# generated using pymatgen
data_Nd12As(RuBr4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.52477725
_cell_length_b   10.52477898
_cell_length_c   10.13428751
_cell_angle_alpha   108.72134863
_cell_angle_beta   108.72135183
_cell_angle_gamma   110.21056651
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd12As(RuBr4)3
_chemical_formula_sum   'Nd12 As1 Ru3 Br12'
_cell_volume   872.03304975
_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
  Nd  Nd0  1  0.25540321  0.72659360  0.22826473  1.0
  Nd  Nd1  1  0.47119039  0.72659360  0.99832887  1.0
  Nd  Nd2  1  0.23718760  0.47437420  0.48718760  1.0
  Nd  Nd3  1  0.01640730  0.03281360  0.26640730  1.0
  Nd  Nd4  1  0.23718760  0.26281240  0.75000000  1.0
  Nd  Nd5  1  0.01640730  0.48359270  0.75000000  1.0
  Nd  Nd6  1  0.47119039  0.24459679  0.47286153  1.0
  Nd  Nd7  1  0.25540321  0.02880961  0.02713847  1.0
  Nd  Nd8  1  0.77340640  0.24459679  0.27173527  1.0
  Nd  Nd9  1  0.77340640  0.02880961  0.50167113  1.0
  Nd  Nd10  1  0.46718640  0.48359270  0.23359270  1.0
  Nd  Nd11  1  0.02562580  0.26281240  0.01281240  1.0
  As  As12  1  0.50000000  0.00000000  0.25000000  1.0
  Ru  Ru13  1  0.24816533  0.49633066  0.99816533  1.0
  Ru  Ru14  1  0.00366934  0.25183467  0.50183467  1.0
  Ru  Ru15  1  0.24816533  0.25183467  0.25000000  1.0
  Br  Br16  1  0.25196707  0.98856086  0.49994928  1.0
  Br  Br17  1  0.52302467  0.51151233  0.76151233  1.0
  Br  Br18  1  0.25196707  0.76340621  0.75201879  1.0
  Br  Br19  1  0.00093617  0.75046808  0.00046808  1.0
  Br  Br20  1  0.98848767  0.51151233  0.25000000  1.0
  Br  Br21  1  0.73659379  0.98856086  0.98861158  1.0
  Br  Br22  1  0.74953192  0.75046808  0.25000000  1.0
  Br  Br23  1  0.51143914  0.76340621  0.51138842  1.0
  Br  Br24  1  0.51143914  0.24803293  0.00005072  1.0
  Br  Br25  1  0.74953192  0.49906383  0.49953192  1.0
  Br  Br26  1  0.73659379  0.24803293  0.74798121  1.0
  Br  Br27  1  0.98848767  0.97697533  0.73848767  1.0