# generated using pymatgen data_Ba2ZnCuSn2F14 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.46625100 _cell_length_b 7.84296876 _cell_length_c 15.52183822 _cell_angle_alpha 90.08628000 _cell_angle_beta 91.50375033 _cell_angle_gamma 109.50953445 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba2ZnCuSn2F14 _chemical_formula_sum 'Ba4 Zn2 Cu2 Sn4 F28' _cell_volume 626.98733828 _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 Ba Ba0 1 0.08507700 0.34974400 0.61605500 1.0 Ba Ba1 1 0.26575300 0.34948800 0.13235900 1.0 Ba Ba2 1 0.89623400 0.62815500 0.37132400 1.0 Ba Ba3 1 0.73734500 0.64608700 0.87642700 1.0 Zn Zn4 1 0.47104700 0.00221100 0.75128500 1.0 Zn Zn5 1 0.52184500 0.01061300 0.25803800 1.0 Cu Cu6 1 0.50745900 0.00133900 0.00313300 1.0 Cu Cu7 1 0.50054300 0.01416000 0.49659800 1.0 Sn Sn8 1 0.10609100 0.24683100 0.87495100 1.0 Sn Sn9 1 0.14974600 0.23091800 0.37814700 1.0 Sn Sn10 1 0.90431800 0.75592600 0.12264800 1.0 Sn Sn11 1 0.85648000 0.75934000 0.62669800 1.0 F F12 1 0.79818800 0.94626100 0.31271200 1.0 F F13 1 0.86069700 0.31948800 0.46234000 1.0 F F14 1 0.11581000 0.69913600 0.55191300 1.0 F F15 1 0.62200000 0.50403400 0.60357300 1.0 F F16 1 0.63159800 0.07458300 0.63949400 1.0 F F17 1 0.54724200 0.92301100 0.86945900 1.0 F F18 1 0.43280200 0.30795800 0.95288500 1.0 F F19 1 0.91918200 0.00701100 0.14633200 1.0 F F20 1 0.35585000 0.34733300 0.77748300 1.0 F F21 1 0.38174100 0.51870000 0.40263800 1.0 F F22 1 0.81151100 0.23893900 0.78947700 1.0 F F23 1 0.13420400 0.50881100 0.89797700 1.0 F F24 1 0.47164300 0.24833900 0.27013700 1.0 F F25 1 0.18713100 0.76797200 0.21129500 1.0 F F26 1 0.45911100 0.06591900 0.12586200 1.0 F F27 1 0.64242000 0.64094200 0.21247700 1.0 F F28 1 0.09421300 0.82757000 0.01068900 1.0 F F29 1 0.11591700 0.99548300 0.67210900 1.0 F F30 1 0.89982700 0.16778000 0.98247700 1.0 F F31 1 0.72918500 0.84865000 0.51810800 1.0 F F32 1 0.58153600 0.70021100 0.04226200 1.0 F F33 1 0.58639300 0.76450000 0.71639500 1.0 F F34 1 0.00908100 0.37313300 0.26886600 1.0 F F35 1 0.28190000 0.16657500 0.52105300 1.0 F F36 1 0.33312500 0.92349300 0.37448200 1.0 F F37 1 0.11579200 0.99886300 0.83980200 1.0 F F38 1 0.00811200 0.65019700 0.72609600 1.0 F F39 1 0.88491900 0.50127800 0.09263200 1.0