MMs02585533 MOE2007 2D CORINA 3.40 0006 02.08.2006 30 32 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 0.7557 1.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0113 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4887 2.6046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2443 1.3088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 0.0065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7443 1.3154 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6313 0.1057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1740 -1.3229 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0558 0.5755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2732 -0.3009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6408 0.3152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8582 -0.5612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2258 0.0549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3761 1.5473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1587 2.4237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7911 1.8076 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0493 2.0754 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.6207 2.5327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1509 3.9573 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2330 3.9069 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.5955 -1.0418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9556 1.2905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6159 3.6347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1045 -1.0301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1529 -1.4949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7379 -1.7552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1997 -0.6462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4702 2.0402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2790 3.6177 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 19 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 26 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 27 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 15 16 2 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 M END