# generated using pymatgen
data_Nb6AlAsC2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.64871311
_cell_length_b   5.64871227
_cell_length_c   8.40000426
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   145.77561422
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb6AlAsC2
_chemical_formula_sum   'Nb6 Al1 As1 C2'
_cell_volume   150.74783428
_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
  Nb  Nb0  1  0.86890939  0.13108861  0.04891471  1.0
  Nb  Nb1  1  0.54699338  0.45300462  0.25000000  1.0
  Nb  Nb2  1  0.86890939  0.13108861  0.45108529  1.0
  Nb  Nb3  1  0.13294926  0.86704874  0.55685077  1.0
  Nb  Nb4  1  0.44591764  0.55408036  0.75000000  1.0
  Nb  Nb5  1  0.13294926  0.86704874  0.94314923  1.0
  Al  Al6  1  0.24530474  0.75469326  0.25000000  1.0
  As  As7  1  0.75772567  0.24227233  0.75000000  1.0
  C  C8  1  0.50016563  0.49983237  0.99764928  1.0
  C  C9  1  0.50016563  0.49983237  0.50235072  1.0