MMs02584048 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 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 1.2946 -0.7576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8927 -0.7728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2048 1.4696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9102 2.2272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6068 1.4848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5082 2.2120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8029 1.4544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1767 2.0564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4972 3.5218 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1739 0.9359 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4163 -0.3588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0184 -1.7326 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.9509 -0.0383 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.6666 1.0839 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.8666 1.0839 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5411 -0.1347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9230 -1.5015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7976 -2.7201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2903 -2.5721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9084 -1.2053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0338 0.0133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2847 2.4507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7774 2.5987 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6061 1.0357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0357 0.6061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6061 -1.0357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5179 -1.6723 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0606 -1.6813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8856 -1.9728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2318 -0.6365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9172 3.4271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5711 2.0908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5153 3.4119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7289 -1.6199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3031 -3.8135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9899 -3.5470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1025 -1.0869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5283 1.1067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4101 3.6693 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9046 4.7627 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 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 16 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 17 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 25 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 42 43 1 0 0 0 0 M END