# generated using pymatgen
data_Ca3Yb(HgN)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.03704821
_cell_length_b   10.03704911
_cell_length_c   4.92930772
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   160.04996966
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca3Yb(HgN)2
_chemical_formula_sum   'Ca3 Yb1 Hg2 N2'
_cell_volume   169.43675143
_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
  Ca  Ca0  1  0.78146533  0.21853467  0.25000000  1.0
  Ca  Ca1  1  0.38194268  0.61805732  0.75000000  1.0
  Ca  Ca2  1  0.61831513  0.38168487  0.25000000  1.0
  Yb  Yb3  1  0.21923655  0.78076345  0.75000000  1.0
  Hg  Hg4  1  0.04367206  0.95632794  0.75000000  1.0
  Hg  Hg5  1  0.95727167  0.04272833  0.25000000  1.0
  N  N6  1  0.79990185  0.20009815  0.75000000  1.0
  N  N7  1  0.19819373  0.80180627  0.25000000  1.0