MMs01697717 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 43 0 0 1 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 2.2554 -1.2897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2446 1.3084 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8446 2.3476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7446 1.3146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0187 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 0.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7445 1.3271 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7554 -1.2709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2553 -1.2647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0107 -2.5606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2662 -3.8627 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5107 -2.5543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3873 -1.3371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8158 -1.7947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8221 -3.2947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3975 -3.7642 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.0393 -4.1713 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.4892 2.6043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0936 3.9771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9747 4.9762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3212 4.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0033 2.7549 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2187 -1.8940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8597 -2.3264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2921 -0.6853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5313 2.4955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8705 1.7298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9043 -1.0230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6294 -1.6860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9686 -2.4518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0420 -0.0838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3813 -0.8496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0118 -0.1974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7837 -1.0853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2663 4.2315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0951 6.1701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4195 4.7043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.0062 0.0000 N 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 42 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 42 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 19 1 0 0 0 0 3 42 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 M END