MMs01222359 MOE2007 2D CORINA 3.40 0006 02.08.2006 31 34 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 -0.7429 -1.3031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0141 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5141 -2.5899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2570 -1.2868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.0081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7259 -1.5907 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6133 -0.7829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8908 -3.0816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5238 -3.6992 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1939 -3.8246 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.4888 -3.0675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7919 -3.8105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1589 -3.1930 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.1686 -4.3022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6686 -4.2941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4256 -5.5890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6827 -6.8921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1827 -6.9003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4257 -5.6053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9568 -5.3014 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.6056 1.0360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9429 -1.3096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5803 -3.6405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0943 1.0506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7125 -2.1525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2552 -2.1441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2630 -3.2516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6256 -5.5825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2883 -7.9281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5884 -7.9427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 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 26 1 0 0 0 0 12 27 1 0 0 0 0 13 14 2 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 28 1 0 0 0 0 17 18 1 0 0 0 0 17 29 1 0 0 0 0 18 19 2 0 0 0 0 18 30 1 0 0 0 0 19 20 1 0 0 0 0 19 31 1 0 0 0 0 20 21 1 0 0 0 0 M END