D0D3WJ Wcorina 10100417253D 1 1.00000 0.00000 CORINA evaluation license 3.40 0067 02.08.2006 32 33 0 1 0 0 0 0 0999 V2000 -6.1704 -4.6178 -0.2630 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.0024 1.4189 -0.0511 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4703 0.7315 -0.6849 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8592 4.1877 0.2804 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5096 0.6505 -2.5348 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1264 -1.8839 -2.9688 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1178 -0.5444 -0.7828 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3147 -0.5918 -2.8036 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0781 0.8347 -0.9899 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0134 -0.0181 -0.0149 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3388 -0.4821 -0.6495 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 1.8511 -0.0508 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4994 3.2706 -0.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9735 -1.4291 -0.1911 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2945 -0.1426 -2.0518 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0288 -1.9215 -0.9041 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2006 -1.4732 -2.2938 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9730 -2.8801 -0.2951 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0577 -3.2575 -0.9612 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9298 1.1050 -2.0354 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0468 -0.3633 1.0172 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1472 -1.0573 -1.5554 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9169 -1.0712 0.0624 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7992 1.7962 0.9539 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0199 3.3180 -1.5868 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5522 3.5349 -0.7075 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9324 0.0443 -1.1842 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8166 -1.7369 0.8321 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4141 -0.2813 -3.7171 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8961 5.1090 -0.0111 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7811 -3.2740 0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3045 -2.7877 -1.9018 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 2 10 1 0 0 0 0 2 12 1 0 0 0 0 9 3 1 0 0 0 0 3 27 1 0 0 0 0 4 13 1 0 0 0 0 4 30 1 0 0 0 0 5 15 2 0 0 0 0 6 17 2 0 0 0 0 10 7 1 0 0 0 0 7 14 1 0 0 0 0 7 15 1 0 0 0 0 8 15 1 0 0 0 0 8 17 1 0 0 0 0 8 29 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 10 21 1 0 0 0 0 11 22 1 0 0 0 0 11 23 1 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 13 25 1 0 0 0 0 13 26 1 0 0 0 0 14 16 2 0 0 0 0 14 28 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 31 1 0 0 0 0 19 32 1 0 0 0 0 M END $$$$