MMs00175480 MOE2007 2D CORINA 3.40 0006 02.08.2006 38 40 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 1.4927 -0.1473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3667 1.0718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8595 0.9244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4782 -0.4420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6043 -1.6611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1115 -1.5138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2230 -3.0275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9710 -0.5893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7292 -1.8836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1944 -1.5625 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3418 -0.0697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9676 0.5317 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.6360 0.6885 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.9398 -0.0532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9493 -1.5532 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2340 0.7050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2245 2.2049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5188 2.9632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8226 2.2214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8321 0.7214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5378 -0.0368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1358 -0.0203 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.1179 1.1942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1942 0.1179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1179 -1.1942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8717 2.1649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5586 1.8997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4123 -2.4890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1299 -3.5225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7181 -4.1207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3162 -2.5325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2481 -2.9829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6284 1.8885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1815 2.7983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5112 4.1631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8580 2.8280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5454 -1.2368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 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 27 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 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 29 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 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 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 38 1 0 0 0 0 M END