MMs01604913 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 41 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 1.2961 0.7551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0102 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8941 0.7653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8883 2.2653 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0204 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4922 0.7755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4863 2.2754 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0903 0.7856 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 0.0407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5549 -1.4504 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0233 -1.7565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7682 -0.4546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7601 0.6562 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0663 2.1247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2594 -0.2919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8641 1.0808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3552 1.2434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2417 0.0334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6369 -1.3393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1458 -1.5020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6041 1.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0369 -0.6041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6041 -1.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5211 1.6713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0638 1.6774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6028 -1.1898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2008 -1.1796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0264 -0.8917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5691 -0.8857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5157 -2.8509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2410 1.8798 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3111 3.2994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8915 2.3695 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1549 2.0488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8390 2.3416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4346 0.1635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3461 -2.3074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6620 -2.6001 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 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 M END