MMs00598308 MOE2007 2D CORINA 3.40 0006 02.08.2006 22 22 0 0 1 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 0.7608 -1.2928 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4392 -1.2928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2607 -1.2803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 0.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4998 0.0374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2606 -1.2553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5215 -2.5606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0215 -2.5730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7606 -1.2429 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.0216 -2.5980 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4783 -2.6105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2175 -3.9157 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0342 0.6086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6086 1.0342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0342 -0.6086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3913 1.0592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0912 1.0816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1301 -3.5948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4302 -3.6172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6302 -3.6322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0870 -1.5763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 11 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 17 1 0 0 0 0 6 7 1 0 0 0 0 6 18 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 19 1 0 0 0 0 9 20 1 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 12 13 2 0 0 0 0 12 22 1 0 0 0 0 M END