MMs00435147 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 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 1.3024 0.7442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0117 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9004 0.7325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9072 2.2325 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1894 -1.5233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4850 -2.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7874 -1.5350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4985 0.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0965 0.7091 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 -0.0467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3855 -1.5467 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6946 0.6974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9902 -0.0584 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.2926 0.6858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2994 2.1858 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.6018 2.9299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8974 2.1741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8907 0.6741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5883 -0.0701 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.1863 -0.0817 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.1998 2.9182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5022 3.6624 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5953 1.0419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0419 -0.5953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5953 -1.0419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5352 1.6669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0779 1.6599 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1474 -2.1187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4796 -3.4792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8239 -2.1397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5039 1.9208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1019 1.9091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9274 1.6202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4701 1.6132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6072 4.1299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1810 -1.2817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2283 0.5136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 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 11 2 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 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 19 20 1 0 0 0 0 19 38 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 23 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 25 3 0 0 0 0 M END