MMs00191114 MOE2007 2D CORINA 3.40 0006 02.08.2006 37 39 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 -1.5000 0.0081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2429 1.3112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4859 2.6061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 1.2950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7710 3.8930 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.2710 3.8849 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0281 5.1961 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.7429 1.3193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4859 2.6223 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4999 0.0243 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9999 0.0324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8750 1.2507 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.3041 0.7949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3122 -0.7051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8881 -1.1763 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.5305 -1.5802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8975 -0.9627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1157 -1.8378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4827 -1.2203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6315 0.2723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4132 1.1474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0462 0.5299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.9985 0.8898 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.5944 -1.0425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1056 -1.0279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0803 3.6486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9570 1.2885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9056 -1.0181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2711 1.5054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6718 -2.4185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2069 -2.5714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9968 -3.0319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4574 -1.9204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5322 2.3415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0716 1.2300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 18 33 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 34 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 36 1 0 0 0 0 24 37 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M END