MMs01198541 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 54 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 1.5000 -0.0048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2459 -1.3062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7458 -1.3110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0143 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4917 -2.6124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7376 -3.9090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4834 -5.2104 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9834 -5.2152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7293 -6.5166 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7376 -3.9186 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9917 -2.6172 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.1917 -2.6172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7458 -1.3205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -0.0191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7541 1.2776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2541 1.2728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 -0.0286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2458 -1.3253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4999 -0.0334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7293 -6.5071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2376 -3.9043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4835 -5.2009 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0165 -5.1961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7624 -3.8947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2624 -3.8899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0165 -5.1866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2707 -6.4880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7707 -6.4928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0248 -7.7942 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0038 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0038 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2954 1.1777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6289 0.4021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9376 -3.9224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4000 -0.0172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1574 2.3187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8574 2.3101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8425 -2.3664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4961 -1.2334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6999 -0.0372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5038 1.1666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6920 -5.9038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1260 -7.5444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7666 -7.1104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4497 -2.7232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1113 -3.4902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1591 -2.8574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8591 -2.8488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2165 -5.1828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8740 -7.5253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 22 1 0 0 0 0 8 9 1 0 0 0 0 8 21 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 M END