# generated using pymatgen
data_Zr4InHgN2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.31661110
_cell_length_b   3.31661145
_cell_length_c   14.63825675
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99998662
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr4InHgN2
_chemical_formula_sum   'Zr4 In1 Hg1 N2'
_cell_volume   139.44700641
_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
  Zr  Zr0  1  0.33333300  0.66666700  0.41868109  1.0
  Zr  Zr1  1  0.66666700  0.33333300  0.58540749  1.0
  Zr  Zr2  1  0.66666700  0.33333300  0.91459251  1.0
  Zr  Zr3  1  0.33333300  0.66666700  0.08131891  1.0
  In  In4  1  0.66666700  0.33333300  0.25000000  1.0
  Hg  Hg5  1  0.33333300  0.66666700  0.75000000  1.0
  N  N6  1  0.00000000  0.00000000  0.50322785  1.0
  N  N7  1  0.00000000  0.00000000  0.99677215  1.0