MMs00633289 MOE2007 2D CORINA 3.40 0006 02.08.2006 28 29 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 1.4864 -0.2017 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1969 -1.5227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6729 -1.2552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8745 0.2312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5232 0.8823 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1956 0.9417 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4714 0.1529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4262 -1.3464 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.7925 0.8635 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0683 0.0747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0231 -1.4246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2990 -2.2134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6200 -1.5029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6652 -0.0036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3894 0.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4345 2.2845 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 12.8959 -2.2917 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.1613 1.1891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1891 0.1613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1613 -1.1891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6760 -2.6038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5400 -2.0846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2317 2.1412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8286 2.0629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9663 -1.9931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2628 -3.4129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7220 0.5648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 25 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 26 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 16 17 1 0 0 0 0 M END