MMs03130804 MOE2007 2D CORINA 3.40 0006 02.08.2006 61 60 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 1.3036 -0.7420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3128 -2.2420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5888 1.5159 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6280 0.9159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8832 2.2739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8740 3.7739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1868 1.5319 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4812 2.2899 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.5205 2.8899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4720 3.7899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7849 1.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0793 2.3059 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 0.0479 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0977 -0.6941 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.0585 -1.2941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3921 0.0639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6957 -0.6781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9901 0.0799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7050 -2.1781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1069 -2.1940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8125 -2.9520 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2852 2.2579 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 3.7579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5704 4.5159 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0277 4.4999 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0669 5.0999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0369 5.9999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5936 1.0429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0429 0.5936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5936 -1.0429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2644 -1.3420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1129 -2.2493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3202 -3.4419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5128 -2.2346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0154 -1.1091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7785 0.2316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1942 0.3319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6720 3.7972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4646 4.9898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2720 3.7825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7586 -0.5585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6151 0.9784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1578 0.9879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7350 -1.2781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5965 -0.9556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0257 0.6863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3838 1.1154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5050 -2.1854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7123 -3.3780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9049 -2.1707 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2497 1.6516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1631 6.0073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0443 7.1999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2369 5.9925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3650 4.3355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4106 -2.9360 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3221 3.7419 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3147 2.5420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4179 -4.1360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 24 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 39 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 12 42 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 43 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 22 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 21 1 0 0 0 0 19 46 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 22 23 2 0 0 0 0 22 58 1 0 0 0 0 24 25 1 0 0 0 0 24 53 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 59 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 57 59 1 0 0 0 0 58 61 1 0 0 0 0 59 60 1 0 0 0 0 M END