# generated using pymatgen
data_CaPa(ZnGa)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.33531203
_cell_length_b   4.33531139
_cell_length_c   7.77965178
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999777
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaPa(ZnGa)2
_chemical_formula_sum   'Ca1 Pa1 Zn2 Ga2'
_cell_volume   126.62849866
_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  0.00000000  0.00000000  0.50000000  1.0
  Pa  Pa1  1  0.00000000  0.00000000  0.00000000  1.0
  Zn  Zn2  1  0.33333300  0.66666700  0.77201010  1.0
  Zn  Zn3  1  0.66666700  0.33333300  0.22798990  1.0
  Ga  Ga4  1  0.33333300  0.66666700  0.22287949  1.0
  Ga  Ga5  1  0.66666700  0.33333300  0.77712051  1.0