# generated using pymatgen
data_Li3NbHO2F7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.56382000
_cell_length_b   13.00190000
_cell_length_c   14.25184500
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3NbHO2F7
_chemical_formula_sum   'Li24 Nb8 H8 O16 F56'
_cell_volume   1216.28282666
_cell_formula_units_Z   8
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
  Li  Li0  1  0.20277900  0.34536400  0.26691500  1
  Li  Li1  1  0.20277900  0.84536400  0.73308500  1
  Li  Li2  1  0.23131500  0.36654300  0.99588100  1
  Li  Li3  1  0.23131500  0.86654300  0.00411900  1
  Li  Li4  1  0.23084400  0.56269800  0.11917600  1
  Li  Li5  1  0.23084400  0.06269800  0.88082400  1
  Li  Li6  1  0.26915600  0.06269800  0.38082400  1
  Li  Li7  1  0.26915600  0.56269800  0.61917600  1
  Li  Li8  1  0.26868500  0.36654300  0.49588100  1
  Li  Li9  1  0.26868500  0.86654300  0.50411900  1
  Li  Li10  1  0.29722100  0.84536400  0.23308500  1
  Li  Li11  1  0.29722100  0.34536400  0.76691500  1
  Li  Li12  1  0.70277900  0.65463600  0.23308500  1
  Li  Li13  1  0.70277900  0.15463600  0.76691500  1
  Li  Li14  1  0.73131500  0.13345700  0.49588100  1
  Li  Li15  1  0.73131500  0.63345700  0.50411900  1
  Li  Li16  1  0.73084400  0.43730200  0.38082400  1
  Li  Li17  1  0.73084400  0.93730200  0.61917600  1
  Li  Li18  1  0.76915600  0.43730200  0.88082400  1
  Li  Li19  1  0.76915600  0.93730200  0.11917600  1
  Li  Li20  1  0.76868500  0.13345700  0.99588100  1
  Li  Li21  1  0.76868500  0.63345700  0.00411900  1
  Li  Li22  1  0.79722100  0.15463600  0.26691500  1
  Li  Li23  1  0.79722100  0.65463600  0.73308500  1
  Nb  Nb24  1  0.24177300  0.60881300  0.36845800  1
  Nb  Nb25  1  0.24177300  0.10881300  0.63154200  1
  Nb  Nb26  1  0.25822700  0.10881300  0.13154200  1
  Nb  Nb27  1  0.25822700  0.60881300  0.86845800  1
  Nb  Nb28  1  0.74177300  0.39118700  0.13154200  1
  Nb  Nb29  1  0.74177300  0.89118700  0.86845800  1
  Nb  Nb30  1  0.75822700  0.89118700  0.36845800  1
  Nb  Nb31  1  0.75822700  0.39118700  0.63154200  1
  H  H32  1  0.00000000  0.25000000  0.40136000  1
  H  H33  1  0.00000000  0.75000000  0.11647000  1
  H  H34  1  0.00000000  0.25000000  0.88353000  1
  H  H35  1  0.00000000  0.75000000  0.59864000  1
  H  H36  1  0.50000000  0.75000000  0.61647000  1
  H  H37  1  0.50000000  0.75000000  0.09864000  1
  H  H38  1  0.50000000  0.25000000  0.90136000  1
  H  H39  1  0.50000000  0.25000000  0.38353000  1
  O  O40  1  0.02903800  0.35327100  0.67678400  1
  O  O41  1  0.02903800  0.85327100  0.32321600  1
  O  O42  1  0.04366400  0.42615300  0.59883400  1
  O  O43  1  0.04366400  0.92615300  0.40116600  1
  O  O44  1  0.45633600  0.42615300  0.09883400  1
  O  O45  1  0.45633600  0.92615300  0.90116600  1
  O  O46  1  0.47096200  0.35327100  0.17678400  1
  O  O47  1  0.47096200  0.85327100  0.82321600  1
  O  O48  1  0.52903800  0.14672900  0.17678400  1
  O  O49  1  0.52903800  0.64672900  0.82321600  1
  O  O50  1  0.54366400  0.07384700  0.09883400  1
  O  O51  1  0.54366400  0.57384700  0.90116600  1
