# generated using pymatgen data_Ti20Ga7Se5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.69755161 _cell_length_b 7.87474523 _cell_length_c 9.84953140 _cell_angle_alpha 89.89736894 _cell_angle_beta 89.90651148 _cell_angle_gamma 89.98787980 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti20Ga7Se5 _chemical_formula_sum 'Ti20 Ga7 Se5' _cell_volume 519.47764785 _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 0.81649186 0.55814964 0.05946846 1.0 Ti Ti1 1 0.68229400 0.93975979 0.56314052 1.0 Ti Ti2 1 0.18460734 0.05960002 0.93752290 1.0 Ti Ti3 1 0.31609121 0.44180520 0.43963864 1.0 Ti Ti4 1 0.18258383 0.44332552 0.93682720 1.0 Ti Ti5 1 0.31568681 0.05786587 0.43882969 1.0 Ti Ti6 1 0.81532228 0.94251199 0.06112302 1.0 Ti Ti7 1 0.68153018 0.55740948 0.56399348 1.0 Ti Ti8 1 0.16915400 0.75075285 0.22485431 1.0 Ti Ti9 1 0.33232420 0.74515263 0.72319602 1.0 Ti Ti10 1 0.83015314 0.25199657 0.77658530 1.0 Ti Ti11 1 0.67000869 0.25023469 0.27467012 1.0 Ti Ti12 1 0.48517321 0.74883679 0.00521263 1.0 Ti Ti13 1 0.01176345 0.74987715 0.50318618 1.0 Ti Ti14 1 0.51551605 0.25213102 0.99704609 1.0 Ti Ti15 1 0.98517523 0.24894732 0.49663326 1.0 Ti Ti16 1 0.66608885 0.74892039 0.28554727 1.0 Ti Ti17 1 0.84146932 0.75229719 0.78646039 1.0 Ti Ti18 1 0.33053640 0.24928284 0.71085964 1.0 Ti Ti19 1 0.16588760 0.24897105 0.21450106 1.0 Ga Ga20 1 0.93709170 0.50561860 0.32526672 1.0 Ga Ga21 1 0.56196312 0.99324573 0.82615567 1.0 Ga Ga22 1 0.06291301 0.00586535 0.67419562 1.0 Ga Ga23 1 0.43556514 0.49341812 0.17669409 1.0 Ga Ga24 1 0.06361393 0.49350790 0.67231486 1.0 Ga Ga25 1 0.43750297 0.00658953 0.17380122 1.0 Ga Ga26 1 0.93641226 0.99370592 0.32554893 1.0 Se Se27 1 0.39598189 0.74976075 0.46782129 1.0 Se Se28 1 0.10283758 0.75172249 0.97157460 1.0 Se Se29 1 0.60194371 0.24825361 0.52889115 1.0 Se Se30 1 0.89963550 0.25000075 0.03140272 1.0 Se Se31 1 0.56668155 0.51048425 0.82703998 1.0