MMs00027099 MOE2007 2D CORINA 3.40 0006 02.08.2006 64 67 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 1.3054 -0.7388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9034 -0.7164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9163 -2.2164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6238 -2.9775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3184 -2.2387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0258 -2.9999 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0387 -4.4998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 0.0447 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5014 -0.6941 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5014 0.5059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7939 0.0671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0994 -0.6717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1123 -2.1716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8198 -2.9328 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.8590 -3.5328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5143 -2.1940 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5143 -3.3940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2218 -2.9552 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8327 -4.4327 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3919 0.0895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3790 1.5894 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6974 -0.6493 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9899 0.1118 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.9899 -1.0882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9770 1.6118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2695 2.3729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6450 1.7747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6391 2.8980 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.8336 2.7828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8779 4.1905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4135 3.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4002 4.9721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8514 6.4026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3159 6.7271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3292 5.6210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2953 -0.6269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3083 -2.1269 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5879 0.1342 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 1.0444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0444 0.5910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5910 -1.0444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5876 1.2223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4385 -2.5119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6341 -4.1775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1612 -4.5102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0491 -5.6998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2387 -4.4895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7836 1.2671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2922 -1.9531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5324 -3.2957 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2321 -4.1551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8770 -5.0238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7077 -1.8493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7971 1.3932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5569 2.7358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9046 0.6031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2286 4.7125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0408 7.2874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6769 7.8715 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5008 5.8806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6322 -0.4568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5827 0.7342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 1 43 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 44 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 5 6 2 0 0 0 0 5 45 1 0 0 0 0 6 7 1 0 0 0 0 6 46 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 47 1 0 0 0 0 9 48 1 0 0 0 0 9 49 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 18 1 0 0 0 0 13 14 2 0 0 0 0 13 50 1 0 0 0 0 14 15 1 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 51 1 0 0 0 0 15 52 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 21 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 53 1 0 0 0 0 21 54 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 55 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 38 1 0 0 0 0 27 28 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 28 29 2 0 0 0 0 28 33 1 0 0 0 0 29 30 1 0 0 0 0 29 58 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 32 33 1 0 0 0 0 32 37 2 0 0 0 0 33 34 2 0 0 0 0 34 35 1 0 0 0 0 34 59 1 0 0 0 0 35 36 2 0 0 0 0 35 60 1 0 0 0 0 36 37 1 0 0 0 0 36 61 1 0 0 0 0 37 62 1 0 0 0 0 38 39 2 0 0 0 0 38 40 1 0 0 0 0 40 63 1 0 0 0 0 40 64 1 0 0 0 0 M END