# generated using pymatgen
data_K3CaOs2O9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.98177892
_cell_length_b   5.98177901
_cell_length_c   14.60990032
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99998362
_symmetry_Int_Tables_number   1
_chemical_formula_structural   K3CaOs2O9
_chemical_formula_sum   'K6 Ca2 Os4 O18'
_cell_volume   452.72937989
_cell_formula_units_Z   2
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
  K  K0  1  0.00000000  0.00000000  0.25000000  1.0
  K  K1  1  0.00000000  0.00000000  0.75000000  1.0
  K  K2  1  0.33333300  0.66666700  0.39006414  1.0
  K  K3  1  0.66666700  0.33333300  0.60993586  1.0
  K  K4  1  0.66666700  0.33333300  0.89006414  1.0
  K  K5  1  0.33333300  0.66666700  0.10993586  1.0
  Ca  Ca6  1  0.00000000  0.00000000  0.50000000  1.0
  Ca  Ca7  1  0.00000000  0.00000000  0.00000000  1.0
  Os  Os8  1  0.66666700  0.33333300  0.34823046  1.0
  Os  Os9  1  0.33333300  0.66666700  0.65176954  1.0
  Os  Os10  1  0.33333300  0.66666700  0.84823046  1.0
  Os  Os11  1  0.66666700  0.33333300  0.15176954  1.0
  O  O12  1  0.53031590  0.46968410  0.25000000  1.0
  O  O13  1  0.53031590  0.06063080  0.25000000  1.0
  O  O14  1  0.93936920  0.46968410  0.25000000  1.0
  O  O15  1  0.46968410  0.53031590  0.75000000  1.0
  O  O16  1  0.46968410  0.93936920  0.75000000  1.0
  O  O17  1  0.06063080  0.53031590  0.75000000  1.0
  O  O18  1  0.35923327  0.17961713  0.40917481  1.0
  O  O19  1  0.82038287  0.17961713  0.40917481  1.0
  O  O20  1  0.82038287  0.64076673  0.40917481  1.0
  O  O21  1  0.64076673  0.82038287  0.59082519  1.0
  O  O22  1  0.17961713  0.82038287  0.59082519  1.0
  O  O23  1  0.17961713  0.35923327  0.59082519  1.0
  O  O24  1  0.64076673  0.82038287  0.90917481  1.0
  O  O25  1  0.17961713  0.82038287  0.90917481  1.0
  O  O26  1  0.17961713  0.35923327  0.90917481  1.0
  O  O27  1  0.35923327  0.17961713  0.09082519  1.0
  O  O28  1  0.82038287  0.17961713  0.09082519  1.0
  O  O29  1  0.82038287  0.64076673  0.09082519  1.0