# generated using pymatgen
data_Hf6BN4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.59745440
_cell_length_b   5.59745340
_cell_length_c   5.57812460
_cell_angle_alpha   99.70599168
_cell_angle_beta   99.70598496
_cell_angle_gamma   119.70182774
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf6BN4
_chemical_formula_sum   'Hf6 B1 N4'
_cell_volume   143.00062982
_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
  Hf  Hf0  1  0.43149643  0.08516004  0.25175730  1.0
  Hf  Hf1  1  0.08357033  0.42612845  0.24899231  1.0
  Hf  Hf2  1  0.73603185  0.73753802  0.26079679  1.0
  Hf  Hf3  1  0.26246298  0.26396915  0.73920321  1.0
  Hf  Hf4  1  0.91483996  0.56850357  0.74824070  1.0
  Hf  Hf5  1  0.57387155  0.91642967  0.75100569  1.0
  B  B6  1  0.16628670  0.83371230  0.50000000  1.0
  N  N7  1  0.66679944  0.33319956  1.00000000  1.0
  N  N8  1  0.33275549  0.66724351  1.00000000  1.0
  N  N9  1  0.83166757  0.16833143  0.50000000  1.0
  N  N10  1  0.50021569  0.49978231  0.50000000  1.0