MMs02939352 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 45 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 1.3017 -0.7453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0093 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5588 0.6093 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5927 1.5093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8998 -0.7360 0.0000 C 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 5.2069 -2.9813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5032 -2.2266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4978 -0.7266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8050 -2.9719 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1013 -2.2173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0959 -0.7173 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.4030 -2.9626 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6994 -2.2079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6940 -0.7079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 0.0467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2920 -0.6986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2974 -2.1986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0011 -2.9533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5991 -2.9439 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 15.5884 0.0561 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5830 1.5561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2812 2.3014 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 16.8793 2.3107 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.5963 1.0414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0414 0.5963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5963 -1.0414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5337 -1.6673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0764 -1.6618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7927 1.5136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5883 2.7093 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3927 1.5050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8681 -2.8397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2112 -4.1813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5349 -0.1229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1918 1.2187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8093 -4.1719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4073 -4.1626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6526 -0.1117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9860 1.2467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0054 -4.1533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5830 2.7561 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 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 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 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 43 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 44 1 0 0 0 0 M END