# generated using pymatgen
data_BeNb3B2Ru3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.17799910
_cell_length_b   9.03449798
_cell_length_c   15.66763480
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BeNb3B2Ru3
_chemical_formula_sum   'Be4 Nb12 B8 Ru12'
_cell_volume   449.84327736
_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  0.00000000  0.60946368  0.83235334  1.0
  Be  Be1  1  0.00000000  0.39053632  0.16764666  1.0
  Be  Be2  1  0.00000000  0.10946368  0.66764666  1.0
  Be  Be3  1  0.00000000  0.89053632  0.33235334  1.0
  Nb  Nb4  1  0.00000000  0.80201518  0.49541333  1.0
  Nb  Nb5  1  0.00000000  0.19798482  0.50458667  1.0
  Nb  Nb6  1  0.00000000  0.30201518  0.00458667  1.0
  Nb  Nb7  1  0.00000000  0.69798482  0.99541333  1.0
  Nb  Nb8  1  0.00000000  0.51351072  0.59568470  1.0
  Nb  Nb9  1  0.00000000  0.48648928  0.40431530  1.0
  Nb  Nb10  1  0.00000000  0.01351072  0.90431530  1.0
  Nb  Nb11  1  0.00000000  0.98648928  0.09568470  1.0
  Nb  Nb12  1  0.00000000  0.68444913  0.20451339  1.0
  Nb  Nb13  1  0.00000000  0.31555087  0.79548661  1.0
  Nb  Nb14  1  0.00000000  0.18444913  0.29548661  1.0
  Nb  Nb15  1  0.00000000  0.81555087  0.70451339  1.0
  B  B16  1  0.50000000  0.60493351  0.49683588  1.0
  B  B17  1  0.50000000  0.39506649  0.50316412  1.0
  B  B18  1  0.50000000  0.10493351  0.00316412  1.0
  B  B19  1  0.50000000  0.89506649  0.99683588  1.0
  B  B20  1  0.50000000  0.71378074  0.59904768  1.0
  B  B21  1  0.50000000  0.28621926  0.40095232  1.0
  B  B22  1  0.50000000  0.21378074  0.90095232  1.0
  B  B23  1  0.50000000  0.78621926  0.09904768  1.0
  Ru  Ru24  1  0.50000000  0.71502476  0.35755102  1.0
  Ru  Ru25  1  0.50000000  0.28497524  0.64244898  1.0
  Ru  Ru26  1  0.50000000  0.21502476  0.14244898  1.0
  Ru  Ru27  1  0.50000000  0.78497524  0.85755102  1.0
  Ru  Ru28  1  0.50000000  0.52159705  0.09405125  1.0
  Ru  Ru29  1  0.50000000  0.47840295  0.90594875  1.0
  Ru  Ru30  1  0.50000000  0.02159705  0.40594875  1.0
  Ru  Ru31  1  0.50000000  0.97840295  0.59405125  1.0
  Ru  Ru32  1  0.50000000  0.56711113  0.73097224  1.0
  Ru  Ru33  1  0.50000000  0.43288887  0.26902776  1.0
  Ru  Ru34  1  0.50000000  0.06711113  0.76902776  1.0
  Ru  Ru35  1  0.50000000  0.93288887  0.23097224  1.0