# generated using pymatgen
data_Nd9Th(Ga2Ru3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.52059965
_cell_length_b   8.46700993
_cell_length_c   8.46700984
_cell_angle_alpha   108.94839364
_cell_angle_beta   109.87043180
_cell_angle_gamma   109.33812687
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd9Th(Ga2Ru3)2
_chemical_formula_sum   'Nd9 Th1 Ga4 Ru6'
_cell_volume   471.68865122
_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  0.75000000  0.81236271  0.06236271  1.0
  Nd  Nd1  1  0.43948235  0.25184362  0.68915509  1.0
  Nd  Nd2  1  0.68584502  0.43835147  0.24963079  1.0
  Nd  Nd3  1  0.06051865  0.74967373  0.81236226  1.0
  Nd  Nd4  1  0.81415498  0.06378577  0.75250545  1.0
  Nd  Nd5  1  0.22191355  0.21880637  0.22136996  1.0
  Nd  Nd6  1  0.50369431  0.00002692  0.28293839  1.0
  Nd  Nd7  1  0.27808645  0.49945842  0.99689282  1.0
  Nd  Nd8  1  0.99630669  0.27924609  0.49633461  1.0
  Th  Th9  1  0.25000000  0.69206978  0.44207078  1.0
  Ga  Ga10  1  0.50210581  0.00532722  0.91401981  1.0
  Ga  Ga11  1  0.59271891  0.59113538  0.58987773  1.0
  Ga  Ga12  1  0.90728109  0.49715982  0.99841547  1.0
  Ga  Ga13  1  0.99789519  0.91191500  0.50322340  1.0
  Ru  Ru14  1  0.25000100  0.12194052  0.87194052  1.0
  Ru  Ru15  1  0.75000000  0.37863123  0.62863123  1.0
  Ru  Ru16  1  0.87449719  0.24982696  0.12343153  1.0
  Ru  Ru17  1  0.12859344  0.85682163  0.26128347  1.0
  Ru  Ru18  1  0.62550181  0.74893434  0.37532777  1.0
  Ru  Ru19  1  0.37140556  0.63268903  0.72822819  1.0