MMs00680672 MOE2007 2D CORINA 3.40 0006 02.08.2006 45 46 0 0 0 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 0.0013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4987 1.5013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5013 -1.4987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7512 -1.2957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2512 -1.2943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 0.0054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2488 1.3037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7488 1.3024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 0.0067 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2512 -1.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7512 -1.2903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5000 0.0094 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5023 -2.5887 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0023 -2.5873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7512 -1.2876 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.7535 -3.8857 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2535 -3.8844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0023 -2.5846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5023 -2.5833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2535 -3.8817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5046 -5.1814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0046 -5.1827 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.7535 -3.8803 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0005 0.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0005 -0.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6987 1.5024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4976 2.7013 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8987 1.5008 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9013 -1.4992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5024 -2.6987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7013 -1.4976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1521 -2.3354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8521 -2.3330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8479 2.3435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1479 2.3411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1239 -1.7031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4606 -2.4732 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9033 -3.6284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1544 -4.9255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4014 -1.5460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1014 -1.5435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1056 -6.2201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 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 41 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 M END