MMs00679582 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 1.2985 -0.7509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0019 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8966 -0.7528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8955 -2.2528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1940 -3.0037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4936 -2.2547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4947 -0.7547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1962 -0.0037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7953 1.4944 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0927 -0.7565 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 -0.0074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3934 1.4926 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.6908 -0.7584 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9904 -0.0093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9915 1.4907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2910 2.2398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5895 1.4888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5885 -0.0112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2889 -0.7602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2878 -2.2602 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 14.2921 3.7398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2932 5.2398 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 12.7921 3.7408 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 15.7921 3.7387 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.6007 1.0388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0388 0.6007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6007 -1.0388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5265 -1.6696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0692 -1.6707 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8558 -2.8520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1931 -4.2037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5324 -2.8554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1970 1.1963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0919 -1.9565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6899 -1.9584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9527 2.0914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6292 2.0881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6273 -0.6119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 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 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 M END