MMs01861243 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 43 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 1.3024 -0.7442 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 1.3090 -2.2442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6114 -2.9884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9071 -2.2326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9004 -0.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1894 1.5231 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4985 -0.7211 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0965 -0.7095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 0.0462 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6946 -0.6980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7012 -2.1980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 0.0578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9836 1.5578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2793 2.3135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5816 1.5693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5883 0.0693 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 14.2926 -0.6864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8907 -0.6749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5954 1.0419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0419 0.5954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5954 -1.0419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2725 -2.8488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6167 -4.1884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9490 -2.8280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5927 1.2115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5038 -1.9211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0187 0.9505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5614 0.9573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3293 -1.6322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8719 -1.6254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3869 1.2462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9417 2.1531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2739 3.5135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6182 2.1739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2980 -1.8864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2953 -1.7168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9326 -1.2703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4860 0.3670 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 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 M CHG 1 2 1 M CHG 1 20 1 M END