MMs02645511 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 40 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 1.2982 0.7515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0030 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8962 0.7545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8945 2.2545 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1979 -1.4940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4978 -2.2425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7960 -1.4910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4943 0.7575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0959 -2.2395 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3940 -1.4880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 0.0120 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.6939 -2.2365 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9921 -1.4850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9904 0.0150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2885 0.7665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5884 0.0180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5902 -1.4820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2920 -2.2335 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.8901 -2.2305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6012 1.0385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0385 -0.6012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6012 -1.0385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5258 1.6699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0685 1.6716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1593 -2.0952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4992 -3.4425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8328 0.6102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4929 1.9575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0972 -3.4395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6953 -3.4365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9505 0.6138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2872 1.9665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6270 0.6192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2913 -3.2705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9300 -2.8293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4889 -1.1906 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 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 33 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 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 M END