# generated using pymatgen
data_Ca11Si4ClO18
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.70201106
_cell_length_b   8.70201106
_cell_length_c   8.70201106
_cell_angle_alpha   105.22783343
_cell_angle_beta   105.22783343
_cell_angle_gamma   118.33878533
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca11Si4ClO18
_chemical_formula_sum   'Ca11 Si4 Cl1 O18'
_cell_volume   498.02731454
_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  0.29322400  0.54980800  0.25658400  1.0
  Ca  Ca1  1  0.29322400  0.03664000  0.74341600  1.0
  Ca  Ca2  1  0.96336000  0.70677600  0.25658400  1.0
  Ca  Ca3  1  0.70677600  0.96336000  0.25658400  1.0
  Ca  Ca4  1  0.45019200  0.70677600  0.74341600  1.0
  Ca  Ca5  1  0.70677600  0.45019200  0.74341600  1.0
  Ca  Ca6  1  0.03664000  0.29322400  0.74341600  1.0
  Ca  Ca7  1  0.54980800  0.29322400  0.25658400  1.0
  Ca  Ca8  1  0.00000000  0.50000000  0.50000000  1.0
  Ca  Ca9  1  0.50000000  0.00000000  0.50000000  1.0
  Ca  Ca10  1  0.00000000  0.00000000  0.00000000  1.0
  Si  Si11  1  0.78871300  0.78871300  0.57742700  1.0
  Si  Si12  1  0.21128700  0.21128700  0.42257300  1.0
  Si  Si13  1  0.78871300  0.21128700  0.00000000  1.0
  Si  Si14  1  0.21128700  0.78871300  0.00000000  1.0
  Cl  Cl15  1  0.50000000  0.50000000  0.00000000  1.0
  O  O16  1  0.18300000  0.36499200  0.54799200  1.0
  O  O17  1  0.81700000  0.63500800  0.45200800  1.0
  O  O18  1  0.36499200  0.81700000  0.18199200  1.0
  O  O19  1  0.81700000  0.36499200  0.18199200  1.0
  O  O20  1  0.63500800  0.18300000  0.81800800  1.0
  O  O21  1  0.18300000  0.63500800  0.81800800  1.0
  O  O22  1  0.63500800  0.81700000  0.45200800  1.0
  O  O23  1  0.36499200  0.18300000  0.54799200  1.0
  O  O24  1  0.29173300  0.29173300  0.28626700  1.0
  O  O25  1  0.00546600  0.00546600  0.71373300  1.0
  O  O26  1  0.99453400  0.70826700  0.00000000  1.0
  O  O27  1  0.70826700  0.99453400  0.00000000  1.0
  O  O28  1  0.25000000  0.75000000  0.50000000  1.0
  O  O29  1  0.75000000  0.25000000  0.50000000  1.0
  O  O30  1  0.70826700  0.70826700  0.71373300  1.0
  O  O31  1  0.99453400  0.99453400  0.28626700  1.0
  O  O32  1  0.00546600  0.29173300  0.00000000  1.0
  O  O33  1  0.29173300  0.00546600  0.00000000  1.0