MMs02140087 MOE2007 2D CORINA 3.40 0006 02.08.2006 33 35 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 -1.3028 0.7434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3104 2.2434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0152 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2876 2.2566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2952 0.7566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7624 -1.4778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2312 -1.7822 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9746 -0.4794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9653 0.6302 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6133 2.9868 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9085 2.2302 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.1519 0.9350 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6650 3.5254 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2037 1.4736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5065 2.2170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8017 1.4605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7941 -0.0395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4913 -0.7829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1961 -0.0263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0893 -0.7961 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0061 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3390 0.1381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0213 4.1999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3238 2.8618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8747 -2.2853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1674 -0.3479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6193 4.1868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5126 3.4170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8440 2.0552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4852 -1.9829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1538 -0.6211 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 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 12 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 21 33 1 0 0 0 0 M END