MMs02495109 MOE2007 2D CORINA 3.40 0006 02.08.2006 65 65 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 0.0057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2549 -1.2905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2451 1.3076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7451 1.3132 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9451 1.3132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7549 -1.2848 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 0.0227 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7549 -1.2734 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.3549 -2.3127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0098 -2.5753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2549 -1.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 0.0341 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0098 -2.5640 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5098 -2.5583 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.9098 -3.5975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2548 -1.2564 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.8548 -0.2172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7548 -1.2507 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.9548 -1.2507 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5097 -2.5469 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.1097 -3.5861 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7647 -3.8488 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2647 -3.8545 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.8647 -4.8937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5196 -5.1563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0097 -2.5412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7647 -3.8374 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.9646 -3.8329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4999 0.0512 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6999 0.0557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4999 0.0398 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0960 1.0813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4901 2.6151 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7352 3.9113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2352 3.9056 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4803 5.2132 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0803 6.2524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9803 5.2189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0045 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0045 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 -1.0335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -1.8944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8588 -2.3275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2919 -0.6866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1159 1.7137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4490 2.4901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5960 1.0642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9683 -1.9793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4137 -3.6168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0513 -3.1714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4137 -3.6054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1235 -6.1933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7969 -1.3602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1358 -2.1265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6901 2.6197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9848 4.0189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1803 5.2234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9757 6.4188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7254 6.5094 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 4.7623 7.1133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1214 7.5463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6884 5.9054 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 4 1 0 0 0 0 2 44 1 0 0 0 0 3 45 1 0 0 0 0 3 46 1 0 0 0 0 3 47 1 0 0 0 0 4 5 1 0 0 0 0 4 48 1 0 0 0 0 4 49 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 35 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 50 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 12 51 1 0 0 0 0 12 52 1 0 0 0 0 12 53 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 54 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 25 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 33 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 31 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 28 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 55 1 0 0 0 0 28 29 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 29 30 1 0 0 0 0 31 32 1 0 0 0 0 33 34 1 0 0 0 0 35 36 1 0 0 0 0 35 58 1 0 0 0 0 36 37 2 0 0 0 0 36 38 1 0 0 0 0 38 39 1 0 0 0 0 38 40 1 0 0 0 0 38 62 1 0 0 0 0 40 59 1 0 0 0 0 40 60 1 0 0 0 0 40 61 1 0 0 0 0 62 63 1 0 0 0 0 62 64 1 0 0 0 0 62 65 1 0 0 0 0 M CHG 1 62 1 M END