MMs01076167 MOE2007 2D CORINA 3.40 0006 02.08.2006 34 35 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 0.7554 -1.2959 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -1.2896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2554 -1.2770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5108 -2.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0109 -2.5855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2663 -3.8877 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 6.7554 -1.2707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5108 -2.5666 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4999 0.0314 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 0.0377 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7445 1.3399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2445 1.3462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9890 2.6483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4890 2.6546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2444 1.3587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4999 0.0566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9999 0.0503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7444 1.3650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2444 1.3713 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0367 0.6043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6043 1.0367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0367 -0.6043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3956 1.0493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0956 1.0606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1152 -3.6159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8956 1.0681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1401 2.3766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3847 3.6850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0846 3.6963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1042 -0.9801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4043 -0.9915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 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 29 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 30 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 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 20 34 1 0 0 0 0 21 22 3 0 0 0 0 M END