MMs01726822 MOE2007 2D CORINA 3.40 0006 02.08.2006 49 52 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 1.4951 -0.1213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7333 1.3597 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0439 2.5188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2154 1.5907 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8932 0.2526 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2037 -0.9065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8300 -0.8055 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.2313 0.9304 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8313 1.9696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5536 2.2685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0205 3.6940 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6568 0.4634 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8724 1.3421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8760 2.8421 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0838 0.4575 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.9323 -0.3910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1169 -0.9643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7297 -1.5350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9956 -2.4594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5115 0.9176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6238 -0.0888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0515 0.3713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3669 1.8378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2546 2.8442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8269 2.3841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6752 2.4229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0669 3.8708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7083 -1.3984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 1.1961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1961 0.0970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0970 -1.1961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2731 -0.4252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6199 -1.9915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1862 -2.6447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7995 -2.3624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8985 -3.6555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1916 -2.5564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3715 -1.2619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9413 -0.4338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5091 2.2059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5069 4.0173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9371 3.1892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3134 -0.7689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0788 -2.4200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7299 -2.0278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6169 -0.9679 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3199 -1.9404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7746 2.0381 0.0000 O 0 5 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 8 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 27 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 13 18 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 21 1 0 0 0 0 16 47 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 47 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 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 25 2 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 26 43 1 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 29 44 1 0 0 0 0 29 45 1 0 0 0 0 29 46 1 0 0 0 0 47 48 1 0 0 0 0 M CHG 1 49 -1 M END