D0T3DG Wcorina 10100417273D 1 1.00000 0.00000 CORINA evaluation license 3.40 0067 02.08.2006 38 40 0 1 0 0 0 0 0999 V2000 0.8939 6.4391 2.7293 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.7238 8.0067 0.0354 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.9050 -2.8551 -0.9675 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.0173 1.4248 0.0099 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1958 -2.9145 -2.6274 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7217 -0.9164 -1.8437 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9976 -0.0146 3.1277 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3483 1.1797 1.8500 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0075 -1.9716 1.1242 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3694 -0.4837 -0.3095 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.6921 -0.4669 -1.6911 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.5587 -1.6566 -1.2735 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.2377 -0.5739 0.7350 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1725 -0.5475 -1.4379 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0021 -0.0041 0.0020 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.9047 -1.8017 -1.9356 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5688 0.2615 1.9448 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2801 2.0237 0.0007 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1407 3.5242 0.0101 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0883 4.2055 1.2114 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0711 4.2191 -1.1832 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9604 5.5830 1.2205 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9438 5.5953 -1.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8850 6.2782 0.0257 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2164 0.1648 -0.0856 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0401 0.1940 -2.4849 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1704 -1.5803 -1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3666 0.0778 -2.1496 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9221 -0.3789 0.4505 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2684 -2.0396 1.8076 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8565 -2.3962 1.4664 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8338 1.7047 0.8837 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8168 1.7143 -0.8961 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0717 -2.9618 -3.0344 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2410 0.5489 3.8749 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1468 3.6624 2.1432 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1166 3.6863 -2.1215 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8901 6.1375 -2.1085 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 2 24 1 0 0 0 0 12 3 1 0 0 0 0 15 4 1 0 0 0 0 4 18 1 0 0 0 0 5 16 1 0 0 0 0 5 34 1 0 0 0 0 6 16 2 0 0 0 0 7 17 1 0 0 0 0 7 35 1 0 0 0 0 8 17 2 0 0 0 0 13 9 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 11 26 1 0 0 0 0 12 16 1 0 0 0 0 13 15 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 14 28 1 0 0 0 0 15 29 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 20 22 1 0 0 0 0 20 36 1 0 0 0 0 21 23 2 0 0 0 0 21 37 1 0 0 0 0 22 24 2 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 M END $$$$