MMs01311349 MOE2007 2D CORINA 3.40 0006 02.08.2006 47 49 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 0.7574 -1.2947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0148 -2.5980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7722 -3.8928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2722 -3.8842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0295 -5.1790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2869 -6.4823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 -6.4908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0296 -5.1961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4704 -5.2046 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.4618 -6.7046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4789 -3.7046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9704 -5.2132 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7130 -6.5164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2129 -6.5250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9703 -5.2302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4703 -5.2388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2129 -6.5421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4555 -7.8368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9555 -7.8283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9556 -7.8112 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4629 -7.9595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1427 -9.4249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4374 -10.1823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5579 -9.1850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0443 -7.7770 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0358 0.6059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6059 1.0358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0358 -0.6059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6722 -0.5182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6810 -2.0608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8662 -2.8416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2295 -5.1722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1929 -7.5334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3762 -4.1876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0762 -4.2030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4129 -6.5489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0496 -8.8794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3496 -8.8641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4663 -7.3595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2702 -7.8273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0036 -9.0476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6484 -10.5184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7266 -11.1491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3246 -10.9903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6005 -8.5909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2577 -10.1598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 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 33 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 34 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 21 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 M END