MMs00651667 MOE2007 2D CORINA 3.40 0006 02.08.2006 30 31 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 -0.7410 -1.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0179 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5179 -2.5877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2589 -1.2835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.0103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7589 -1.2732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5178 -2.5670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0310 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 0.0413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7588 -1.2525 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.7409 1.3455 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2409 1.3558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9819 2.6600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4819 2.6703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2408 1.3765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4998 0.0723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9998 0.0620 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2230 3.9538 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2768 -3.8815 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.6071 1.0351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9410 -1.3124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5749 -3.6414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0928 1.0537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8928 1.0661 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1338 2.3806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0747 3.7136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4408 1.3847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1069 -0.9628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8158 4.9972 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 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 25 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 26 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 27 1 0 0 0 0 16 17 2 0 0 0 0 16 28 1 0 0 0 0 17 18 1 0 0 0 0 17 29 1 0 0 0 0 19 30 1 0 0 0 0 M END