D0X0PW Wcorina 11010620293D 1 1.00000 0.00000 0 CORINA evaluation license 3.40 0067 02.08.2006 38 41 0 0 0 999 V2000 -0.3454 1.3855 0.4574 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8059 2.0532 0.0682 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8512 3.4321 0.0581 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2690 4.1704 0.4427 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4808 2.1021 0.8405 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4398 3.4992 0.8385 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7058 1.7064 1.2573 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4946 2.7602 1.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7680 3.9396 1.2926 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3752 5.1711 1.5044 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6217 5.2322 1.9290 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3348 4.1451 2.1672 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8063 2.8847 1.9876 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3705 0.0281 0.4607 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8226 -0.6438 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2251 5.6425 0.4345 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9306 6.2837 0.6983 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2319 6.2795 0.1897 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9895 7.6776 0.6211 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6731 8.4188 1.5841 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7080 9.7949 1.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1049 10.4078 0.4699 N 0 3 0 0 0 0 0 0 0 0 0 0 0.4478 9.7410 -0.4614 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3712 8.3626 -0.4241 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4953 7.4958 -1.6535 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.4688 7.6231 2.9060 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.1382 -0.2768 -1.2606 F 0 0 0 0 0 0 0 0 0 0 0 0 1.8742 -0.2852 0.9022 F 0 0 0 0 0 0 0 0 0 0 0 0 1.1643 11.8204 0.3919 O 0 5 0 0 0 0 0 0 0 0 0 0 1.6764 1.4879 -0.2299 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7540 3.9404 -0.2471 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8239 6.0815 1.3209 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3525 4.2465 2.5141 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4038 2.0069 2.1845 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6675 -1.7216 0.1006 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7214 5.7776 0.9418 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2348 10.3770 2.2136 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0322 10.2802 -1.2647 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 16 1 0 0 0 0 4 6 1 0 0 0 0 5 7 1 0 0 0 0 5 6 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 8 13 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 15 27 1 0 0 0 0 15 28 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 18 2 0 0 0 0 17 19 1 0 0 0 0 17 36 1 0 0 0 0 19 20 2 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 26 1 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 29 1 0 0 0 0 23 24 2 0 0 0 0 23 38 1 0 0 0 0 24 25 1 0 0 0 0 M CHG 2 22 1 29 -1 M END $$$$