# generated using pymatgen
data_Ba2Co4ClO7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   15.69417874
_cell_length_b   15.69417874
_cell_length_c   15.69417905
_cell_angle_alpha   21.08517912
_cell_angle_beta   21.08517912
_cell_angle_gamma   21.08518139
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2Co4ClO7
_chemical_formula_sum   'Ba4 Co8 Cl2 O14'
_cell_volume   438.16073160
_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
  Ba  Ba0  1  0.56990600  0.56990600  0.56990600  1.0
  Ba  Ba1  1  0.43009400  0.43009400  0.43009400  1.0
  Ba  Ba2  1  0.28908100  0.28908100  0.28908100  1.0
  Ba  Ba3  1  0.71091900  0.71091900  0.71091900  1.0
  Co  Co4  1  0.21976300  0.21976300  0.21976300  1.0
  Co  Co5  1  0.89744900  0.89744900  0.89744900  1.0
  Co  Co6  1  0.78023700  0.78023700  0.78023700  1.0
  Co  Co7  1  0.50000000  0.50000000  0.50000000  1.0
  Co  Co8  1  0.10255100  0.10255100  0.10255100  1.0
  Co  Co9  1  0.00000000  0.00000000  0.50000000  1.0
  Co  Co10  1  0.00000000  0.50000000  0.00000000  1.0
  Co  Co11  1  0.50000000  0.00000000  0.00000000  1.0
  Cl  Cl12  1  0.63983400  0.63983400  0.63983400  1.0
  Cl  Cl13  1  0.36016600  0.36016600  0.36016600  1.0
  O  O14  1  0.55046400  0.09094000  0.09094000  1.0
  O  O15  1  0.34998000  0.34998000  0.86665500  1.0
  O  O16  1  0.13334500  0.65002000  0.65002000  1.0
  O  O17  1  0.90906000  0.90906000  0.44953600  1.0
  O  O18  1  0.09094000  0.09094000  0.55046400  1.0
  O  O19  1  0.09094000  0.55046400  0.09094000  1.0
  O  O20  1  0.34998000  0.86665500  0.34998000  1.0
  O  O21  1  0.85464300  0.85464300  0.85464300  1.0
  O  O22  1  0.65002000  0.65002000  0.13334500  1.0
  O  O23  1  0.44953600  0.90906000  0.90906000  1.0
  O  O24  1  0.86665500  0.34998000  0.34998000  1.0
  O  O25  1  0.65002000  0.13334500  0.65002000  1.0
  O  O26  1  0.90906000  0.44953600  0.90906000  1.0
  O  O27  1  0.14535700  0.14535700  0.14535700  1.0