# generated using pymatgen
data_Ca3Bi2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.50122407
_cell_length_b   10.50122407
_cell_length_c   6.06607389
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   147.81961467
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca3Bi2O7
_chemical_formula_sum   'Ca6 Bi4 O14'
_cell_volume   356.26876468
_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
  Ca  Ca0  1  0.22958495  0.22958495  0.30593455  1.0
  Ca  Ca1  1  0.77041505  0.77041505  0.80593455  1.0
  Ca  Ca2  1  0.04467959  0.43597081  0.18190128  1.0
  Ca  Ca3  1  0.95532041  0.56402919  0.68190128  1.0
  Ca  Ca4  1  0.43597081  0.04467959  0.18190128  1.0
  Ca  Ca5  1  0.56402919  0.95532041  0.68190128  1.0
  Bi  Bi6  1  0.84926051  0.64169809  0.24938229  1.0
  Bi  Bi7  1  0.15073949  0.35830191  0.74938229  1.0
  Bi  Bi8  1  0.35830191  0.15073949  0.74938229  1.0
  Bi  Bi9  1  0.64169809  0.84926051  0.24938229  1.0
  O  O10  1  0.66474694  0.07423128  0.30612827  1.0
  O  O11  1  0.33525306  0.92576872  0.80612827  1.0
  O  O12  1  0.92576872  0.33525306  0.80612827  1.0
  O  O13  1  0.07423128  0.66474694  0.30612827  1.0
  O  O14  1  0.42046192  0.69066920  0.95221658  1.0
  O  O15  1  0.57953808  0.30933080  0.45221658  1.0
  O  O16  1  0.30933080  0.57953808  0.45221658  1.0
  O  O17  1  0.69066920  0.42046192  0.95221658  1.0
  O  O18  1  0.98252479  0.13705540  0.05910990  1.0
  O  O19  1  0.01747521  0.86294460  0.55910990  1.0
  O  O20  1  0.61142779  0.61142779  0.17658580  1.0
  O  O21  1  0.38857221  0.38857221  0.67658580  1.0
  O  O22  1  0.13705540  0.98252479  0.05910990  1.0
  O  O23  1  0.86294460  0.01747521  0.55910990  1.0