MMs01439806 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 41 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 0.0054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2547 -1.2909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5094 -2.5926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0094 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7453 -1.3017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2641 -3.8889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5188 -5.1907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2735 -6.4870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7735 -6.4816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5188 -5.1798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7641 -3.8835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5094 -2.5818 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0094 -2.5763 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.0148 -4.0763 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0039 -1.0763 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5094 -2.5709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2641 -3.8672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7640 -3.8618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5093 -2.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7546 -1.2637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2546 -1.2692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5000 0.0272 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -12.0093 -2.5546 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -10.5187 -5.1581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7735 -6.4598 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.6038 1.0371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0962 1.0468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4547 -1.2865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5868 -3.6395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9453 -1.3061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3188 -5.1950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6773 -7.5284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3772 -7.5186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7188 -5.1755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9056 -1.5447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6678 -4.9086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3509 -0.2223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0187 -5.1527 0.0000 O 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 25 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 25 26 1 0 0 0 0 25 39 2 0 0 0 0 M CHG 1 26 -1 M END