MMs01471665 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 0.7572 1.2949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2571 1.2866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0143 2.5815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2715 3.8846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7715 3.8929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0143 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0287 5.1961 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4622 5.3611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7660 6.8300 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4628 7.5728 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6463 6.5630 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4720 4.2519 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.9375 4.5719 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.0966 4.8825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3932 6.0010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9474 3.4627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4917 2.0336 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4128 3.7827 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4227 2.6736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9670 1.2444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9769 0.1353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4423 0.4552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8980 1.8844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8881 2.9935 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.4522 -0.6539 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.0286 5.1795 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5286 5.1712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0359 0.6057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6057 -1.0359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0359 -0.6057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8514 0.2441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2143 2.5748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1856 2.6047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2499 6.3655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7577 7.1443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5365 5.6365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7773 4.9260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7946 0.9885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6123 -1.0080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0704 2.1403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5220 3.9712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7286 5.1646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5352 6.3712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 38 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 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 27 28 1 0 0 0 0 28 42 1 0 0 0 0 28 43 1 0 0 0 0 28 44 1 0 0 0 0 M END