MMs00280758 MOE2007 2D CORINA 3.40 0006 02.08.2006 33 35 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 0.0053 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3071 2.2454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6034 1.4907 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2964 -0.7546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8944 -0.7639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0185 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4925 -0.7732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4871 -2.2731 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1623 -0.6428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1700 0.4684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6700 0.4630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4246 1.7594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6792 3.0611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1792 3.0664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4246 1.7701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9563 1.4634 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.4339 4.3574 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 13.9338 4.3521 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6885 5.6591 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 9.4689 -2.1111 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.0414 -0.5963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0317 2.1037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3113 3.4453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2921 -1.9546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1198 -1.6804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6625 -1.6859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2004 1.1815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2663 -0.5784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6246 1.7551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5829 4.1078 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 7 29 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 2 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END