MMs01065690 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 45 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 1.2902 -2.2551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5862 -3.0102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8882 -2.2653 0.0000 C 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 2.5981 -0.0102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1843 -3.0204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4863 -2.2756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7824 -3.0307 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0843 -2.2858 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.8292 -3.5878 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3395 -0.9838 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3863 -1.5409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6824 -2.2960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9844 -1.5511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 -0.0511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6942 0.7040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 -0.0409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2923 0.6937 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.4549 2.1849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9234 2.4910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6682 1.1890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6602 0.0782 0.0000 N 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 0.2486 -2.8510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5815 -4.2102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9357 -0.1694 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 4.4093 -3.9366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9520 -3.9427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7186 -1.3533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2612 -1.3593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7776 -4.2307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6777 -3.4960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0212 -2.1552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6989 1.9040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3554 0.5632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5663 2.9914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4158 3.5853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8612 1.0589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 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 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 31 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 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 M END