# generated using pymatgen
data_Nb5B2As
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.35037684
_cell_length_b   7.35037713
_cell_length_c   7.35037739
_cell_angle_alpha   129.35942697
_cell_angle_beta   129.35943039
_cell_angle_gamma   74.43291912
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb5B2As
_chemical_formula_sum   'Nb10 B4 As2'
_cell_volume   231.38217405
_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
  Nb  Nb0  1  0.00000000  0.00000000  0.00000000  1.0
  Nb  Nb1  1  0.50000000  0.50000000  0.00000000  1.0
  Nb  Nb2  1  0.80469739  0.30469739  0.83384093  1.0
  Nb  Nb3  1  0.19530261  0.69530261  0.16615907  1.0
  Nb  Nb4  1  0.47085646  0.97085646  0.16615907  1.0
  Nb  Nb5  1  0.30469739  0.47085646  0.50000000  1.0
  Nb  Nb6  1  0.02914354  0.19530261  0.50000000  1.0
  Nb  Nb7  1  0.52914354  0.02914354  0.83384093  1.0
  Nb  Nb8  1  0.69530261  0.52914354  0.50000000  1.0
  Nb  Nb9  1  0.97085646  0.80469739  0.50000000  1.0
  B  B10  1  0.11399638  0.61399638  0.72799075  1.0
  B  B11  1  0.88600362  0.38600362  0.27200925  1.0
  B  B12  1  0.61399638  0.88600362  0.50000000  1.0
  B  B13  1  0.38600362  0.11399638  0.50000000  1.0
  As  As14  1  0.25000000  0.25000000  0.00000000  1.0
  As  As15  1  0.75000000  0.75000000  0.00000000  1.0