# generated using pymatgen
data_Ca2AlCoO5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.30127968
_cell_length_b   8.30127968
_cell_length_c   5.58986313
_cell_angle_alpha   70.56233689
_cell_angle_beta   70.56233689
_cell_angle_gamma   36.90551796
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca2AlCoO5
_chemical_formula_sum   'Ca4 Al2 Co2 O10'
_cell_volume   216.61267194
_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  0.88251200  0.89767500  0.64424800  1.0
  Ca  Ca1  1  0.59883800  0.62114900  0.91968400  1.0
  Ca  Ca2  1  0.10232500  0.11748800  0.35575200  1.0
  Ca  Ca3  1  0.37885100  0.40116200  0.08031600  1.0
  Al  Al4  1  0.70691400  0.79099000  0.32618600  1.0
  Al  Al5  1  0.20901000  0.29308600  0.67381400  1.0
  Co  Co6  1  0.50268800  0.49731200  0.50000000  1.0
  Co  Co7  1  0.00158000  0.99842000  0.00000000  1.0
  O  O8  1  0.37032500  0.12957600  0.39055000  1.0
  O  O9  1  0.87042400  0.62967500  0.60945000  1.0
  O  O10  1  0.38302400  0.32800100  0.71023900  1.0
  O  O11  1  0.67199900  0.61697600  0.28976100  1.0
  O  O12  1  0.88228100  0.81744300  0.07699400  1.0
  O  O13  1  0.18255700  0.11771900  0.92300600  1.0
  O  O14  1  0.76207300  0.26505600  0.74370300  1.0
  O  O15  1  0.73494400  0.23792700  0.25629700  1.0
  O  O16  1  0.23613400  0.73657500  0.26421300  1.0
  O  O17  1  0.26342500  0.76386600  0.73578700  1.0