# generated using pymatgen data_Cs3V2Cl9 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.31198878 _cell_length_b 7.31200380 _cell_length_c 18.05425258 _cell_angle_alpha 89.99883056 _cell_angle_beta 90.00041805 _cell_angle_gamma 119.99927920 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cs3V2Cl9 _chemical_formula_sum 'Cs6 V4 Cl18' _cell_volume 835.95947459 _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 Cs Cs0 1 0.00009920 0.00003530 0.24999737 1.0 Cs Cs1 1 0.99999764 0.00000670 0.75000157 1.0 Cs Cs2 1 0.33331568 0.66665682 0.42162680 1.0 Cs Cs3 1 0.66665982 0.33333098 0.57840418 1.0 Cs Cs4 1 0.66665912 0.33333024 0.92159388 1.0 Cs Cs5 1 0.33332346 0.66666318 0.07837450 1.0 V V6 1 0.33332518 0.66666658 0.65837380 1.0 V V7 1 0.66666544 0.33332964 0.34166261 1.0 V V8 1 0.66667144 0.33333505 0.15833859 1.0 V V9 1 0.33332872 0.66666613 0.84162193 1.0 Cl Cl10 1 0.51800591 0.48199936 0.25000337 1.0 Cl Cl11 1 0.51801547 0.03600131 0.24999836 1.0 Cl Cl12 1 0.96398503 0.48199550 0.25000372 1.0 Cl Cl13 1 0.48208986 0.51787587 0.74999825 1.0 Cl Cl14 1 0.48210119 0.96421778 0.74999975 1.0 Cl Cl15 1 0.03576706 0.51789226 0.74999918 1.0 Cl Cl16 1 0.82256033 0.17745263 0.40759657 1.0 Cl Cl17 1 0.82253468 0.64509269 0.40759837 1.0 Cl Cl18 1 0.35489680 0.17744508 0.40759504 1.0 Cl Cl19 1 0.17741969 0.82261327 0.59242524 1.0 Cl Cl20 1 0.17739508 0.35482034 0.59242492 1.0 Cl Cl21 1 0.64517885 0.82256781 0.59243102 1.0 Cl Cl22 1 0.17740710 0.82258881 0.90757621 1.0 Cl Cl23 1 0.17739832 0.35481506 0.90757443 1.0 Cl Cl24 1 0.64517569 0.82258585 0.90756861 1.0 Cl Cl25 1 0.82256519 0.17746493 0.09240317 1.0 Cl Cl26 1 0.82255247 0.64510161 0.09240298 1.0 Cl Cl27 1 0.35490758 0.17745022 0.09240559 1.0