MMs01454561 MOE2007 2D CORINA 3.40 0006 02.08.2006 50 52 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 0.6887 -1.3326 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0952 -0.8114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5004 0.6328 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0255 -1.9881 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1939 -3.2365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7150 -4.6430 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7496 -2.8313 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5243 -1.9271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3265 -3.1946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6299 -4.5231 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8252 -3.1336 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6274 -4.4011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1262 -4.3401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9283 -5.6076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4271 -5.5467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1237 -4.2182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3215 -2.9507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8227 -3.0117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8112 -1.3150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5764 -2.6052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0763 -2.5876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8110 -1.2799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0459 0.0102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5460 -0.0073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3109 -1.2624 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0661 0.5509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2755 0.5330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0661 -0.5509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1917 -3.5756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2680 -0.7548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6343 -1.4712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3825 -2.0709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5174 -4.8570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8836 -5.5734 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5262 -5.3794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8183 -6.0635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1846 -6.7799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2669 -6.7359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5705 -5.9109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0735 -4.9515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0108 -3.4101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4315 -2.4948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0652 -1.7784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6794 -2.6474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9829 -1.8224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9886 -3.6514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6884 -3.6198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6337 1.0564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2399 0.5088 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 8 1 0 0 0 0 2 20 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 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 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 50 1 0 0 0 0 M END