# generated using pymatgen data_Mg2Ti7O15 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.00079127 _cell_length_b 5.21596487 _cell_length_c 10.62031626 _cell_angle_alpha 83.86061436 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg2Ti7O15 _chemical_formula_sum 'Mg4 Ti14 O30' _cell_volume 550.81844467 _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 Mg Mg0 1 0.75000000 0.49110090 0.89812867 1.0 Mg Mg1 1 0.25000000 0.50889910 0.10187133 1.0 Mg Mg2 1 0.25000000 0.17500045 0.43505666 1.0 Mg Mg3 1 0.75000000 0.82499955 0.56494334 1.0 Ti Ti4 1 0.06186247 0.39303913 0.87993992 1.0 Ti Ti5 1 0.43813753 0.39303913 0.87993992 1.0 Ti Ti6 1 0.56186247 0.60696087 0.12006008 1.0 Ti Ti7 1 0.93813753 0.60696087 0.12006008 1.0 Ti Ti8 1 0.56293621 0.27491645 0.45671954 1.0 Ti Ti9 1 0.93706379 0.27491645 0.45671954 1.0 Ti Ti10 1 0.06853282 0.06043704 0.21290099 1.0 Ti Ti11 1 0.43146718 0.06043704 0.21290099 1.0 Ti Ti12 1 0.06293621 0.72508355 0.54328046 1.0 Ti Ti13 1 0.43706379 0.72508355 0.54328046 1.0 Ti Ti14 1 0.75000000 0.15816058 0.23112913 1.0 Ti Ti15 1 0.25000000 0.84183942 0.76887087 1.0 Ti Ti16 1 0.93146718 0.93956296 0.78709901 1.0 Ti Ti17 1 0.56853282 0.93956296 0.78709901 1.0 O O18 1 0.88779353 0.24194787 0.84825826 1.0 O O19 1 0.61220647 0.24194787 0.84825826 1.0 O O20 1 0.43530471 0.31397411 0.06278656 1.0 O O21 1 0.06469529 0.31397411 0.06278656 1.0 O O22 1 0.25000000 0.20411189 0.24068196 1.0 O O23 1 0.25000000 0.54134625 0.90381686 1.0 O O24 1 0.75000000 0.45865375 0.09618314 1.0 O O25 1 0.93530471 0.68602589 0.93721344 1.0 O O26 1 0.56736302 0.35016647 0.27088070 1.0 O O27 1 0.93263698 0.35016647 0.27088070 1.0 O O28 1 0.56469529 0.68602589 0.93721344 1.0 O O29 1 0.38779353 0.75805213 0.15174174 1.0 O O30 1 0.38632882 0.42425514 0.48407554 1.0 O O31 1 0.11220647 0.75805213 0.15174174 1.0 O O32 1 0.11367118 0.42425514 0.48407554 1.0 O O33 1 0.88194546 0.91389277 0.18260888 1.0 O O34 1 0.61805454 0.91389277 0.18260888 1.0 O O35 1 0.61367118 0.57574486 0.51592446 1.0 O O36 1 0.88632882 0.57574486 0.51592446 1.0 O O37 1 0.06586295 0.97762709 0.39652875 1.0 O O38 1 0.43263698 0.64983353 0.72911930 1.0 O O39 1 0.43413705 0.97762709 0.39652875 1.0 O O40 1 0.06736302 0.64983353 0.72911930 1.0 O O41 1 0.25000000 0.87077488 0.57954292 1.0 O O42 1 0.75000000 0.12922512 0.42045708 1.0 O O43 1 0.75000000 0.79588811 0.75931804 1.0 O O44 1 0.93413705 0.02237291 0.60347125 1.0 O O45 1 0.56586295 0.02237291 0.60347125 1.0 O O46 1 0.38194546 0.08610723 0.81739112 1.0 O O47 1 0.11805454 0.08610723 0.81739112 1.0