MMs02906838 MOE2007 2D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 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 0.0054 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2910 -2.2546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2856 -3.7546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0161 -4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3125 -3.7453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3071 -2.2453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6034 -1.4907 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9052 -2.2360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2015 -1.4814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0186 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5032 -2.2267 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7996 -1.4720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1013 -2.2174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3976 -1.4627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 0.0373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0905 0.7826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6886 0.7919 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.9339 2.0883 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4432 -0.5044 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2866 0.8012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4488 -0.6900 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.9171 -0.9966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6624 0.3052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6548 1.4163 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.5819 -4.5093 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.8836 -3.7640 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5765 -6.0093 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2000 0.0043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0043 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3323 -1.6584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0204 -5.7000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3539 -4.3416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1371 -3.1580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6798 -3.1525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5075 -3.4267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1056 -3.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4390 -2.0590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0862 1.9826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7528 0.6242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4091 -2.0911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8554 0.4349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9849 1.5466 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9806 2.7466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 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 38 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 45 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END