MMs02606097 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 57 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 1.3175 -0.7172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5973 0.0652 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9147 -0.6519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9524 -2.1515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2698 -2.8686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5496 -2.0862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5120 -0.5867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1945 0.1304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9265 -0.0875 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.8383 -1.2785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9874 -2.5138 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3379 -1.2409 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1888 -0.0056 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.0373 0.8429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6266 -0.4332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6642 -1.9327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2497 -2.4319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8222 -3.8697 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.8995 -2.7837 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.8176 0.4787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6234 1.9661 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2028 -0.0968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3970 -1.5842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7822 -2.1597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9732 -1.2479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7790 0.2395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3938 0.8150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3584 -1.8234 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 10.6896 1.4089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6650 2.5484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1658 3.9629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6912 4.2379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7158 3.0983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2150 1.6838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5737 1.0540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0540 0.5737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5737 -1.0540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5694 -1.6555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1116 -1.6168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9285 -2.7774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2999 -4.0682 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1644 1.3301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5762 2.6955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4442 -2.3137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9375 -3.3496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.7318 0.9690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2384 2.0049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8447 2.3285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9461 4.8746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2919 5.3695 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5362 3.3183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4347 0.7722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 39 1 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 41 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 30 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 1 0 0 0 0 17 20 2 0 0 0 0 18 19 2 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 48 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 49 1 0 0 0 0 32 33 1 0 0 0 0 32 50 1 0 0 0 0 33 34 2 0 0 0 0 33 51 1 0 0 0 0 34 35 1 0 0 0 0 34 52 1 0 0 0 0 35 53 1 0 0 0 0 M END