MMs00331274 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 0.7516 -1.2981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2516 -1.2963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0031 -2.5945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2547 -3.8944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7547 -3.8962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0031 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4969 -2.5999 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2453 -3.8998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4937 -5.1980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7453 -3.9016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4937 -5.2016 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.9937 -5.2034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8769 -3.9909 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5074 -2.8492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3029 -4.4561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6028 -3.7077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9010 -4.4593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8992 -5.9593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5992 -6.7077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3011 -5.9561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8740 -6.4180 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.1973 -6.7108 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.4973 -5.9624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0062 -5.1925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5062 -5.1907 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0385 0.6012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6012 1.0385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0385 -0.6012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8503 -0.2564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2031 -2.5930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1559 -4.9362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0981 -1.5614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5384 -2.7196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8734 -3.4926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6043 -2.5077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9409 -3.8605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5978 -7.9077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8985 -4.9224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.5372 -5.3636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0960 -7.0023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2578 -6.4925 0.0000 O 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 22 2 0 0 0 0 14 15 1 0 0 0 0 14 16 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 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 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 38 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 2 0 0 0 0 M CHG 1 26 -1 M END