MMs01107217 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 1.3026 -0.7439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3097 -2.2438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6122 -2.9877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9077 -2.2316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9006 -0.7316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0123 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0245 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4987 -0.7193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5057 -2.2193 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 0.0368 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0967 -0.7070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1038 -2.2070 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 0.0491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6948 -0.6948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9902 0.0614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9832 1.5614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6806 2.3052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3851 1.5491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6735 3.8052 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9690 4.5613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2928 -0.6825 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5883 0.0736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0142 -3.0000 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.5951 1.0421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0421 0.5951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5951 -1.0421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6179 -4.1877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9498 -2.8266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1904 1.2245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7885 1.2368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7004 -1.8947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0195 2.1663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3430 2.1442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5739 3.5249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0054 5.1662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3641 5.5977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1932 -0.9627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6247 0.6785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9834 1.1100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 13 2 0 0 0 0 12 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 32 1 0 0 0 0 16 17 1 0 0 0 0 16 22 1 0 0 0 0 17 18 2 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 M END