MMs01144476 MOE2007 2D CORINA 3.40 0006 02.08.2006 48 50 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 1.5000 -0.0099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2585 1.2841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2414 -1.3139 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8414 -2.3531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7413 -1.3238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4827 -2.6278 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0298 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 -0.0397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8735 -1.2590 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3031 -0.8049 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3130 0.6950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8896 1.1680 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.5324 1.5687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8986 0.9495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1180 1.8231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9710 3.3159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6048 3.9351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3855 3.0614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1904 4.1896 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5566 3.5704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4828 -2.6079 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0172 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7586 -1.2940 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7758 -3.8921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2685 -4.0390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5901 -5.5041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2961 -6.2627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1747 -5.2664 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0079 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0079 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 1.0293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2938 0.6773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8654 2.3194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2233 1.8910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9068 1.0134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0162 -0.2447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2110 1.3278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4872 5.1293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2924 3.5568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0613 2.4774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6496 3.0751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0519 4.6634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0759 -3.6511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0656 -3.1419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6896 -5.9849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1785 -7.4569 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 6 1 0 0 0 0 4 22 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 8 37 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 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 27 28 2 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 M END