MMs01727438 MOE2007 2D CORINA 3.40 0006 02.08.2006 41 43 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 1.2853 -0.7733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1768 -1.9796 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0254 -2.8281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5996 -1.5045 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5874 -0.0045 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5874 1.1955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1571 0.4474 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.0873 0.0077 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1266 -0.5923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0995 -1.4923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1688 -2.5443 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1393 1.0769 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5913 0.7005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9913 -0.7451 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6433 1.7698 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.4918 2.6183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0953 1.3934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2533 2.3468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5179 1.5401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1415 0.0881 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.6442 -0.0026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2433 3.2155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7913 3.5919 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7249 -3.4099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7377 -4.5164 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0128 -1.5674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6186 1.0282 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0282 0.6186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6186 -1.0282 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8193 2.2335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1807 3.5446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6347 1.9793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9989 -1.0143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6225 -0.5494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0053 -2.2028 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6481 -2.5855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2953 4.2847 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2603 -3.7337 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1012 -4.8780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9753 5.4413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 25 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 23 1 0 0 0 0 18 19 1 0 0 0 0 18 22 2 0 0 0 0 19 20 2 0 0 0 0 19 32 1 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 22 34 1 0 0 0 0 23 24 2 0 0 0 0 23 38 1 0 0 0 0 25 26 2 0 0 0 0 25 39 1 0 0 0 0 27 35 1 0 0 0 0 27 36 1 0 0 0 0 27 37 1 0 0 0 0 38 41 1 0 0 0 0 39 40 1 0 0 0 0 M END