MMs02778764 MOE2007 2D CORINA 3.40 0006 02.08.2006 61 63 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 -0.7531 -1.2973 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3531 -0.2580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2531 -1.2937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 0.0071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 0.0107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2531 -1.2865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5062 -2.5874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0062 -2.5909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0062 -2.5981 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4938 -2.6016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2469 -1.3044 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2407 -3.9025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4876 -5.1997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2345 -6.5005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7345 -6.5041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4876 -5.2068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7407 -3.9060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4938 -2.6088 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9938 -2.6123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7407 -3.9132 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7469 -1.3151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2469 -1.3187 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 -0.0214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5000 -0.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2531 1.2723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5061 2.5731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0062 2.5767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2531 1.2794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7531 1.2830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0062 2.5838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9938 -2.6195 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.6930 -3.3664 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2946 -1.8726 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7407 -3.9203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0378 -0.6025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6025 1.0378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0378 0.6025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3975 1.0449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0975 1.0514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4531 -1.2837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1086 -3.6252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4086 -3.6316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6086 -3.6359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2876 -5.1969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6321 -7.5383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3321 -7.5447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6876 -5.2097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8963 -1.5681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6202 -0.9020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9581 -0.1338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0975 -1.0656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4531 1.2694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1086 3.6109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4086 3.6173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 3.1813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4086 3.6245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9655 1.9863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7001 -4.5178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3382 -4.9609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7814 -3.3228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 7 8 2 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 42 1 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 10 44 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 16 17 2 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 32 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 28 2 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 32 33 2 0 0 0 0 32 34 2 0 0 0 0 32 35 1 0 0 0 0 35 59 1 0 0 0 0 35 60 1 0 0 0 0 35 61 1 0 0 0 0 M END