# generated using pymatgen
data_Nd6Fe13Hg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.09362400
_cell_length_b   8.09362400
_cell_length_c   12.82748412
_cell_angle_alpha   108.38978072
_cell_angle_beta   108.38978072
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd6Fe13Hg
_chemical_formula_sum   'Nd12 Fe26 Hg2'
_cell_volume   752.01912139
_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  0.97493000  0.47493000  0.62543000  1.0
  Nd  Nd1  1  0.65050000  0.15050000  0.62543000  1.0
  Nd  Nd2  1  0.15050000  0.97493000  0.62543000  1.0
  Nd  Nd3  1  0.47493000  0.65050000  0.62543000  1.0
  Nd  Nd4  1  0.02507000  0.52507000  0.37457000  1.0
  Nd  Nd5  1  0.34950000  0.84950000  0.37457000  1.0
  Nd  Nd6  1  0.84950000  0.02507000  0.37457000  1.0
  Nd  Nd7  1  0.52507000  0.34950000  0.37457000  1.0
  Nd  Nd8  1  0.60599800  0.60599800  0.21199700  1.0
  Nd  Nd9  1  0.10599800  0.10599800  0.21199700  1.0
  Nd  Nd10  1  0.39400200  0.39400200  0.78800300  1.0
  Nd  Nd11  1  0.89400200  0.89400200  0.78800300  1.0
  Fe  Fe12  1  0.11807500  0.61807500  0.88018000  1.0
  Fe  Fe13  1  0.76210500  0.26210500  0.88018000  1.0
  Fe  Fe14  1  0.26210500  0.11807500  0.88018000  1.0
  Fe  Fe15  1  0.61807500  0.76210500  0.88018000  1.0
  Fe  Fe16  1  0.88192500  0.38192500  0.11982000  1.0
  Fe  Fe17  1  0.23789500  0.73789500  0.11982000  1.0
  Fe  Fe18  1  0.73789500  0.88192500  0.11982000  1.0
  Fe  Fe19  1  0.38192500  0.23789500  0.11982000  1.0
  Fe  Fe20  1  0.71040500  0.56672400  0.00000000  1.0
  Fe  Fe21  1  0.28959500  0.43327600  0.00000000  1.0
  Fe  Fe22  1  0.78959500  0.06672400  0.00000000  1.0
  Fe  Fe23  1  0.21040500  0.93327600  0.00000000  1.0
  Fe  Fe24  1  0.56672400  0.28959500  0.00000000  1.0
  Fe  Fe25  1  0.43327600  0.71040500  0.00000000  1.0
  Fe  Fe26  1  0.06672400  0.21040500  0.00000000  1.0
  Fe  Fe27  1  0.93327600  0.78959500  0.00000000  1.0
  Fe  Fe28  1  0.29034700  0.79034700  0.80837200  1.0
  Fe  Fe29  1  0.51802500  0.01802500  0.80837200  1.0
  Fe  Fe30  1  0.01802500  0.29034700  0.80837200  1.0
  Fe  Fe31  1  0.79034700  0.51802500  0.80837200  1.0
  Fe  Fe32  1  0.70965300  0.20965300  0.19162800  1.0
  Fe  Fe33  1  0.48197500  0.98197500  0.19162800  1.0
  Fe  Fe34  1  0.98197500  0.70965300  0.19162800  1.0
  Fe  Fe35  1  0.20965300  0.48197500  0.19162800  1.0
  Fe  Fe36  1  0.00000000  0.50000000  0.00000000  1.0
  Fe  Fe37  1  0.50000000  0.00000000  0.00000000  1.0
  Hg  Hg38  1  0.25000000  0.25000000  0.50000000  1.0
  Hg  Hg39  1  0.75000000  0.75000000  0.50000000  1.0