MMs00858859 MOE2007 2D CORINA 3.40 0006 02.08.2006 31 33 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 -1.3051 -0.7394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3173 -2.2394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0244 -2.9999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2807 -2.2605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2929 -0.7605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0211 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0365 -4.4999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2564 -5.2604 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6224 -2.9788 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9153 -2.2183 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.6758 -3.5112 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1547 -0.9254 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2082 -1.4578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1960 0.0422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4889 0.8027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7940 0.0633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8062 -1.4367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5132 -2.1972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8370 -3.6618 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.3300 -3.8065 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.9290 -2.4313 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0869 0.8238 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.0097 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3394 -0.1310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3150 -2.8689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6321 -4.1788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1519 0.6337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4791 2.0027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3416 -5.2393 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3514 -6.4392 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 10 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 10 11 1 0 0 0 0 10 27 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 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 16 17 2 0 0 0 0 16 29 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 18 22 2 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 30 31 1 0 0 0 0 M END