# generated using pymatgen
data_CaV4Co(CuO6)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.42315265
_cell_length_b   6.42315265
_cell_length_c   6.42315265
_cell_angle_alpha   109.99786582
_cell_angle_beta   109.29555929
_cell_angle_gamma   109.12156989
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaV4Co(CuO6)2
_chemical_formula_sum   'Ca1 V4 Co1 Cu2 O12'
_cell_volume   203.98315229
_cell_formula_units_Z   1
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  0.00000000  0.00000000  0.00000000  1.0
  V  V1  1  0.00000000  0.50000000  0.00000000  1.0
  V  V2  1  0.50000000  0.00000000  0.00000000  1.0
  V  V3  1  0.00000000  0.00000000  0.50000000  1.0
  V  V4  1  0.50000000  0.50000000  0.50000000  1.0
  Co  Co5  1  0.50000000  0.00000000  0.50000000  1.0
  Cu  Cu6  1  0.50000000  0.50000000  0.00000000  1.0
  Cu  Cu7  1  0.00000000  0.50000000  0.50000000  1.0
  O  O8  1  0.17987700  0.30220600  0.48208300  1.0
  O  O9  1  0.82012300  0.69779400  0.51791700  1.0
  O  O10  1  0.82012300  0.30220600  0.12233000  1.0
  O  O11  1  0.17987700  0.69779400  0.87767000  1.0
  O  O12  1  0.47632300  0.18021000  0.29611300  1.0
  O  O13  1  0.52367700  0.81979000  0.70388700  1.0
  O  O14  1  0.11590300  0.81979000  0.29611300  1.0
  O  O15  1  0.88409700  0.18021000  0.70388700  1.0
  O  O16  1  0.30484100  0.48594300  0.18110200  1.0
  O  O17  1  0.69515900  0.51405700  0.81889800  1.0
  O  O18  1  0.30484100  0.12374000  0.81889800  1.0
  O  O19  1  0.69515900  0.87626000  0.18110200  1.0