MMs03539952 MOE2007 2D CORINA 3.40 0006 02.08.2006 38 39 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 -0.7613 -1.2925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0226 -2.5980 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4774 -2.6110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2386 -1.3185 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2161 -3.9165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7160 -3.9295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4547 -5.2350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6934 -6.5275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1935 -6.5145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4548 -5.2090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0451 -5.1960 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7838 -3.8905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2838 -3.8774 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.0450 -5.1699 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6450 -6.2091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3063 -6.4754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5450 -5.1569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2837 -3.8514 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3062 -6.4493 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8062 -6.4363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5449 -5.1308 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5674 -7.7288 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0340 -0.6090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 1.0340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0340 0.6090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6738 -0.5132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6872 -2.0558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3250 -2.8956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6546 -5.2455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2844 -7.5719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5845 -7.5485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3507 -7.0663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7154 -7.5198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2619 -5.8844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7153 -7.4937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7674 -7.7184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9765 -8.7732 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 13 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 2 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 M END