MMs03922489 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 57 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 2.2564 -1.2878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0129 -2.5980 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2129 -2.5980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4870 -2.6055 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8870 -1.5663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2435 -1.3102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7435 -1.3177 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1435 -0.2785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4999 -0.0224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7564 1.2804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9999 -0.0299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7564 1.2654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2564 1.2580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9999 -0.0448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2434 -1.3401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7434 -1.3326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9870 -2.6279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7305 -3.9307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4870 -2.6204 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7306 -3.9157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4741 -5.2185 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2306 -3.9083 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4741 -5.2036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2176 -6.5063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0259 -5.1961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7694 -3.8933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2694 -3.8859 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7823 -6.4914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0388 -7.7941 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2823 -6.4839 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9741 -5.2110 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2305 -3.9232 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -8.9870 -2.6428 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0362 0.6052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6052 1.0362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5181 -0.3026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2624 -2.4878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4564 -1.2818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2505 -0.0878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6807 -1.1022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4578 -0.1295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5564 1.2863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3616 2.3166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1616 2.3076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8615 2.2942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1999 -0.0508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6440 -8.8304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8875 -7.5201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8771 -5.4417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6715 -5.7291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1869 -2.6488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7565 -1.2953 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 1.3565 -0.2561 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 53 1 0 0 0 0 2 38 1 0 0 0 0 2 39 1 0 0 0 0 2 40 1 0 0 0 0 2 53 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 27 1 0 0 0 0 3 53 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 23 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 7 42 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 20 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 11 43 1 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 14 46 1 0 0 0 0 15 16 2 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 32 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 29 2 0 0 0 0 27 28 2 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 30 48 1 0 0 0 0 31 49 1 0 0 0 0 31 50 1 0 0 0 0 32 51 1 0 0 0 0 34 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END