# generated using pymatgen
data_Ca6Ag16P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.62466330
_cell_length_b   8.62466293
_cell_length_c   8.62466325
_cell_angle_alpha   109.47122368
_cell_angle_beta   109.47122280
_cell_angle_gamma   109.47122256
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca6Ag16P
_chemical_formula_sum   'Ca6 Ag16 P1'
_cell_volume   493.86073509
_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  0.28178071  0.28178071  1.0
  Ca  Ca1  1  0.28178071  0.00000000  0.28178071  1.0
  Ca  Ca2  1  0.71821929  1.00000000  0.71821929  1.0
  Ca  Ca3  1  0.71821929  0.71821929  1.00000000  1.0
  Ca  Ca4  1  0.28178071  0.28178071  0.00000000  1.0
  Ca  Ca5  1  0.00000000  0.71821929  0.71821929  1.0
  Ag  Ag6  1  0.50000000  0.50000000  0.50000000  1.0
  Ag  Ag7  1  0.50000000  0.00000000  0.00000000  1.0
  Ag  Ag8  1  0.00000000  0.50000000  0.00000000  1.0
  Ag  Ag9  1  0.00000000  0.00000000  0.50000000  1.0
  Ag  Ag10  1  0.68196985  0.34098493  0.34098493  1.0
  Ag  Ag11  1  0.34098493  1.00000000  0.65901507  1.0
  Ag  Ag12  1  0.34098493  0.68196985  0.34098493  1.0
  Ag  Ag13  1  0.34098493  0.34098493  0.68196985  1.0
  Ag  Ag14  1  0.34098493  0.65901507  1.00000000  1.0
  Ag  Ag15  1  0.00000000  0.34098493  0.65901507  1.0
  Ag  Ag16  1  1.00000000  0.65901507  0.34098493  1.0
  Ag  Ag17  1  0.65901507  0.65901507  0.31803015  1.0
  Ag  Ag18  1  0.65901507  0.00000000  0.34098493  1.0
  Ag  Ag19  1  0.65901507  0.34098493  0.00000000  1.0
  Ag  Ag20  1  0.65901507  0.31803015  0.65901507  1.0
  Ag  Ag21  1  0.31803015  0.65901507  0.65901507  1.0
  P  P22  1  0.00000000  0.00000000  0.00000000  1.0