Na  Na46  1  0.69880224  0.89462372  0.89462372  1
  Na  Na47  1  0.45496268  0.26689866  0.63906933  1
  Na  Na48  1  0.26765771  0.63263939  0.83204519  1
  Na  Na49  1  0.63906933  0.26689866  0.45496268  1
  Na  Na50  1  0.26765771  0.63263939  0.26765771  1
  Na  Na51  1  0.63906933  0.45496268  0.63906933  1
  Na  Na52  1  0.63263939  0.83204519  0.26765771  1
  Na  Na53  1  0.45496268  0.63906933  0.63906933  1
  Na  Na54  1  0.08176281  0.39241774  0.76290972  1
  Na  Na55  1  0.51195032  0.89462372  0.69880224  1
  Na  Na56  1  0.63906933  0.63906933  0.45496268  1
  Na  Na57  1  0.89462372  0.69880224  0.89462372  1
  Na  Na58  1  0.76290972  0.76290972  0.08176281  1
  Na  Na59  1  0.63906933  0.63906933  0.26689866  1
  Na  Na60  1  0.63906933  0.45496268  0.26689866  1
  Na  Na61  1  0.39241774  0.76290972  0.08176281  1
  Na  Na62  1  0.04931570  0.04931570  0.04931570  1
  Na  Na63  1  0.84086408  0.15913592  0.84086408  1
  Na  Na64  1  0.84086408  0.15913592  0.15913592  1
  Na  Na65  1  0.63263939  0.26765771  0.83204519  1
  Na  Na66  1  0.26765771  0.83204519  0.63263939  1
  Na  Na67  1  0.39241774  0.76290972  0.76290972  1
  Na  Na68  1  0.63906933  0.26689866  0.63906933  1
  Na  Na69  1  0.84086408  0.84086408  0.15913592  1
  Na  Na70  1  0.89462372  0.89462372  0.51195032  1
  Na  Na71  1  0.51195032  0.89462372  0.89462372  1
  Na  Na72  1  0.76290972  0.39241774  0.76290972  1
  Na  Na73  1  0.85205290  0.04931570  0.04931570  1
  Na  Na74  1  0.76290972  0.08176281  0.76290972  1
  Na  Na75  1  0.15913592  0.15913592  0.84086408  1
  Na  Na76  1  0.08176281  0.76290972  0.39241774  1
  Na  Na77  1  0.83204519  0.63263939  0.26765771  1
  Na  Na78  1  0.89462372  0.51195032  0.69880224  1
  Na  Na79  1  0.76290972  0.39241774  0.08176281  1
  Na  Na80  1  0.69880224  0.89462372  0.51195032  1
  Na  Na81  1  0.83204519  0.26765771  0.26765771  1
  Na  Na82  1  0.39241774  0.08176281  0.76290972  1
  Na  Na83  1  0.26765771  0.26765771  0.63263939  1
  Na  Na84  1  0.69880224  0.51195032  0.89462372  1
  Na  Na85  1  0.26765771  0.83204519  0.26765771  1
  Na  Na86  1  0.45496268  0.63906933  0.26689866  1
  Na  Na87  1  0.26689866  0.63906933  0.63906933  1
  Na  Na88  1  0.89462372  0.51195032  0.89462372  1
  Na  Na89  1  0.89462372  0.89462372  0.69880224  1
  Na  Na90  1  0.15913592  0.84086408  0.15913592  1
  Na  Na91  1  0.89462372  0.69880224  0.51195032  1
  Na  Na92  1  0.15913592  0.84086408  0.84086408  1
  Na  Na93  1  0.26689866  0.63906933  0.45496268  1
  Na  Na94  1  0.26689866  0.45496268  0.63906933  1
  Na  Na95  1  0.76290972  0.76290972  0.39241774  1
  Li  Li96  1  0.18162311  0.18162311  0.18162311  1
  Li  Li97  1  0.18162311  0.18162311  0.45513068  1
  Li  Li98  1  0.99409405  0.45626003  0.27482296  1
  Li  Li99  1  0.38747155  0.38747155  0.11252845  1
  Li  Li100  1  0.45513068  0.18162311  0.18162311  1
  Li  Li101  1  0.28939649  0.28939649  0.13181052  1
  Li  Li102  1  0.11252845  0.38747155  0.38747155  1
  Li  Li103  1  0.27482296  0.27482296  0.99409405  1
  Li  Li104  1  0.45626003  0.27482296  0.99409405  1
  Li  Li105  1  0.27482296  0.99409405  0.45626003  1
  Li  Li106  1  0.18162311  0.45513068  0.18162311  1
  Li  Li107  1  0.27482296  0.45626003  0.27482296  1
  Li  Li108  1  0.27482296  0.27482296  0.45626003  1
  Li  Li109  1  0.45626003  0.27482296  0.27482296  1
  Li  Li110  1  0.27482296  0.99409405  0.27482296  1
  Li  Li111  1  0.13181052  0.28939649  0.28939649  1
  Li  Li112  1  0.28939649  0.13181052  0.28939649  1
  Li  Li113  1  0.45626003  0.99409405  0.27482296  1
  Li  Li114  1  0.38747155  0.11252845  0.38747155  1
  Li  Li115  1  0.28939649  0.28939649  0.28939649  1
  Li  Li116  1  0.27482296  0.45626003  0.99409405  1
  Li  Li117  1  0.11252845  0.38747155  0.11252845  1
  Li  Li118  1  0.99409405  0.27482296  0.45626003  1
  Li  Li119  1  0.38747155  0.11252845  0.11252845  1
  Li  Li120  1  0.99409405  0.27482296  0.27482296  1
  Li  Li121  1  0.11252845  0.11252845  0.38747155  1
