MMs01756160 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 45 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 0.7488 -1.2997 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2488 -1.3012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9975 -2.6009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2463 -3.8992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9951 -5.1990 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7463 -3.8978 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1453 -4.9365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0025 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5025 -2.5967 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4651 -2.2904 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6233 -0.7988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2535 -0.1874 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9230 -0.0500 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9244 1.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2242 2.1987 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1849 2.7987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2256 3.6987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5253 4.4475 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5225 1.4475 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5788 -3.2952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0058 -2.8330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3191 -1.3661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7461 -0.9039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8599 -1.9087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5466 -3.3756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1196 -3.8378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8064 -5.3047 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0398 0.5990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5990 1.0398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0398 -0.5990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7425 1.2427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5151 2.5780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0436 3.4915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8162 4.8268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5265 5.6475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5623 2.0465 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6325 -4.0331 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1412 -4.3553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4281 -0.5623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9967 0.2696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0015 -1.5389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4376 -4.1794 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 9 1 0 0 0 0 3 4 2 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 20 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 36 1 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 M END