D0P3QR Wcorina 11010620253D 1 1.00000 0.00000 0 CORINA evaluation license 3.40 0067 02.08.2006 55 58 0 1 0 999 V2000 0.6158 1.3099 -0.5772 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0999 1.6599 -0.3994 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3219 0.3807 -1.2185 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0205 -0.1011 -0.7193 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7893 7.1978 1.4072 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2872 7.1554 1.4963 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4357 4.3338 0.0756 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1439 4.6750 0.7815 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5508 5.6956 1.8575 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9926 5.8893 1.6633 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4365 5.0427 0.6343 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6982 7.9911 2.6346 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5938 7.4858 2.9773 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5732 9.4484 2.1854 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7758 7.2987 0.5445 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2541 5.4150 2.8681 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5602 8.1058 1.1766 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7882 4.9446 0.2281 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1191 4.1871 -0.8393 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6529 5.5432 0.8411 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1488 5.3003 -0.1981 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6096 3.1780 -1.2429 S 0 0 0 0 0 0 0 0 0 0 0 0 0.2589 -0.7622 -1.7874 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1486 -1.0203 -1.3149 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1308 -0.0689 -1.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4218 -0.3030 -1.0878 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7325 -1.4939 -0.4477 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7453 -2.4469 -0.2431 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4570 -2.2103 -0.6822 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0018 -1.7264 -0.0212 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2491 -2.9741 0.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0148 1.5019 0.3117 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1763 1.7289 -1.4824 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4558 1.5987 0.6291 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3378 0.5516 -2.2949 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1670 -0.2149 -0.8731 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7151 3.7849 1.2419 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3531 7.9338 3.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2300 7.5065 2.2494 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0817 9.5057 1.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1536 10.0438 2.9963 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5587 9.8338 1.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0713 4.1197 -0.9938 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1676 4.5502 -0.9229 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7199 5.6653 0.3498 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 6.1309 -0.7192 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2347 -0.1197 -2.6675 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7361 -1.7087 -2.0415 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8883 0.8582 -2.0181 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1885 0.4406 -1.2479 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9847 -3.3748 0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6881 -2.9519 -0.5233 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0145 -3.7922 -0.0511 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6228 -3.0505 1.5189 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2985 -3.0315 0.9189 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 22 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 23 1 0 0 0 0 5 10 1 0 0 0 0 5 17 2 0 0 0 0 5 6 1 0 0 0 0 6 12 1 0 0 0 0 6 15 1 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 22 1 0 0 0 0 7 11 2 0 0 0 0 8 21 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 11 18 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 38 1 0 0 0 0 13 39 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 18 19 1 0 0 0 0 18 20 2 0 0 0 0 19 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 2 0 0 0 0 24 29 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 30 1 0 0 0 0 28 29 2 0 0 0 0 28 51 1 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 M END $$$$