# generated using pymatgen
data_Be(NF2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.78757800
_cell_length_b   7.66208000
_cell_length_c   11.72534900
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Be(NF2)2
_chemical_formula_sum   'Be4 N8 F16'
_cell_volume   609.79982259
_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
  Be  Be0  1  0.75000000  0.19257500  0.09766500  1.0
  Be  Be1  1  0.75000000  0.69257500  0.40233500  1.0
  Be  Be2  1  0.25000000  0.80742500  0.90233500  1.0
  Be  Be3  1  0.25000000  0.30742500  0.59766500  1.0
  N  N4  1  0.75000000  0.77391200  0.12757600  1.0
  N  N5  1  0.75000000  0.27391200  0.37242400  1.0
  N  N6  1  0.25000000  0.22608800  0.87242400  1.0
  N  N7  1  0.25000000  0.72608800  0.62757600  1.0
  N  N8  1  0.75000000  0.48005400  0.85936100  1.0
  N  N9  1  0.75000000  0.98005400  0.64063900  1.0
  N  N10  1  0.25000000  0.51994600  0.14063900  1.0
  N  N11  1  0.25000000  0.01994600  0.35936100  1.0
  F  F12  1  0.75000000  0.59915200  0.12440800  1.0
  F  F13  1  0.75000000  0.09915200  0.37559200  1.0
  F  F14  1  0.25000000  0.40084800  0.87559200  1.0
  F  F15  1  0.25000000  0.90084800  0.62440800  1.0
  F  F16  1  0.75000000  0.31538300  0.90183100  1.0
  F  F17  1  0.75000000  0.81538300  0.59816900  1.0
  F  F18  1  0.25000000  0.68461700  0.09816900  1.0
  F  F19  1  0.25000000  0.18461700  0.40183100  1.0
  F  F20  1  0.95399400  0.19059500  0.10736900  1.0
  F  F21  1  0.54600600  0.69059500  0.39263100  1.0
  F  F22  1  0.45399400  0.80940500  0.89263100  1.0
  F  F23  1  0.04600600  0.30940500  0.60736900  1.0
  F  F24  1  0.04600600  0.80940500  0.89263100  1.0
  F  F25  1  0.45399400  0.30940500  0.60736900  1.0
  F  F26  1  0.54600600  0.19059500  0.10736900  1.0
  F  F27  1  0.95399400  0.69059500  0.39263100  1.0