MMs01319625 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 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 1.3749 -0.5997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6979 -2.0645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1909 -2.2099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7905 -0.8350 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6682 0.1602 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2553 -0.5120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2675 -1.6190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7323 -1.2960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1850 0.1341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1728 1.2411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7080 0.9181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9507 -3.5032 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.7027 -3.1868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7668 -2.8861 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2412 -1.4631 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7107 -1.1624 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.4100 0.3072 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0114 -2.6319 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1803 -0.8617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1755 -1.9840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6450 -1.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1194 -0.2603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1242 0.8620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6546 0.5613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5889 0.0404 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.4797 1.0999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0999 0.4797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4797 -1.0999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9054 -2.7631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5420 -2.1817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3568 0.3925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5349 2.3852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8983 1.8037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0822 -4.3252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4450 -0.5652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7960 -3.1224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4412 -2.5811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5037 2.0005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8585 1.4592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 6 2 0 0 0 0 3 4 2 0 0 0 0 3 14 1 0 0 0 0 4 5 1 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 34 1 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 25 40 1 0 0 0 0 M END