# CIF generated by HEAS from Alexandria entry agm017285894 data_agm017285894 _cell_length_a 6.79155 _cell_length_b 9.52331 _cell_length_c 10.11550 _cell_angle_alpha 118.08646 _cell_angle_beta 109.60605 _cell_angle_gamma 90.00224 _cell_volume 533.82115 _symmetry_space_group_name_H-M 'P 1' _symmetry_Int_Tables_number 1 loop_ _symmetry_equiv_pos_as_xyz 'x, y, z' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy K1 K 0.37518 0.74943 0.75039 1.00000 Ti1 Ti 0.11834 0.10364 0.23668 1.00000 Ti2 Ti 0.61916 0.10599 0.23834 1.00000 Ti3 Ti 0.30871 0.26236 0.61730 1.00000 Ti4 Ti 0.80858 0.26276 0.61701 1.00000 Ti5 Ti 0.19700 0.88266 0.39423 1.00000 Ti6 Ti 0.69823 0.88352 0.39663 1.00000 Ti7 Ti 0.38201 0.39359 0.26104 1.00000 Ti8 Ti 0.87903 0.39360 0.26105 1.00000 Ti9 Ti 0.19030 0.23887 0.88258 1.00000 Ti10 Ti 0.69217 0.23887 0.88259 1.00000 Ti11 Ti 0.30184 0.61718 0.10618 1.00000 Ti12 Ti 0.80453 0.61718 0.10618 1.00000 S1 S 0.54149 0.41673 0.08295 1.00000 S2 S 0.04186 0.41638 0.08371 1.00000 S3 S 0.95828 0.08349 0.41664 1.00000 S4 S 0.45834 0.08348 0.41664 1.00000 S5 S 0.72154 0.39316 0.44319 1.00000 S6 S 0.22041 0.39037 0.44094 1.00000 S7 S 0.85007 0.05766 0.69997 1.00000 S8 S 0.34973 0.05836 0.69930 1.00000 S9 S 0.55507 0.80080 0.11015 1.00000 S10 S 0.05350 0.79981 0.10703 1.00000 S11 S 0.77772 0.10594 0.05553 1.00000 S12 S 0.27790 0.10594 0.05552 1.00000 S13 S 0.65041 0.44438 0.80040 1.00000 S14 S 0.14984 0.44440 0.80040 1.00000 S15 S 0.94684 0.69970 0.39372 1.00000 S16 S 0.44690 0.69971 0.39372 1.00000