MMs01217157 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 55 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 1.3027 0.7436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0128 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9008 0.7308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9081 2.2308 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0256 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4988 0.7180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0968 0.7052 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4641 0.0884 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.6233 -0.2222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4733 1.1982 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.7297 2.5009 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.9297 2.5009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2610 2.1962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1512 3.2054 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3466 3.8682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7688 -1.3803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6491 -2.3785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9538 -3.8473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3781 -4.3178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4977 -3.3196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1931 -1.8509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6827 -5.7866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1887 -1.5256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4840 -2.2819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8860 -2.2692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5949 1.0422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0422 -0.5949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5949 -1.0422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5359 1.6666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0786 1.6590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5921 -1.2128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7320 1.6411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2747 1.6335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4062 -0.4961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5609 -0.9614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4404 3.3747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8400 4.9620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2527 4.3616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5097 -2.0021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0581 -4.6458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6371 -3.6961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0888 -1.0523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5077 -6.0303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9264 -6.9615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8577 -5.5428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1887 -2.7256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8789 -3.3182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5203 -2.8870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7866 -1.7638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2911 -1.2270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8438 -2.8640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4809 -3.3113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 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 25 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 17 1 0 0 0 0 15 16 2 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 M END