# generated using pymatgen
data_Ba4CaTl4(Cu3O10)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.72437500
_cell_length_b   7.45841602
_cell_length_c   19.58229510
_cell_angle_alpha   95.29315034
_cell_angle_beta   94.26235701
_cell_angle_gamma   89.99629726
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba4CaTl4(Cu3O10)2
_chemical_formula_sum   'Ba4 Ca1 Tl4 Cu6 O20'
_cell_volume   540.12550606
_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
  Ba  Ba0  1  0.83246400  0.95014300  0.71730800  1.0
  Ba  Ba1  1  0.83271700  0.45003800  0.72013700  1.0
  Ba  Ba2  1  0.17441400  0.60054200  0.28069900  1.0
  Ba  Ba3  1  0.17416900  0.10038300  0.28026300  1.0
  Ca  Ca4  1  0.93060300  0.51015500  0.91554400  1.0
  Tl  Tl5  1  0.27600500  0.66408000  0.56263400  1.0
  Tl  Tl6  1  0.27597100  0.16536900  0.56251500  1.0
  Tl  Tl7  1  0.73096200  0.88529400  0.43865700  1.0
  Tl  Tl8  1  0.73094200  0.38529300  0.43859600  1.0
  Cu  Cu9  1  0.62807300  0.82490700  0.16046100  1.0
  Cu  Cu10  1  0.62838500  0.32553800  0.16055600  1.0
  Cu  Cu11  1  0.38150300  0.74661200  0.83413400  1.0
  Cu  Cu12  1  0.38252800  0.21775000  0.83598200  1.0
  Cu  Cu13  1  0.47980800  0.80215100  0.00842200  1.0
  Cu  Cu14  1  0.47985600  0.28725400  0.01070300  1.0
  O  O15  1  0.13677800  0.82949700  0.18415500  1.0
  O  O16  1  0.13711500  0.32949500  0.18428900  1.0
  O  O17  1  0.69602800  0.85940800  0.33412500  1.0
  O  O18  1  0.69606300  0.35900400  0.33415700  1.0
  O  O19  1  0.63252400  0.57966100  0.17893600  1.0
  O  O20  1  0.63181000  0.07930500  0.17823700  1.0
  O  O21  1  0.23692400  0.60340900  0.45522200  1.0
  O  O22  1  0.23693100  0.10289700  0.45525600  1.0
  O  O23  1  0.46352900  0.53880100  0.98676000  1.0
  O  O24  1  0.46118200  0.03993100  0.98873900  1.0
  O  O25  1  0.36839300  0.97696600  0.80914500  1.0
  O  O26  1  0.37961100  0.48095600  0.82774100  1.0
  O  O27  1  0.31145900  0.68231900  0.66761400  1.0
  O  O28  1  0.31153200  0.18695000  0.66749100  1.0
  O  O29  1  0.87781400  0.71231400  0.82433800  1.0
  O  O30  1  0.87875700  0.24951300  0.82699500  1.0
  O  O31  1  0.76986400  0.87446900  0.54653500  1.0
  O  O32  1  0.76973400  0.37448200  0.54624800  1.0
  O  O33  1  0.97516000  0.77969000  0.99984400  1.0
  O  O34  1  0.97545300  0.30210300  0.00223300  1.0