MMs00706579 MOE2007 2D CORINA 3.40 0006 02.08.2006 37 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 0.7542 -1.2966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2542 -1.2918 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0083 -2.5884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2625 -3.8899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0167 -5.1865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5167 -5.1816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2625 -3.8802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5083 -2.5836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -1.2821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7541 -1.2773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6319 -0.0610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1638 1.3641 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0600 -0.5199 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4851 -0.0518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0908 1.3205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5820 1.4821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4676 0.2714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8619 -1.1009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3706 -1.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4929 -2.4788 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0648 -2.0199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6397 -2.4880 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.2709 -6.4783 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0373 0.6033 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6033 1.0373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0373 -0.6033 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3721 -1.7107 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9664 -2.4777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0625 -3.8937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4200 -6.2276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4625 -3.8763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6508 -0.2448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3823 2.2890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0666 2.5799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6606 0.4007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5704 -2.0694 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 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 23 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 22 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 M END