# generated using pymatgen data_Ti11H7O24 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.01129400 _cell_length_b 9.81478600 _cell_length_c 14.75625232 _cell_angle_alpha 89.54400530 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti11H7O24 _chemical_formula_sum 'Ti11 H7 O24' _cell_volume 436.11026822 _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 Ti Ti0 1 0.00000000 0.85634500 0.66044400 1.0 Ti Ti1 1 0.00000000 0.85345600 0.98284700 1.0 Ti Ti2 1 0.50000000 0.65768200 0.16305200 1.0 Ti Ti3 1 0.50000000 0.66322200 0.48520900 1.0 Ti Ti4 1 0.50000000 0.63418000 0.82088500 1.0 Ti Ti5 1 0.00000000 0.34328400 0.17896100 1.0 Ti Ti6 1 0.00000000 0.36516600 0.50393100 1.0 Ti Ti7 1 0.00000000 0.36899400 0.84261600 1.0 Ti Ti8 1 0.50000000 0.14806400 0.67851800 1.0 Ti Ti9 1 0.50000000 0.14103700 0.00342400 1.0 Ti Ti10 1 0.50000000 0.12362100 0.34236100 1.0 H H11 1 0.00000000 0.00760300 0.14048900 1.0 H H12 1 0.00000000 0.93745900 0.41418400 1.0 H H13 1 0.50000000 0.47119400 0.30377800 1.0 H H14 1 0.50000000 0.46411300 0.64236700 1.0 H H15 1 0.00000000 0.52085700 0.03208300 1.0 H H16 1 0.50000000 0.03091400 0.18779500 1.0 H H17 1 0.50000000 0.97273200 0.52634700 1.0 O O18 1 0.50000000 0.96590600 0.93781300 1.0 O O19 1 0.50000000 0.99786500 0.25014900 1.0 O O20 1 0.50000000 0.96866100 0.59291000 1.0 O O21 1 0.50000000 0.77364700 0.05974400 1.0 O O22 1 0.50000000 0.78383500 0.73168500 1.0 O O23 1 0.50000000 0.80390400 0.41913200 1.0 O O24 1 0.00000000 0.71568500 0.22109700 1.0 O O25 1 0.00000000 0.72613400 0.57081600 1.0 O O26 1 0.00000000 0.71712000 0.89516400 1.0 O O27 1 0.00000000 0.54202100 0.43950700 1.0 O O28 1 0.00000000 0.52718700 0.09850800 1.0 O O29 1 0.00000000 0.53573000 0.76260800 1.0 O O30 1 0.50000000 0.46716800 0.23729500 1.0 O O31 1 0.50000000 0.46270300 0.90152900 1.0 O O32 1 0.50000000 0.46354500 0.57596800 1.0 O O33 1 0.50000000 0.26433900 0.11040800 1.0 O O34 1 0.50000000 0.29027600 0.44119300 1.0 O O35 1 0.50000000 0.28062500 0.77108500 1.0 O O36 1 0.00000000 0.23350400 0.28271500 1.0 O O37 1 0.00000000 0.22509700 0.94072800 1.0 O O38 1 0.00000000 0.23131400 0.60525900 1.0 O O39 1 0.00000000 0.04206100 0.72601400 1.0 O O40 1 0.00000000 0.02810300 0.07532500 1.0 O O41 1 0.00000000 0.03937400 0.41492700 1.0