# generated using pymatgen
data_Ca4SnHgPd4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.80588598
_cell_length_b   5.80588642
_cell_length_c   8.17390615
_cell_angle_alpha   76.97267843
_cell_angle_beta   76.97268446
_cell_angle_gamma   58.67130377
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca4SnHgPd4
_chemical_formula_sum   'Ca4 Sn1 Hg1 Pd4'
_cell_volume   227.35200714
_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  0.50096958  0.79632481  0.34938765  1.0
  Ca  Ca1  1  0.20367519  0.49903042  0.15061235  1.0
  Ca  Ca2  1  0.49910827  0.20155160  0.64898563  1.0
  Ca  Ca3  1  0.79844840  0.50089173  0.85101437  1.0
  Sn  Sn4  1  0.84113730  0.15886270  0.25000000  1.0
  Hg  Hg5  1  0.17459076  0.82540924  0.75000000  1.0
  Pd  Pd6  1  0.72727242  0.00921395  0.00205915  1.0
  Pd  Pd7  1  0.99078605  0.27272758  0.49794085  1.0
  Pd  Pd8  1  0.26820973  0.00419968  0.00064013  1.0
  Pd  Pd9  1  0.99580032  0.73179027  0.49935987  1.0