MMs00648853 MOE2007 2D CORINA 3.40 0006 02.08.2006 47 50 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 -1.2930 -0.7604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2809 -2.2604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5739 -3.0208 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6131 -3.6208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8789 -2.2812 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8910 -0.7813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3212 -0.3292 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1931 -1.5498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3017 -2.7562 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.6931 -1.5619 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.4535 -0.2689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9534 -0.2809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6930 -1.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1929 -1.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9533 -0.3050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2138 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7139 1.0120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9743 2.3171 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.5980 -0.0209 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5618 -4.5207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2568 -5.2603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2448 -6.7602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5377 -7.5206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8428 -6.7811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8548 -5.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1357 -7.5415 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0241 -2.9999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3171 -2.2395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0362 -4.4999 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6083 -1.0344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0344 0.6083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6083 1.0344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3292 0.1506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6714 0.9112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0846 -2.6203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7846 -2.6420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1533 -0.3147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8221 2.0344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6076 1.1791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7396 -4.9561 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2007 -7.3519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5281 -8.7206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8988 -4.6895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1261 -8.7415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4810 -4.8040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0802 -5.0915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 21 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 7 20 1 0 0 0 0 8 9 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 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 20 40 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 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 44 1 0 0 0 0 27 45 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 46 1 0 0 0 0 30 47 1 0 0 0 0 M END