# generated using pymatgen
data_Ca2Cu9O13
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.18558143
_cell_length_b   5.18558143
_cell_length_c   16.39812937
_cell_angle_alpha   81.88936245
_cell_angle_beta   81.88936245
_cell_angle_gamma   34.51711199
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca2Cu9O13
_chemical_formula_sum   'Ca2 Cu9 O13'
_cell_volume   247.12343827
_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  0.78390400  0.78390400  0.22850900  1.0
  Ca  Ca1  1  0.21609600  0.21609600  0.77149100  1.0
  Cu  Cu2  1  0.50000000  0.50000000  0.50000000  1.0
  Cu  Cu3  1  0.35338200  0.35338200  0.03792500  1.0
  Cu  Cu4  1  0.64661800  0.64661800  0.96207500  1.0
  Cu  Cu5  1  0.24852600  0.24852600  0.42141700  1.0
  Cu  Cu6  1  0.75147400  0.75147400  0.57858300  1.0
  Cu  Cu7  1  0.06257900  0.06257900  0.11950400  1.0
  Cu  Cu8  1  0.93742100  0.93742100  0.88049600  1.0
  Cu  Cu9  1  0.00433800  0.00433800  0.33695700  1.0
  Cu  Cu10  1  0.99566200  0.99566200  0.66304300  1.0
  O  O11  1  0.00000000  0.00000000  0.00000000  1.0
  O  O12  1  0.11654600  0.11654600  0.22686700  1.0
  O  O13  1  0.88345400  0.88345400  0.77313300  1.0
  O  O14  1  0.70096000  0.70096000  0.07140700  1.0
  O  O15  1  0.29904000  0.29904000  0.92859300  1.0
  O  O16  1  0.42246700  0.42246700  0.13840900  1.0
  O  O17  1  0.57753300  0.57753300  0.86159100  1.0
  O  O18  1  0.37316600  0.37316600  0.32270300  1.0
  O  O19  1  0.62683400  0.62683400  0.67729700  1.0
  O  O20  1  0.60857100  0.60857100  0.38835400  1.0
  O  O21  1  0.39142900  0.39142900  0.61164600  1.0
  O  O22  1  0.86734800  0.86734800  0.47140700  1.0
  O  O23  1  0.13265200  0.13265200  0.52859300  1.0