MMs00076128 MOE2007 2D CORINA 3.40 0006 02.08.2006 32 34 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 -1.3040 -0.7413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3140 -2.2413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6181 -2.9826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9121 -2.2239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9020 -0.7240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5980 0.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1960 0.0347 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3429 1.5275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2215 2.5237 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8080 1.8492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5666 0.5552 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.1666 -0.4841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5704 -0.5662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8921 -2.0313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.0594 0.4083 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.9330 1.6277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4329 1.6377 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.3162 3.4144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8869 3.0674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6675 3.9409 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.4599 3.0512 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 -1.0432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0432 0.5930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5930 1.0432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2788 -2.8482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6261 -4.1826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9553 -2.8170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5900 1.2173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4295 2.9879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9009 2.3445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0257 3.4458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 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 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 14 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 30 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 14 15 2 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 2 0 0 0 0 20 32 1 0 0 0 0 21 22 1 0 0 0 0 M END