# generated using pymatgen
data_Be3Nb6P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.55235970
_cell_length_b   6.55235970
_cell_length_c   3.38953538
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   89.70733607
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Be3Nb6P
_chemical_formula_sum   'Be3 Nb6 P1'
_cell_volume   145.52243961
_cell_formula_units_Z   1
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  0.38599132  0.11415780  0.00000000  1.0
  Be  Be1  1  0.61415780  0.88599132  0.00000000  1.0
  Be  Be2  1  0.11836353  0.61836353  0.00000000  1.0
  Nb  Nb3  1  0.00210577  0.99595875  0.00000000  1.0
  Nb  Nb4  1  0.49595875  0.50210577  0.00000000  1.0
  Nb  Nb5  1  0.67648551  0.17648551  0.50000000  1.0
  Nb  Nb6  1  0.17988837  0.32118422  0.50000000  1.0
  Nb  Nb7  1  0.82118422  0.67988837  0.50000000  1.0
  Nb  Nb8  1  0.32114467  0.82114467  0.50000000  1.0
  P  P9  1  0.88472007  0.38472007  0.00000000  1.0