MMs03068450 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 61 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 0.7478 -1.3003 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2478 -1.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2478 -1.3078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4957 -2.6055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9957 -2.6031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7478 -1.3102 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1478 -0.2710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 -0.0124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7521 1.2878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5043 2.5856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0043 2.5831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7521 1.2829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 -0.0149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7478 -1.3152 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2478 -1.3177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9957 -2.6180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4957 -2.6205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2435 -3.9208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4914 -5.2186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9914 -5.2161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2435 -3.9158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9872 -2.7698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2966 -4.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9963 -4.9854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8833 -3.9798 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5727 -5.1389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4156 -4.2893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9497 -5.7151 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0402 0.5983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5983 1.0402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0402 -0.5983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4017 1.0352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1017 1.0308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0940 -3.6458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 -3.6413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5521 1.2898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9060 3.6258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6060 3.6214 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9521 1.2809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0414 -0.1356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3761 -0.9092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0974 -1.5822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4435 -3.9228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0896 -6.2588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3896 -6.2543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6435 -3.9148 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1808 -2.6463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9892 -1.5698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8676 -4.0531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7829 -5.3346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7001 -5.9574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1032 -5.7868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4957 -2.6105 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4137 -3.1729 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2395 -3.4204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 56 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 14 15 2 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 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 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 25 56 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 56 1 0 0 0 0 30 31 2 0 0 0 0 30 57 1 0 0 0 0 57 58 1 0 0 0 0 M END