MMs01557775 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 43 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 1.5000 -0.0067 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2442 -1.3091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2558 1.2889 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9601 2.0448 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5515 0.5331 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0116 2.5846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2674 3.8870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0233 5.1827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5232 5.1759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2674 3.8736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5116 2.5779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7674 3.8668 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5116 2.5644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7558 1.2688 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0116 2.5577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7557 1.2553 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2557 1.2486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0115 2.5443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5115 2.5376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2557 1.2352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4999 -0.0605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9999 -0.0538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2441 -1.3494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4883 -2.6451 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2790 6.4716 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0054 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0054 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2022 -1.9044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8395 -2.3510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2861 -0.7138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0675 3.8924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4279 6.2246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1069 1.5360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3720 4.9034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8085 3.7404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1410 2.9631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4162 3.5862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1162 3.5741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4557 1.2298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0952 -1.1024 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 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 6 2 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 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 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 24 25 3 0 0 0 0 M END