# generated using pymatgen
data_Zr3AgHg3F20
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.69615004
_cell_length_b   10.69615004
_cell_length_c   8.55074318
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999924
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr3AgHg3F20
_chemical_formula_sum   'Zr6 Ag2 Hg6 F40'
_cell_volume   847.20687271
_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
  Zr  Zr0  1  0.58377816  0.72273868  0.75000000  1.0
  Zr  Zr1  1  0.41622184  0.27726132  0.25000000  1.0
  Zr  Zr2  1  0.13895953  0.41622184  0.75000000  1.0
  Zr  Zr3  1  0.86104047  0.58377816  0.25000000  1.0
  Zr  Zr4  1  0.27726132  0.86104047  0.75000000  1.0
  Zr  Zr5  1  0.72273868  0.13895953  0.25000000  1.0
  Ag  Ag6  1  0.00000000  -0.00000000  0.75000000  1.0
  Ag  Ag7  1  0.00000000  -0.00000000  0.25000000  1.0
  Hg  Hg8  1  0.73066335  0.16182770  0.75000000  1.0
  Hg  Hg9  1  0.26933665  0.83817230  0.25000000  1.0
  Hg  Hg10  1  0.43116435  0.26933665  0.75000000  1.0
  Hg  Hg11  1  0.56883565  0.73066335  0.25000000  1.0
  Hg  Hg12  1  0.83817230  0.56883565  0.75000000  1.0
  Hg  Hg13  1  0.16182770  0.43116435  0.25000000  1.0
  F  F14  1  0.57430844  0.71959856  0.98307953  1.0
  F  F15  1  0.42569156  0.28040144  0.01692047  1.0
  F  F16  1  0.14529112  0.42569156  0.98307953  1.0
  F  F17  1  0.42569156  0.28040144  0.48307953  1.0
  F  F18  1  0.85470888  0.57430844  0.01692047  1.0
  F  F19  1  0.57430844  0.71959856  0.51692047  1.0
  F  F20  1  0.28040144  0.85470888  0.98307953  1.0
  F  F21  1  0.85470888  0.57430844  0.48307953  1.0
  F  F22  1  0.71959856  0.14529112  0.01692047  1.0
  F  F23  1  0.14529112  0.42569156  0.51692047  1.0
  F  F24  1  0.71959856  0.14529112  0.48307953  1.0
  F  F25  1  0.28040144  0.85470888  0.51692047  1.0
  F  F26  1  0.72008431  0.94318319  0.75000000  1.0
  F  F27  1  0.27991569  0.05681681  0.25000000  1.0
  F  F28  1  0.22309788  0.27991569  0.75000000  1.0
  F  F29  1  0.77690212  0.72008431  0.25000000  1.0
  F  F30  1  0.05681681  0.77690212  0.75000000  1.0
  F  F31  1  0.94318319  0.22309788  0.25000000  1.0
  F  F32  1  0.96943926  0.19950744  0.75000000  1.0
  F  F33  1  0.03056074  0.80049256  0.25000000  1.0
  F  F34  1  0.23006918  0.03056074  0.75000000  1.0
  F  F35  1  0.76993082  0.96943926  0.25000000  1.0
  F  F36  1  0.80049256  0.76993082  0.75000000  1.0
  F  F37  1  0.19950744  0.23006918  0.25000000  1.0
  F  F38  1  0.66666700  0.33333300  0.75000000  1.0
  F  F39  1  0.33333300  0.66666700  0.25000000  1.0
  F  F40  1  0.36615775  0.55030864  0.75000000  1.0
  F  F41  1  0.63384225  0.44969136  0.25000000  1.0
  F  F42  1  0.18415189  0.63384225  0.75000000  1.0
  F  F43  1  0.81584811  0.36615775  0.25000000  1.0
  F  F44  1  0.44969136  0.81584811  0.75000000  1.0
  F  F45  1  0.55030864  0.18415189  0.25000000  1.0
  F  F46  1  0.94337844  0.41221053  0.75000000  1.0
  F  F47  1  0.05662156  0.58778947  0.25000000  1.0
  F  F48  1  0.46883209  0.05662156  0.75000000  1.0
  F  F49  1  0.53116791  0.94337844  0.25000000  1.0
  F  F50  1  0.58778947  0.53116791  0.75000000  1.0
  F  F51  1  0.41221053  0.46883209  0.25000000  1.0
  F  F52  1  0.00000000  -0.00000000  0.00000000  1.0
  F  F53  1  0.00000000  -0.00000000  0.50000000  1.0