# generated using pymatgen
data_Nd12Co(RuBr4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.32161317
_cell_length_b   10.32146091
_cell_length_c   10.36669439
_cell_angle_alpha   109.55937676
_cell_angle_beta   109.56002017
_cell_angle_gamma   109.39299164
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd12Co(RuBr4)3
_chemical_formula_sum   'Nd12 Co1 Ru3 Br12'
_cell_volume   849.13345902
_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  0.26779508  0.75273027  0.23534504  1.0
  Nd  Nd1  1  0.48495442  0.75270610  0.01732858  1.0
  Nd  Nd2  1  0.23384696  0.46774170  0.48389617  1.0
  Nd  Nd3  1  0.01408017  0.02814425  0.26405964  1.0
  Nd  Nd4  1  0.23387015  0.26612296  0.75001273  1.0
  Nd  Nd5  1  0.01406306  0.48595291  0.75000994  1.0
  Nd  Nd6  1  0.48496857  0.23222351  0.46760966  1.0
  Nd  Nd7  1  0.26779745  0.01503259  0.03242097  1.0
  Nd  Nd8  1  0.74727206  0.23224919  0.26465574  1.0
  Nd  Nd9  1  0.74727922  0.01500761  0.48264355  1.0
  Nd  Nd10  1  0.47183210  0.48590970  0.23591637  1.0
  Nd  Nd11  1  0.03233212  0.26619671  0.01613656  1.0
  Co  Co12  1  0.50001226  0.99999749  0.25000017  1.0
  Ru  Ru13  1  0.25157769  0.50314914  0.00152789  1.0
  Ru  Ru14  1  0.99685871  0.24843893  0.49847657  1.0
  Ru  Ru15  1  0.25156896  0.24845259  0.25001177  1.0
  Br  Br16  1  0.24974079  0.99216900  0.50710522  1.0
  Br  Br17  1  0.51370344  0.50687935  0.75686985  1.0
  Br  Br18  1  0.24969692  0.75756396  0.74265893  1.0
  Br  Br19  1  0.98367214  0.74178631  0.99186988  1.0
  Br  Br20  1  0.99319286  0.50687715  0.25004766  1.0
  Br  Br21  1  0.74242169  0.99225149  0.98509657  1.0
  Br  Br22  1  0.75815120  0.74179503  0.24994263  1.0
  Br  Br23  1  0.50778382  0.75761623  0.51490860  1.0
  Br  Br24  1  0.50778888  0.25019133  0.99285371  1.0
  Br  Br25  1  0.75820956  0.51637683  0.50823839  1.0
  Br  Br26  1  0.74246390  0.25019718  0.75731055  1.0
  Br  Br27  1  0.99306284  0.98624348  0.74304666  1.0