MMs02438491 MOE2007 2D CORINA 3.40 0006 02.08.2006 66 68 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 1.3045 -0.7405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3155 -2.2404 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3155 -3.4404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0219 -2.9999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0329 -4.4999 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2826 -2.2594 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5761 -3.0189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6199 -2.9809 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9135 -2.2215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9025 -0.7215 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2179 -2.9619 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3694 -3.8105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5115 -2.2025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8159 -2.9429 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.1095 -2.1835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3500 -0.8899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0905 0.4145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3310 1.7081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8310 1.6971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0906 0.3926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8500 -0.9009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4030 -1.4240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7075 -2.1645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0010 -1.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9900 0.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6855 0.8354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3920 0.0760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8689 -3.4770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1285 -4.7815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8879 -6.0750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3879 -6.0640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1284 -4.7595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3689 -3.4660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5924 1.0436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0436 0.5924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5924 -1.0436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3045 0.4595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2056 -1.0158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6328 0.6266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9904 1.0538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1837 -1.9841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6109 -3.6265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9685 -4.0537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6287 -4.1809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7334 -1.2889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2761 -1.2776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6905 0.4189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9234 2.7516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2235 2.7319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8906 0.3838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5538 -1.4227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7119 -2.7645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0446 -1.9974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0249 0.7025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6768 2.0354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8702 0.3722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9285 -4.7902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2955 -7.1186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9955 -7.0989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3283 -4.7508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6651 -2.9442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1941 -5.0695 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2289 -4.4619 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2725 -5.0543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 39 1 0 0 0 0 3 40 1 0 0 0 0 3 41 1 0 0 0 0 3 42 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 43 1 0 0 0 0 9 44 1 0 0 0 0 9 45 1 0 0 0 0 10 11 1 0 0 0 0 10 46 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 15 1 0 0 0 0 13 65 1 0 0 0 0 15 16 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 24 1 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 21 22 2 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 52 1 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 54 1 0 0 0 0 26 27 1 0 0 0 0 26 55 1 0 0 0 0 27 28 2 0 0 0 0 27 56 1 0 0 0 0 28 29 1 0 0 0 0 28 57 1 0 0 0 0 29 58 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 59 1 0 0 0 0 32 33 1 0 0 0 0 32 60 1 0 0 0 0 33 34 2 0 0 0 0 33 61 1 0 0 0 0 34 35 1 0 0 0 0 34 62 1 0 0 0 0 35 63 1 0 0 0 0 64 65 1 0 0 0 0 65 66 1 0 0 0 0 M END