MMs00828782 MOE2007 2D CORINA 3.40 0006 02.08.2006 59 60 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 0.0065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2556 -1.2892 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0556 -1.2892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5113 -2.5915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2670 -3.8873 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6715 -4.9291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 0.0262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7556 -1.2696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2556 -1.2630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 0.0393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2443 1.3350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7443 1.3285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9886 2.6373 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2329 3.9331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4999 0.0458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2556 -1.2499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7555 -1.2434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4999 0.0589 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5112 -2.5392 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.0112 -2.5326 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 16.2112 -2.5326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7555 -1.2303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7669 -3.8284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0225 -5.1307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7782 -6.4264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2782 -6.4199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0225 -5.1176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2668 -3.8218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0052 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0052 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2865 1.1874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6258 0.4219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5887 -1.8242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5954 -3.3669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7032 1.2023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3705 0.4251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1601 -2.3114 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8601 -2.2996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1397 2.3651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2695 4.5376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6284 4.9697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1963 3.3285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1297 -1.6653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4691 -2.4308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9157 -3.5810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7974 -1.8258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3510 -0.1885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7137 -0.6348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8225 -5.1359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1827 -7.4683 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8827 -7.4565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2225 -5.1123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8623 -2.7800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7556 -1.2827 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.5524 -2.4653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8850 -1.6882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 57 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 8 57 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 28 29 2 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 30 56 1 0 0 0 0 57 58 1 0 0 0 0 57 59 1 0 0 0 0 M CHG 1 57 1 M END