MMs00211797 MOE2007 2D CORINA 3.40 0006 02.08.2006 34 35 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 -0.0095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2582 1.2847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5164 2.5885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0165 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7417 1.3038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2417 1.3133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 0.0190 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0285 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4904 1.5285 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5094 -1.4714 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 0.0380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7416 1.3418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2416 1.3513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9998 0.0571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2581 -1.2467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7581 -1.2562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4998 0.0666 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -3.7582 1.2752 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7487 -0.2247 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7677 2.7752 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2581 1.2657 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0 -5.8647 2.3011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6066 -1.0354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0934 -1.0525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1230 3.6239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5769 3.6410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0259 2.4937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3667 1.7308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4065 -1.0240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1351 2.3772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8350 2.3943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8646 -2.2821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1647 -2.2992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 34 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 M CHG 1 22 -1 M END