MMs01211785 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 0.7414 -1.3039 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3414 -0.2647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2414 -1.3138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9829 -2.6177 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 -0.0197 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2584 1.2645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4998 -0.0493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5169 2.5487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0171 -2.5980 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5099 -2.7450 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6690 -3.0556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8314 -4.2101 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5373 -4.9687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 -3.9723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0491 -4.2938 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5062 -1.6237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9990 -1.7707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6001 -0.3964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4788 0.5999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1847 -0.1586 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0432 0.5932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5932 1.0432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0432 -0.5932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4068 1.0234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2838 -1.2100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6248 -0.4474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1335 1.6823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4746 2.4449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4567 -0.6425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0930 -1.0925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5430 0.5439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5522 1.9419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1237 3.5840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4817 3.1555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2490 -5.9348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3492 -5.7775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6058 -2.8060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7722 -0.1392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5964 1.7942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7584 1.2546 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 11 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 8 42 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 9 42 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 18 1 0 0 0 0 14 15 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 2 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 M END