MMs00644737 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 42 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 -1.2932 -0.7600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2816 -2.2600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0231 -2.9999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3164 -2.2399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3048 -0.7400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0200 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9730 -0.5795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9680 0.5430 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.2786 -0.6162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2081 1.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7433 1.5130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6209 2.5081 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4610 0.3977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0817 -0.9679 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3333 1.6180 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8262 1.4727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4469 0.1071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9398 -0.0382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8121 1.1821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1915 2.5477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6985 2.6930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0638 3.7680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9361 4.9883 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 13.2841 2.8957 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 10.8435 4.6403 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 13.3051 1.0368 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.5749 -3.0200 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.0093 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3370 -0.1680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0324 -4.1999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3602 -2.8319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3810 -1.6233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9492 -1.2773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3005 2.3327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8284 2.9745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8368 2.7104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7491 -0.8691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4364 -1.1306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2020 3.7854 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 2 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 27 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 M END