MMs02268114 MOE2007 2D CORINA 3.40 0006 02.08.2006 35 38 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 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2581 1.2850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5162 2.5887 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7580 1.2756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5161 2.5699 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0161 2.5606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7742 3.8549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2742 3.8456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0160 2.5419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2579 1.2475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7580 1.2569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 -0.0374 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7418 -1.3224 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2419 -1.3131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4838 -2.6074 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7418 -1.3411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9837 -2.6355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7256 -3.9392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2255 -3.9485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9836 -2.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2417 -1.3505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4836 -2.6635 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.0075 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0075 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1807 4.8979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8806 4.8810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2160 2.5344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8514 0.2046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7837 -2.6280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1191 -4.9746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8190 -4.9915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8482 -0.3150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 16 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 14 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 2 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 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 32 1 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 21 22 2 0 0 0 0 21 34 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 35 1 0 0 0 0 M END