MMs00332003 MOE2007 2D CORINA 3.40 0006 02.08.2006 41 44 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 -0.0086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2574 1.2861 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2425 -1.3120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7425 -1.3206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4850 -2.6240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7275 -3.9186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2275 -3.9100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4850 -2.6067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 -2.5980 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7724 -3.8927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0299 -5.1961 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2724 -3.8841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0299 -5.1788 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.5299 -5.1701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4045 -3.9516 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0271 -2.8125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8338 -4.4069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1285 -3.6494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4318 -4.3919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4404 -5.8919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1457 -6.6493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8424 -5.9068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4185 -6.3786 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.7438 -6.6344 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.7248 -5.0391 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0986 -4.4369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9504 -2.9443 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0069 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0069 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3484 -0.2849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6215 -4.9458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6090 -1.5554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0572 -2.7035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3977 -3.4672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1215 -2.4494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4675 -3.7859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1526 -7.8493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4628 -5.5803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2738 -4.1942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 24 2 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 23 2 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 40 1 0 0 0 0 27 41 1 0 0 0 0 M END