# generated using pymatgen
data_Sr2Ca2Co3CuO12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.71952900
_cell_length_b   7.67687100
_cell_length_c   7.68443577
_cell_angle_alpha   89.75584242
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr2Ca2Co3CuO12
_chemical_formula_sum   'Sr4 Ca4 Co6 Cu2 O24'
_cell_volume   455.38957859
_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
  Sr  Sr0  1  0.00000000  0.24953900  0.75080100  1.0
  Sr  Sr1  1  0.50000000  0.24946300  0.75052200  1.0
  Sr  Sr2  1  0.50000000  0.24962500  0.24962100  1.0
  Sr  Sr3  1  0.00000000  0.75079700  0.24899900  1.0
  Ca  Ca4  1  0.00000000  0.75145600  0.75146900  1.0
  Ca  Ca5  1  0.50000000  0.75128300  0.75218400  1.0
  Ca  Ca6  1  0.00000000  0.24894700  0.24850700  1.0
  Ca  Ca7  1  0.50000000  0.75142800  0.24766800  1.0
  Co  Co8  1  0.24994000  0.50228600  0.00005500  1.0
  Co  Co9  1  0.75006000  0.50228600  0.00005500  1.0
  Co  Co10  1  0.25000100  0.99844300  0.49987500  1.0
  Co  Co11  1  0.74999900  0.99844300  0.49987500  1.0
  Co  Co12  1  0.24986700  0.50150800  0.49992000  1.0
  Co  Co13  1  0.75013300  0.50150800  0.49992000  1.0
  Cu  Cu14  1  0.25000100  0.00009900  0.00004800  1.0
  Cu  Cu15  1  0.74999900  0.00009900  0.00004800  1.0
  O  O16  1  0.24989200  0.99219500  0.74414600  1.0
  O  O17  1  0.75010800  0.99219500  0.74414600  1.0
  O  O18  1  0.25017200  0.50695800  0.74730800  1.0
  O  O19  1  0.74982800  0.50695800  0.74730800  1.0
  O  O20  1  0.25024500  0.99847600  0.25588700  1.0
  O  O21  1  0.74975500  0.99847600  0.25588700  1.0
  O  O22  1  0.25028300  0.50260100  0.25283000  1.0
  O  O23  1  0.74971700  0.50260100  0.25283000  1.0
  O  O24  1  0.24686500  0.25677900  0.00342300  1.0
  O  O25  1  0.75313500  0.25677900  0.00342300  1.0
  O  O26  1  0.25257600  0.74489800  0.99705400  1.0
  O  O27  1  0.74742400  0.74489800  0.99705400  1.0
  O  O28  1  0.24755400  0.25274000  0.49749700  1.0
  O  O29  1  0.75244600  0.25274000  0.49749700  1.0
  O  O30  1  0.25203400  0.74713300  0.50207000  1.0
  O  O31  1  0.74796600  0.74713300  0.50207000  1.0
  O  O32  1  0.00000000  0.99731300  0.99963000  1.0
  O  O33  1  0.50000000  0.98686000  0.00033000  1.0
  O  O34  1  0.00000000  0.50298700  0.99957200  1.0
  O  O35  1  0.50000000  0.50634100  0.99999500  1.0
  O  O36  1  0.00000000  0.99777100  0.50024500  1.0
  O  O37  1  0.50000000  0.99045800  0.50001500  1.0
  O  O38  1  0.00000000  0.50293200  0.50042400  1.0
  O  O39  1  0.50000000  0.50456800  0.49979200  1.0