TITL SHELXL INS file, from DIRDIF output for EG1SCR CELL 0.71073 13.38600 7.42300 15.13400 90.0000 107.7100 90.0000 ZERR 4 0.00200 0.00200 0.00100 0.0010 0.0500 0.0500 LATT 7 SYMM -X , Y , 1/2-Z SFAC CS O SI TI UNIT 8 60 24 4 L.S. 4 BOND FMAP 2 PLAN 10 FVAR 0.33688 CS1 1 0.11742 0.24082 0.40874 11.00000 0.02554 TI1 4 0.25000 0.25000 0.00000 11.00000 0.02554 SI3 3 -0.00159 0.23204 -0.14521 11.00000 0.01915 SI4 3 0.32507 0.43041 -0.17053 11.00000 0.01915 SI5 3 0.34397 0.03826 -0.14276 11.00000 0.01915 O6 2 0.38231 0.23392 -0.17581 11.00000 0.01915 O7 2 0.30131 0.05257 -0.05820 11.00000 0.01915 O8 2 0.10809 0.19559 -0.07492 11.00000 0.01915 O9 2 0.25250 -0.03613 -0.22988 11.00000 0.01915 O10 2 0.00000 0.26348 -0.25000 11.00000 0.01915 O11 2 0.23947 0.07478 0.09150 11.00000 0.01915 O12 2 0.42304 0.54841 -0.15646 11.00000 0.01915 O13 2 0.44798 -0.07915 -0.12709 11.00000 0.01915 O14 2 0.34989 0.22658 -0.24012 11.00000 0.01915 HKLF 4 END