MMs02593456 MOE2007 2D CORINA 3.40 0006 02.08.2006 32 34 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 0.0094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2581 -1.2849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5162 -2.5886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0163 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7419 -1.3037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7256 -3.9017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2256 -3.9111 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2743 -3.8830 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7743 -3.8736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6484 -2.6545 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0778 -3.1091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2858 -2.2199 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0872 -4.6091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3062 -5.4832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6727 -4.8645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9754 -3.3954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4662 -3.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0848 -4.5957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9764 -5.6064 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.5540 -4.8984 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -4.6636 -5.0816 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6065 1.0355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0935 1.0524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4581 -1.2774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9418 -1.3112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6809 -4.9259 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1883 -6.6774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1669 -2.5086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0597 -2.1863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0325 -5.1961 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5610 -6.2390 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 25 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 10 11 2 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 29 1 0 0 0 0 18 19 2 0 0 0 0 18 30 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 31 32 1 0 0 0 0 M END