MMs02394836 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 58 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 0.7453 1.3017 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0093 2.5981 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6093 1.5588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 3.8998 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3360 2.8606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0187 5.1961 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6187 6.2353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5187 5.1907 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7187 5.1907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2640 3.8890 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8640 2.8498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5093 2.5927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7640 3.8836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5186 5.1799 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7733 6.4817 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.9733 6.4817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2733 6.4871 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5280 7.7780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0280 7.7726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7826 9.0689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0373 10.3707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5373 10.3761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7827 9.0797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7267 6.4978 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2266 6.5032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9813 5.2069 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9720 7.8050 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4720 7.8104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2173 9.1121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4626 10.4084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2079 11.7101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7079 11.7155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4626 10.4192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7173 9.1175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2360 3.9052 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0414 0.5963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5963 -1.0414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0414 -0.5963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5514 2.7026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8901 3.4691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6242 6.7312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9826 9.0646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6410 11.4077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9411 11.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5827 9.0840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1229 7.5349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2678 6.6278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6011 7.4040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2626 10.4041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6042 12.7472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3042 12.7569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6626 10.4235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3210 8.0804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8397 2.8681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 13 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 36 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 25 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 18 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 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 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 50 1 0 0 0 0 32 33 1 0 0 0 0 32 51 1 0 0 0 0 33 34 2 0 0 0 0 33 52 1 0 0 0 0 34 35 1 0 0 0 0 34 53 1 0 0 0 0 35 54 1 0 0 0 0 36 55 1 0 0 0 0 M END