# generated using pymatgen
data_Nd3ScHgAu4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.11875163
_cell_length_b   8.11876528
_cell_length_c   8.11876985
_cell_angle_alpha   65.93359994
_cell_angle_beta   65.93454270
_cell_angle_gamma   65.93344969
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd3ScHgAu4
_chemical_formula_sum   'Nd6 Sc2 Hg2 Au8'
_cell_volume   427.02418713
_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
  Nd  Nd0  1  0.89213370  0.19035260  0.61378848  1.0
  Nd  Nd1  1  0.61378824  0.89213381  0.19035338  1.0
  Nd  Nd2  1  0.19035309  0.61378846  0.89213294  1.0
  Nd  Nd3  1  0.10786630  0.80964740  0.38621152  1.0
  Nd  Nd4  1  0.38621176  0.10786619  0.80964662  1.0
  Nd  Nd5  1  0.80964691  0.38621154  0.10786706  1.0
  Sc  Sc6  1  0.66068529  0.66068571  0.66068661  1.0
  Sc  Sc7  1  0.33931471  0.33931429  0.33931339  1.0
  Hg  Hg8  1  0.00000000  0.00000000  0.00000000  1.0
  Hg  Hg9  1  0.50000000  0.50000000  0.50000000  1.0
  Au  Au10  1  0.80300783  0.80300797  0.80300819  1.0
  Au  Au11  1  0.19699217  0.19699203  0.19699181  1.0
  Au  Au12  1  0.93970110  0.55119721  0.32487760  1.0
  Au  Au13  1  0.32487767  0.93970106  0.55119749  1.0
  Au  Au14  1  0.55120833  0.32486348  0.93970926  1.0
  Au  Au15  1  0.06029890  0.44880279  0.67512240  1.0
  Au  Au16  1  0.67512233  0.06029894  0.44880251  1.0
  Au  Au17  1  0.44879167  0.67513652  0.06029074  1.0