MMs01430268 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 57 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 0.3643 -1.4551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5988 -2.6051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1973 -3.8764 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.6524 -3.5121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7556 -2.0157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1031 -1.3569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2064 0.1396 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3475 -2.1945 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4255 -1.6674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2443 -3.6909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8967 -4.3497 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4886 -4.5285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8362 -3.8697 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.0805 -4.7073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4281 -4.0484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5313 -2.5520 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6725 -4.8861 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0200 -4.2272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2644 -5.0648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6120 -4.4060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7152 -2.9095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4708 -2.0719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1232 -2.7308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0627 -2.2507 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.3071 -3.0883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6546 -2.4295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7579 -0.9330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.5135 -0.0954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1659 -0.7543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0953 -2.5019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1641 0.2914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2914 1.1641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1641 -0.2914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6559 -5.3925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1949 -5.4987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2478 -5.5713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7868 -5.6774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5899 -6.0832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1818 -6.2620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6074 -5.0761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5534 -0.8748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1278 -2.0607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4743 -3.9523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0133 -4.0585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9865 -3.5827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.8480 -2.3029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3463 0.7686 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8072 0.8747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9726 -0.8808 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8341 0.3989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0127 -1.3047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2924 -2.4193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1778 -3.6990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 12 1 0 0 0 0 6 7 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 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 30 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 M END