D0H3CW Wcorina 10100417273D 1 1.00000 0.00000 CORINA evaluation license 3.40 0067 02.08.2006 27 29 0 1 0 0 0 0 0999 V2000 1.6724 3.6867 -0.1008 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.3281 -4.3463 0.2278 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0162 1.3429 0.0094 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1620 0.3213 1.2749 N 0 0 3 0 0 0 0 0 0 0 0 0 3.2048 -1.9595 0.7018 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3358 -0.3749 0.1662 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6074 -0.9469 1.7797 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6294 0.8087 0.0101 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7674 -1.6737 0.3206 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1257 0.8653 0.0715 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0021 -0.0041 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2426 1.8479 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8425 -2.6817 0.1443 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1093 1.3664 2.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9179 -1.0342 -0.1567 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4862 -2.3453 -0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8484 -1.8465 -0.1706 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2887 -2.9723 1.0959 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3506 -1.4126 2.4269 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7281 -0.7205 2.3828 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0211 1.8066 -0.1868 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9335 0.1376 -0.7931 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6903 1.0512 3.1727 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5248 2.2917 1.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0738 1.5316 2.6033 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9617 -0.8113 -0.3212 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2043 -3.1372 -0.2559 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 2 13 1 0 0 0 0 3 11 1 0 0 0 0 3 12 1 0 0 0 0 4 7 1 0 0 0 0 4 8 1 0 0 0 0 4 14 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 5 17 1 0 0 0 0 5 18 1 0 0 0 0 6 9 1 0 0 0 0 6 10 1 0 0 0 0 6 11 2 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 8 10 1 0 0 0 0 8 21 1 0 0 0 0 8 22 1 0 0 0 0 9 13 2 0 0 0 0 10 12 2 0 0 0 0 11 15 1 0 0 0 0 13 16 1 0 0 0 0 14 23 1 0 0 0 0 14 24 1 0 0 0 0 14 25 1 0 0 0 0 15 16 2 0 0 0 0 15 26 1 0 0 0 0 16 27 1 0 0 0 0 M END $$$$