# generated using pymatgen
data_ErB9N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.49118588
_cell_length_b   5.49118730
_cell_length_c   7.55413060
_cell_angle_alpha   111.31258511
_cell_angle_beta   68.68741047
_cell_angle_gamma   119.99999368
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ErB9N
_chemical_formula_sum   'Er2 B18 N2'
_cell_volume   179.05066784
_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
  Er  Er0  1  0.29909869  0.70090031  0.10270293  1.0
  Er  Er1  1  0.70089931  0.29909969  0.89729707  1.0
  B  B2  1  0.18034805  0.14306554  0.10578302  1.0
  B  B3  1  0.85693546  0.14306454  0.10578302  1.0
  B  B4  1  0.85693546  0.81965295  0.10578302  1.0
  B  B5  1  0.35182464  0.32370011  0.29557557  1.0
  B  B6  1  0.67630089  0.32369911  0.29557557  1.0
  B  B7  1  0.67630089  0.64817636  0.29557557  1.0
  B  B8  1  0.33722947  0.13355581  0.45909787  1.0
  B  B9  1  0.33722947  0.66277053  0.45909787  1.0
  B  B10  1  0.86644319  0.66277053  0.45909787  1.0
  B  B11  1  0.13355581  0.33722947  0.54090313  1.0
  B  B12  1  0.66277053  0.33722947  0.54090313  1.0
  B  B13  1  0.66277053  0.86644419  0.54090313  1.0
  B  B14  1  0.32370011  0.35182464  0.70442443  1.0
  B  B15  1  0.32370011  0.67630089  0.70442443  1.0
  B  B16  1  0.64817436  0.67629989  0.70442443  1.0
  B  B17  1  0.14306554  0.18034805  0.89421698  1.0
  B  B18  1  0.14306554  0.85693546  0.89421698  1.0
  B  B19  1  0.81965295  0.85693546  0.89421698  1.0
  N  N20  1  0.19038072  0.80961828  0.42885584  1.0
  N  N21  1  0.80961828  0.19038072  0.57114416  1.0