# generated using pymatgen
data_Ca2AlCoO5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.27262149
_cell_length_b   5.57470020
_cell_length_c   8.32648612
_cell_angle_alpha   109.68662472
_cell_angle_beta   108.81019652
_cell_angle_gamma   88.97685293
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca2AlCoO5
_chemical_formula_sum   'Ca4 Al2 Co2 O10'
_cell_volume   216.99609625
_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  0.11794600  0.64410200  0.22068600  1.0
  Ca  Ca1  1  0.40254600  0.92234800  0.77918000  1.0
  Ca  Ca2  1  0.89802300  0.36050200  0.78062300  1.0
  Ca  Ca3  1  0.62069800  0.07958500  0.22034000  1.0
  Al  Al4  1  0.29474100  0.32800400  0.50360000  1.0
  Al  Al5  1  0.78953600  0.67529600  0.49715400  1.0
  Co  Co6  1  0.49755800  0.50143400  0.99957200  1.0
  Co  Co7  1  0.99845600  0.00148200  0.99941400  1.0
  O  O8  1  0.62901000  0.39325300  0.49977000  1.0
  O  O9  1  0.12945300  0.61275200  0.50123300  1.0
  O  O10  1  0.61797000  0.70810500  0.28666400  1.0
  O  O11  1  0.33180900  0.29598800  0.71375100  1.0
  O  O12  1  0.11829500  0.07796300  0.30389300  1.0
  O  O13  1  0.81304100  0.92732100  0.69743900  1.0
  O  O14  1  0.24191000  0.73839600  0.97436100  1.0
  O  O15  1  0.25636900  0.25245400  0.02783400  1.0
  O  O16  1  0.75892400  0.27234200  0.02579700  1.0
  O  O17  1  0.74556500  0.74382800  0.97235800  1.0