# generated using pymatgen
data_Ca3Nd5(CdRu)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.93663648
_cell_length_b   9.93620314
_cell_length_c   9.93620315
_cell_angle_alpha   59.99835288
_cell_angle_beta   59.99943190
_cell_angle_gamma   59.99943138
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca3Nd5(CdRu)2
_chemical_formula_sum   'Ca6 Nd10 Cd4 Ru4'
_cell_volume   693.67523700
_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
  Ca  Ca0  1  0.94178281  0.55816767  0.55816767  1.0
  Ca  Ca1  1  0.55811914  0.94193134  0.94193134  1.0
  Ca  Ca2  1  0.55816875  0.94187303  0.55803323  1.0
  Ca  Ca3  1  0.94183396  0.55812257  0.94188308  1.0
  Ca  Ca4  1  0.55816875  0.55803323  0.94187303  1.0
  Ca  Ca5  1  0.94183396  0.94188308  0.55812257  1.0
  Nd  Nd6  1  0.34494657  0.34479649  0.34479649  1.0
  Nd  Nd7  1  0.34488386  0.34473045  0.96553926  1.0
  Nd  Nd8  1  0.34488386  0.96553926  0.34473045  1.0
  Nd  Nd9  1  0.96548464  0.34480060  0.34480060  1.0
  Nd  Nd10  1  0.80626774  0.19370761  0.19370761  1.0
  Nd  Nd11  1  0.19372960  0.80626157  0.80626157  1.0
  Nd  Nd12  1  0.19371460  0.80636215  0.19371607  1.0
  Nd  Nd13  1  0.80616926  0.19371840  0.80637322  1.0
  Nd  Nd14  1  0.19371460  0.19371607  0.80636215  1.0
  Nd  Nd15  1  0.80616926  0.80637322  0.19371840  1.0
  Cd  Cd16  1  0.57669991  0.57670795  0.57670795  1.0
  Cd  Cd17  1  0.57658537  0.57665424  0.27009176  1.0
  Cd  Cd18  1  0.57658537  0.27009176  0.57665424  1.0
  Cd  Cd19  1  0.27018410  0.57658515  0.57658515  1.0
  Ru  Ru20  1  0.13403581  0.13395654  0.13395654  1.0
  Ru  Ru21  1  0.13398849  0.13399138  0.59803792  1.0
  Ru  Ru22  1  0.13398849  0.59803792  0.13399138  1.0
  Ru  Ru23  1  0.59806009  0.13395731  0.13395731  1.0