# generated using pymatgen
data_BeV3N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.01573441
_cell_length_b   5.01573415
_cell_length_c   7.49134788
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   146.22901069
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BeV3N
_chemical_formula_sum   'Be2 V6 N2'
_cell_volume   104.76253153
_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
  Be  Be0  1  0.25719020  0.74280980  0.25000000  1.0
  Be  Be1  1  0.74280980  0.25719020  0.75000000  1.0
  V  V2  1  0.94176551  0.05823449  0.25000000  1.0
  V  V3  1  0.05823449  0.94176551  0.75000000  1.0
  V  V4  1  0.63820880  0.36179120  0.44740742  1.0
  V  V5  1  0.36179120  0.63820880  0.55259258  1.0
  V  V6  1  0.63820880  0.36179120  0.05259258  1.0
  V  V7  1  0.36179120  0.63820880  0.94740742  1.0
  N  N8  1  0.00000000  0.00000000  0.50000000  1.0
  N  N9  1  0.00000000  0.00000000  0.00000000  1.0