  O  O52  1  0.95633600  0.57384700  0.40116600  1
  O  O53  1  0.95633600  0.07384700  0.59883400  1
  O  O54  1  0.97096200  0.64672900  0.32321600  1
  O  O55  1  0.97096200  0.14672900  0.67678400  1
  F  F56  1  0.03934400  0.33681000  0.39980000  1
  F  F57  1  0.03934400  0.83681000  0.60020000  1
  F  F58  1  0.02183400  0.83828800  0.11562300  1
  F  F59  1  0.02183400  0.33828800  0.88437700  1
  F  F60  1  0.05156300  0.40751300  0.13229000  1
  F  F61  1  0.05156300  0.90751300  0.86771000  1
  F  F62  1  0.18214000  0.19800300  0.24214400  1
  F  F63  1  0.18214000  0.69800300  0.75785600  1
  F  F64  1  0.21323100  0.01770600  0.01743100  1
  F  F65  1  0.21323100  0.51770600  0.98256900  1
  F  F66  1  0.22229300  0.22517300  0.04628600  1
  F  F67  1  0.22229300  0.72517300  0.95371400  1
  F  F68  1  0.24708700  0.99380700  0.22250300  1
  F  F69  1  0.24708700  0.49380700  0.77749700  1
  F  F70  1  0.25291300  0.49380700  0.27749700  1
  F  F71  1  0.25291300  0.99380700  0.72250300  1
  F  F72  1  0.27770700  0.72517300  0.45371400  1
  F  F73  1  0.27770700  0.22517300  0.54628600  1
  F  F74  1  0.28676900  0.01770600  0.51743100  1
  F  F75  1  0.28676900  0.51770600  0.48256900  1
  F  F76  1  0.31786000  0.69800300  0.25785600  1
  F  F77  1  0.31786000  0.19800300  0.74214400  1
  F  F78  1  0.44843700  0.40751300  0.63229000  1
  F  F79  1  0.44843700  0.90751300  0.36771000  1
  F  F80  1  0.47816600  0.83828800  0.61562300  1
  F  F81  1  0.47816600  0.33828800  0.38437700  1
  F  F82  1  0.46065700  0.83681000  0.10020000  1
  F  F83  1  0.46065700  0.33681000  0.89980000  1
  F  F84  1  0.53934300  0.66319000  0.10020000  1
  F  F85  1  0.53934300  0.16319000  0.89980000  1
  F  F86  1  0.52183400  0.66171200  0.61562300  1
  F  F87  1  0.52183400  0.16171200  0.38437700  1
  F  F88  1  0.55156300  0.09248700  0.63229000  1
  F  F89  1  0.55156300  0.59248700  0.36771000  1
  F  F90  1  0.68214000  0.80199700  0.25785600  1
  F  F91  1  0.68214000  0.30199700  0.74214400  1
  F  F92  1  0.71323100  0.98229400  0.48256900  1
  F  F93  1  0.71323100  0.48229400  0.51743100  1
  F  F94  1  0.72229300  0.77482700  0.45371400  1
  F  F95  1  0.72229300  0.27482700  0.54628600  1
  F  F96  1  0.74708700  0.50619300  0.72250300  1
  F  F97  1  0.74708700  0.00619300  0.27749700  1
  F  F98  1  0.75291300  0.50619300  0.22250300  1
  F  F99  1  0.75291300  0.00619300  0.77749700  1
  F  F100  1  0.77770700  0.27482700  0.04628600  1
  F  F101  1  0.77770700  0.77482700  0.95371400  1
  F  F102  1  0.78676900  0.48229400  0.01743100  1
  F  F103  1  0.78676900  0.98229400  0.98256900  1
  F  F104  1  0.81786000  0.30199700  0.24214400  1
  F  F105  1  0.81786000  0.80199700  0.75785600  1
  F  F106  1  0.94843700  0.09248700  0.13229000  1
  F  F107  1  0.94843700  0.59248700  0.86771000  1
  F  F108  1  0.97816600  0.66171200  0.11562300  1
  F  F109  1  0.97816600  0.16171200  0.88437700  1
  F  F110  1  0.96065700  0.16319000  0.39980000  1
  F  F111  1  0.96065700  0.66319000  0.60020000  1
