# generated using pymatgen
data_CoBrO
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.81800700
_cell_length_b   6.39970288
_cell_length_c   12.65192500
_cell_angle_alpha   90.10101681
_cell_angle_beta   90.71466217
_cell_angle_gamma   90.03002796
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoBrO
_chemical_formula_sum   'Co8 Br8 O8'
_cell_volume   471.03820664
_cell_formula_units_Z   8
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
  Co  Co0  1  0.21082700  0.63152300  0.99600400  1.0
  Co  Co1  1  0.72367600  0.38067100  0.50454600  1.0
  Co  Co2  1  0.78946200  0.86786300  0.49892600  1.0
  Co  Co3  1  0.28821400  0.13113100  0.00414300  1.0
  Co  Co4  1  0.78911700  0.36877300  0.00387500  1.0
  Co  Co5  1  0.29078300  0.63180300  0.49374700  1.0
  Co  Co6  1  0.21495600  0.13234300  0.50103800  1.0
  Co  Co7  1  0.71172000  0.86902800  0.99556600  1.0
  Br  Br8  1  0.93085900  0.58299900  0.35957800  1.0
  Br  Br9  1  0.43398400  0.41120100  0.14223200  1.0
  Br  Br10  1  0.06466000  0.90946100  0.85826300  1.0
  Br  Br11  1  0.56009900  0.08478700  0.64239400  1.0
  Br  Br12  1  0.05837700  0.41266900  0.63906400  1.0
  Br  Br13  1  0.56550500  0.58886000  0.85774700  1.0
  Br  Br14  1  0.93487800  0.09053500  0.14185700  1.0
  Br  Br15  1  0.42968000  0.90796500  0.35657900  1.0
  O  O16  1  0.88941900  0.64218200  0.04884300  1.0
  O  O17  1  0.40080700  0.35711100  0.45317300  1.0
  O  O18  1  0.11400800  0.85900000  0.54585500  1.0
  O  O19  1  0.60986400  0.14157100  0.95133500  1.0
  O  O20  1  0.11040900  0.35795300  0.95115300  1.0
  O  O21  1  0.60770200  0.64248900  0.54944500  1.0
  O  O22  1  0.88098200  0.13957700  0.45593200  1.0
  O  O23  1  0.39001400  0.85850100  0.04870000  1.0