D0B0QX Wcorina 11010620303D 1 1.00000 0.00000 0 CORINA evaluation license 3.40 0067 02.08.2006 43 45 0 0 0 999 V2000 -0.0395 1.5492 -0.0043 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0646 0.0206 -0.0635 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3084 2.2228 0.0178 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4540 0.8404 -1.2952 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6098 3.1348 1.0162 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8687 3.7592 1.0316 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3140 -1.9456 0.3497 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4992 -2.5867 0.3213 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2237 -0.6763 -0.0944 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6164 -3.8603 0.8766 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5887 -4.3925 1.5184 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8058 3.4524 0.0364 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2454 1.9253 -0.9558 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1993 4.7266 2.0829 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3264 -2.5122 0.7761 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4892 2.5444 -0.9472 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3850 4.9899 2.9427 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6943 3.4238 1.9738 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6570 -5.5944 2.0586 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8136 -6.3449 1.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9473 1.0309 -1.9235 F 0 0 0 0 0 0 0 0 0 0 0 0 3.8100 -4.5613 0.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8988 -8.0630 2.7573 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.9150 -5.8218 1.3064 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5506 5.3936 2.0952 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6367 6.3495 3.2867 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8215 2.0434 0.5723 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8630 -0.4909 0.4741 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5089 0.8682 -1.5683 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2482 0.8611 -2.1286 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2706 -2.1622 -0.0856 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0116 -0.2243 -0.4346 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7737 3.9314 0.0388 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2123 2.3086 -1.7139 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7467 2.8536 2.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7980 -5.9964 2.5753 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6452 -4.1261 0.2175 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8326 -6.3861 1.2286 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3292 4.6355 2.1805 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6881 5.9530 1.1699 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8581 7.1075 3.2013 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4992 5.7901 4.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6140 6.8319 3.2956 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 4 1 0 0 0 0 1 27 1 0 0 0 0 2 9 1 0 0 0 0 2 4 1 0 0 0 0 2 28 1 0 0 0 0 3 5 1 0 0 0 0 3 13 2 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 18 1 0 0 0 0 6 14 1 0 0 0 0 6 12 1 0 0 0 0 7 9 1 0 0 0 0 7 8 1 0 0 0 0 7 15 2 0 0 0 0 8 10 1 0 0 0 0 8 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 22 1 0 0 0 0 11 19 1 0 0 0 0 12 16 2 0 0 0 0 12 33 1 0 0 0 0 13 16 1 0 0 0 0 13 21 1 0 0 0 0 14 17 2 0 0 0 0 14 25 1 0 0 0 0 16 34 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 24 1 0 0 0 0 20 23 1 0 0 0 0 22 24 2 0 0 0 0 22 37 1 0 0 0 0 24 38 1 0 0 0 0 25 26 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 M END $$$$