MMs01488686 MOE2007 2D CORINA 3.40 0006 02.08.2006 33 33 0 0 1 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 1.2943 0.7582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0165 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8923 0.7747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8828 2.2747 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 0.0330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4903 0.7912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4808 2.2912 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 0.0494 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.7548 -0.5506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8036 -1.4505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0883 0.8077 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.3921 0.0659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4016 -1.4341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7054 -2.1758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9996 -1.4176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9901 0.0824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6864 0.8241 0.0000 C 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 -1.0354 -0.6066 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 0.5171 1.6726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0598 1.6824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6056 -1.1835 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2037 -1.1670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6036 -1.4581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8112 -2.6505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0036 -1.4429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3662 -2.0406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7130 -3.3758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0426 -2.0110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0255 0.6890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6787 2.0241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 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 6 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 16 17 2 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 18 33 1 0 0 0 0 M END