MMs00467796 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 53 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 1.2973 -0.7529 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2581 -1.3529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6015 1.4941 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8954 -0.7588 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4935 -0.7647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4935 0.4353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4901 -2.2647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7874 -3.0177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0881 -2.2706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0881 -3.4706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0915 -0.7706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3855 -3.0236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3821 -4.5236 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6862 -2.2765 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9835 -3.0295 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.9835 -1.8295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9801 -4.5294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2775 -5.2824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2741 -6.7824 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 15.5714 -7.5353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2843 -2.2824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5816 -3.0353 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6024 1.0379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0379 0.6024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6024 -1.0379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8927 -1.9588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4269 0.9092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9696 0.9057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3088 -2.0537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0771 -3.3914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0140 -3.9352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5567 -3.9387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2728 -0.9817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5045 0.3561 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0250 0.9033 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5676 0.8998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6889 -1.0765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7988 -4.3184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5672 -5.6561 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6905 -4.1557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4588 -5.4935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9691 -8.5732 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6093 -8.1377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1738 -6.4975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2533 -2.8506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2877 -0.7824 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2939 -2.2529 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3318 -2.8553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3283 -0.1848 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 4 1 0 0 0 0 2 51 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 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 15 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 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 12 16 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 25 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 49 51 1 0 0 0 0 50 53 1 0 0 0 0 51 52 1 0 0 0 0 M END