MMs01037791 MOE2007 2D CORINA 3.40 0006 02.08.2006 50 52 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 1.3049 -0.7398 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2657 -1.3398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9029 -0.7194 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9147 -2.2193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6215 -2.9795 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5823 -3.5795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3167 -2.2397 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6333 -4.4795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 0.0408 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9562 -1.2523 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4358 1.3339 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4891 0.8010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4773 2.3009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7704 3.0611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0753 2.3213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0871 0.8214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 0.0612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3684 3.0815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3567 4.5814 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6733 2.3417 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6851 0.8417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9900 0.1020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2713 2.3621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9664 3.1019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5918 1.0439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0439 0.5918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5918 -1.0439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8195 0.9336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3621 0.9457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0948 -2.0017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3339 -3.3437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4334 -4.4889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6427 -5.6794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8333 -4.4700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4334 2.8927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7610 4.2610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1310 0.2295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8034 -1.1388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5017 1.0408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2835 -0.2891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2259 -0.8233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7685 -0.8112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6729 3.4929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4547 2.1630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1879 4.0150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7305 4.0272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2831 0.8621 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.3270 0.2703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 10 36 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 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 49 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 49 50 1 0 0 0 0 M END