MMs03727331 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 1.3054 2.2463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8992 0.7390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0147 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4973 0.7317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5015 2.2317 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7900 -1.5220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0869 -2.2756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3880 -1.5293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 -0.0293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0953 0.7243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0996 2.2243 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4007 2.9707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6976 2.2170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6934 0.7170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 -0.0366 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9988 2.9633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0030 4.4633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7061 5.2170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4050 4.4707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1080 5.2243 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.5971 1.0409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0409 -0.5971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5971 -1.0409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5054 2.2429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3088 3.4463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1054 2.2497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3668 -0.9288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8241 -0.9244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1305 1.6604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6731 1.6561 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1927 -1.2147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7490 -2.1190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0835 -3.4756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4256 -2.1322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9869 -1.2366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0312 0.5604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0363 2.3604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0439 5.0604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7095 6.4170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3011 0.7463 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2619 1.3463 0.0000 H 0 0 0 0 0 0 0 0 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 1 43 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 2 43 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 43 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 22 2 0 0 0 0 16 17 1 0 0 0 0 16 19 2 0 0 0 0 17 18 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 43 44 1 0 0 0 0 M CHG 1 43 1 M END