MMs02160366 MOE2007 2D CORINA 3.40 0006 02.08.2006 25 25 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 -0.0027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2523 1.2950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5047 2.5954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0047 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7476 1.3004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7430 3.8985 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.2570 3.8930 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.7523 1.2923 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 -0.0081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7476 -1.3058 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.0000 -0.0108 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7476 -1.3112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2476 -1.3140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9953 -2.6143 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6019 -1.0381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0981 -1.0430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9476 1.3026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3542 2.3304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6019 1.0273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6193 -1.7196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9539 -2.4934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0414 -0.1318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3760 -0.9056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1953 -2.6165 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 16 1 0 0 0 0 2 3 2 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 18 1 0 0 0 0 9 10 1 0 0 0 0 9 19 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 20 1 0 0 0 0 13 14 1 0 0 0 0 13 21 1 0 0 0 0 13 22 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 14 24 1 0 0 0 0 15 25 1 0 0 0 0 M END