MMs00345910 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 40 0 0 0 0 0 0 0 0999 V2000 0.0000 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.0041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2536 -1.2928 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7536 -1.2887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 0.0166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7536 -1.2804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0072 -2.5815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5072 -2.5856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7607 -3.8867 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 8.2536 -1.2763 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.2494 0.2237 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2577 -2.7762 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7535 -1.2721 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5071 -2.5691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0071 -2.5649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7535 -1.2638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0000 0.0331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5000 0.0290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2535 -1.2597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9999 0.0414 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0033 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0033 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0033 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2884 1.1853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6265 0.4177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8971 1.0500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5971 1.0575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6100 -3.6191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3806 -2.9826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7188 -3.7503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8020 -3.7473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1359 -2.9722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3535 -2.3031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1264 0.4467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7883 1.2143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3712 0.4363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7051 1.2113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0071 -2.5566 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 M CHG 1 39 -1 M END