MMs03219609 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 55 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 1.4550 0.3648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4984 -0.7128 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8665 1.8072 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0318 2.6694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3215 2.1721 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4729 3.0206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3649 1.0944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8198 1.4592 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.8633 0.3816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3182 0.7464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3616 -0.3312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8166 0.0336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8600 -1.0440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3150 -0.6792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3584 -1.7568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8134 -1.3920 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7265 0.7632 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.1815 1.1280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2249 0.0504 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5930 2.5705 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.4339 2.8811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2282 4.0254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6707 3.6139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0470 3.0176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6029 4.7890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7330 3.6145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1880 3.9793 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2918 1.1640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 -0.2918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2918 -1.1640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3709 0.4221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8544 -0.0012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8693 -0.2907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3528 -0.7140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8287 1.8420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3122 1.4188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3677 -1.0036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8512 -1.4268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3271 1.1292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8106 0.7060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5308 -2.1980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8918 1.6253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0313 3.9401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3521 5.2190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5700 1.9165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.1481 2.5405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2856 3.5681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0729 4.4162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3487 5.7292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6628 5.5348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9468 -3.1993 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6896 4.6921 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0188 5.8461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7816 -4.0614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 27 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 2 0 0 0 0 16 52 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 28 2 0 0 0 0 27 53 1 0 0 0 0 52 55 1 0 0 0 0 53 54 1 0 0 0 0 M END