MMs01745822 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 58 0 0 1 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 1.3001 -0.7481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3023 -2.2481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6025 -2.9962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9004 -2.2443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8982 -0.7443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4985 -2.2404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7986 -2.9885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0966 -2.2366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0944 -0.7366 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.0944 0.4634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 0.0153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3901 1.5153 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6924 -0.7328 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6946 -2.2328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9948 -2.9809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2927 -2.2290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5929 -2.9771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8908 -2.2252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8886 -0.7252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5884 0.0229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2905 -0.7290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9904 0.0191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5985 1.0401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0401 0.5985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5985 -1.0401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 -2.8496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6043 -4.1962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9405 -2.8427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5963 1.2038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4235 0.9258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9661 0.9280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0897 -3.3687 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3164 -2.0338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0286 -3.9089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5713 -3.9066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5086 -3.3636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6873 -2.1316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5642 0.9319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0215 0.9296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1036 -2.1295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2859 -3.3610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2248 -3.9013 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7675 -3.8990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5946 -4.1771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9309 -2.8236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9269 -0.1236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5867 1.2229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2177 0.9372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7604 0.9395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4963 -0.7404 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.4963 0.4596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 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 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 33 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 8 54 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 9 54 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 14 54 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 26 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 23 24 2 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END