# generated using pymatgen
data_Nb3As
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.24691737
_cell_length_b   10.34645639
_cell_length_c   10.34645639
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb3As
_chemical_formula_sum   'Nb24 As8'
_cell_volume   561.67809579
_cell_formula_units_Z   8
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  0.72651577  0.16542370  0.65580456  1.0
  Nb  Nb1  1  0.22651577  0.34419544  0.66542270  1.0
  Nb  Nb2  1  0.22651577  0.15580456  0.83457730  1.0
  Nb  Nb3  1  0.72651577  0.33457730  0.84419544  1.0
  Nb  Nb4  1  0.27348423  0.83457730  0.34419544  1.0
  Nb  Nb5  1  0.77348423  0.65580456  0.33457730  1.0
  Nb  Nb6  1  0.77348423  0.84419544  0.16542370  1.0
  Nb  Nb7  1  0.27348423  0.66542270  0.15580456  1.0
  Nb  Nb8  1  0.51942216  0.10121829  0.26175775  1.0
  Nb  Nb9  1  0.01942216  0.73824225  0.60121729  1.0
  Nb  Nb10  1  0.01942216  0.76175775  0.89878271  1.0
  Nb  Nb11  1  0.51942216  0.39878271  0.23824225  1.0
  Nb  Nb12  1  0.48057784  0.89878271  0.73824225  1.0
  Nb  Nb13  1  0.98057784  0.26175775  0.39878271  1.0
  Nb  Nb14  1  0.98057784  0.23824225  0.10121829  1.0
  Nb  Nb15  1  0.48057784  0.60121729  0.76175775  1.0
  Nb  Nb16  1  0.23955310  0.05630208  0.53631601  1.0
  Nb  Nb17  1  0.73955310  0.46368399  0.55630208  1.0
  Nb  Nb18  1  0.73955310  0.03631601  0.94369792  1.0
  Nb  Nb19  1  0.23955310  0.44369792  0.96368399  1.0
  Nb  Nb20  1  0.76044690  0.94369792  0.46368399  1.0
  Nb  Nb21  1  0.26044590  0.53631601  0.44369792  1.0
  Nb  Nb22  1  0.26044590  0.96368399  0.05630208  1.0
  Nb  Nb23  1  0.76044690  0.55630208  0.03631601  1.0
  As  As24  1  0.02103156  0.04343575  0.27170575  1.0
  As  As25  1  0.52103156  0.72829425  0.54343575  1.0
  As  As26  1  0.52103156  0.77170575  0.95656425  1.0
  As  As27  1  0.02103156  0.45656425  0.22829425  1.0
  As  As28  1  0.97896844  0.95656425  0.72829425  1.0
  As  As29  1  0.47896844  0.27170575  0.45656425  1.0
  As  As30  1  0.47896844  0.22829425  0.04343575  1.0
  As  As31  1  0.97896844  0.54343575  0.77170575  1.0