# generated using pymatgen
data_LiBeH5(NF2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.16872000
_cell_length_b   8.95719500
_cell_length_c   9.92568700
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiBeH5(NF2)2
_chemical_formula_sum   'Li4 Be4 H20 N8 F16'
_cell_volume   459.53184313
_cell_formula_units_Z   4
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  0.26017200  0.06482500  0.82140300  1
  Li  Li1  1  0.76017200  0.93517500  0.17859700  1
  Li  Li2  1  0.76017200  0.56482500  0.67859700  1
  Li  Li3  1  0.26017200  0.43517500  0.32140300  1
  Be  Be4  1  0.25513900  0.37214400  0.65927200  1
  Be  Be5  1  0.75513900  0.62785600  0.34072800  1
  Be  Be6  1  0.75513900  0.87214400  0.84072800  1
  Be  Be7  1  0.25513900  0.12785600  0.15927200  1
  H  H8  1  0.79112600  0.11792300  0.61842900  1
  H  H9  1  0.29112600  0.88207700  0.38157100  1
  H  H10  1  0.29112600  0.61792300  0.88157100  1
  H  H11  1  0.79112600  0.38207700  0.11842900  1
  H  H12  1  0.56690300  0.04276800  0.51937800  1
  H  H13  1  0.06690300  0.95723200  0.48062200  1
  H  H14  1  0.06690300  0.54276800  0.98062200  1
  H  H15  1  0.56690300  0.45723200  0.01937800  1
  H  H16  1  0.70640000  0.30595800  0.84204700  1
  H  H17  1  0.20640000  0.69404200  0.15795300  1
  H  H18  1  0.20640000  0.80595800  0.65795300  1
  H  H19  1  0.70640000  0.19404200  0.34204700  1
  H  H20  1  0.92746600  0.22674700  0.94701700  1
  H  H21  1  0.42746600  0.77325300  0.05298300  1
  H  H22  1  0.42746600  0.72674700  0.55298300  1
  H  H23  1  0.92746600  0.27325300  0.44701700  1
  H  H24  1  0.60658700  0.20221600  0.97348100  1
  H  H25  1  0.10658700  0.79778400  0.02651900  1
  H  H26  1  0.10658700  0.70221600  0.52651900  1
  H  H27  1  0.60658700  0.29778400  0.47348100  1
  N  N28  1  0.75182100  0.08708600  0.52121400  1
  N  N29  1  0.25182100  0.91291400  0.47878600  1
  N  N30  1  0.25182100  0.58708600  0.97878600  1
  N  N31  1  0.75182100  0.41291400  0.02121400  1
  N  N32  1  0.74639500  0.27761900  0.94186600  1
  N  N33  1  0.24639500  0.72238100  0.05813400  1
  N  N34  1  0.24639500  0.77761900  0.55813400  1
  N  N35  1  0.74639500  0.22238100  0.44186600  1
  F  F36  1  0.55080800  0.39208400  0.69598100  1
  F  F37  1  0.05080800  0.60791600  0.30401900  1
  F  F38  1  0.05080800  0.89208400  0.80401900  1
  F  F39  1  0.55080800  0.10791600  0.19598100  1
  F  F40  1  0.23281000  0.35623500  0.49973200  1
  F  F41  1  0.73281000  0.64376500  0.50026800  1
  F  F42  1  0.73281000  0.85623500  0.00026800  1
  F  F43  1  0.23281000  0.14376500  0.99973200  1
  F  F44  1  0.14266500  0.22943600  0.72494400  1
  F  F45  1  0.64266500  0.77056400  0.27505600  1
  F  F46  1  0.64266500  0.72943600  0.77505600  1
  F  F47  1  0.14266500  0.27056400  0.22494400  1
  F  F48  1  0.60600900  0.01455400  0.79651500  1
  F  F49  1  0.10600900  0.98544600  0.20348500  1
  F  F50  1  0.10600900  0.51455400  0.70348500  1
  F  F51  1  0.60600900  0.48544600  0.29651500  1
