D0B3TA Wcorina 11010620263D 1 1.00000 0.00000 0 CORINA evaluation license 3.40 0067 02.08.2006 85 88 0 1 0 999 V2000 0.4777 1.9512 -0.0789 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5795 0.5859 0.5820 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7089 -1.6776 0.2224 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8573 2.6537 0.0109 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6583 -0.2057 -0.1530 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7454 -2.0441 1.3427 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5428 4.0561 -0.4442 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 4.3221 0.0123 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.3931 2.9934 0.6508 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0111 0.4783 -0.1806 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8849 1.8915 -0.7898 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7422 -0.1714 0.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3475 4.8841 -1.1018 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7585 -3.5636 1.5643 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1236 -2.0839 0.6486 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9549 6.2861 -1.3014 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6687 -1.5621 1.0797 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7254 4.7115 -1.1018 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8387 5.4040 -0.8145 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1689 -4.0088 1.9551 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9393 6.7118 -0.7873 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1894 -3.5894 0.9024 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1513 5.5947 0.3370 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8486 4.9917 -1.6307 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0659 4.0730 -1.1181 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0078 1.8457 -1.5322 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9092 0.7873 2.0638 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3422 -2.4728 -1.0473 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5914 0.5833 1.1134 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7213 7.0999 -2.0546 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7262 4.4583 -0.5456 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5170 -3.4366 3.2188 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6626 4.3855 -1.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1916 -3.9075 2.7212 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6988 5.9438 -1.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4543 6.4443 -1.5568 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1425 4.5949 -2.2937 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1896 2.7195 1.0507 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1135 -1.6179 2.2884 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3398 -0.2331 -1.2311 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6182 2.2645 -1.0973 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.1105 5.1096 0.7707 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4461 2.8356 0.4175 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2248 3.0069 1.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6877 -0.0969 -0.8241 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6114 1.8220 -1.8376 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8569 2.3926 -0.7105 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5286 0.4035 0.9595 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0175 -0.2827 -0.5932 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4273 -4.0914 0.6781 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8315 -1.8206 -0.1362 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3857 -1.5631 1.5712 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1800 -2.2707 0.4143 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2341 -1.5427 2.0224 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1803 -5.0998 2.0499 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0382 -4.1479 -0.0169 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1951 -3.8315 1.2768 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9755 1.3764 -1.5629 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0517 2.8429 -1.9681 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7162 1.2425 -2.1001 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1935 1.4817 2.5041 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8526 -0.1699 2.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9160 1.1937 2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0605 -2.2493 -1.8361 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3650 -3.5400 -0.8268 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3419 -2.1910 -1.3762 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4729 0.9809 1.1181 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4224 8.0138 -2.1571 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4645 3.7724 0.2601 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7767 5.4748 -0.1554 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4006 -3.6771 3.5295 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5514 3.3527 -1.9733 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9672 5.0058 -2.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2011 -3.5808 2.4717 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1887 -4.9850 2.8858 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1407 -3.4007 3.6272 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4495 5.2017 -2.1996 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1936 6.8563 -1.5953 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0753 6.1639 -2.7946 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8962 6.8960 -0.6686 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8131 6.9638 -2.4454 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3686 6.5238 -1.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2555 3.5116 -2.2507 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1313 4.9180 -3.3347 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9764 5.0680 -1.7753 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 9 1 0 0 0 0 1 26 1 0 0 0 0 2 5 1 0 0 0 0 2 12 1 0 0 0 0 2 27 1 0 0 0 0 3 5 1 0 0 0 0 3 15 1 0 0 0 0 3 28 1 0 0 0 0 3 6 1 0 0 0 0 4 7 1 0 0 0 0 4 11 1 0 0 0 0 4 38 1 0 0 0 0 5 40 1 0 0 0 0 5 10 1 0 0 0 0 6 17 1 0 0 0 0 6 14 1 0 0 0 0 6 39 1 0 0 0 0 7 13 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 18 1 0 0 0 0 8 42 1 0 0 0 0 9 43 1 0 0 0 0 9 44 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 10 45 1 0 0 0 0 11 46 1 0 0 0 0 11 47 1 0 0 0 0 12 17 1 0 0 0 0 12 48 1 0 0 0 0 12 49 1 0 0 0 0 13 16 1 0 0 0 0 13 33 1 0 0 0 0 14 20 1 0 0 0 0 14 34 1 0 0 0 0 14 50 1 0 0 0 0 15 22 1 0 0 0 0 15 51 1 0 0 0 0 15 52 1 0 0 0 0 16 21 2 0 0 0 0 16 30 1 0 0 0 0 17 53 1 0 0 0 0 17 54 1 0 0 0 0 18 19 1 0 0 0 0 19 23 2 0 0 0 0 19 35 1 0 0 0 0 20 32 1 0 0 0 0 20 22 1 0 0 0 0 20 55 1 0 0 0 0 22 56 1 0 0 0 0 22 57 1 0 0 0 0 24 25 2 0 0 0 0 24 36 1 0 0 0 0 24 37 1 0 0 0 0 25 31 1 0 0 0 0 25 41 1 0 0 0 0 26 58 1 0 0 0 0 26 59 1 0 0 0 0 26 60 1 0 0 0 0 27 61 1 0 0 0 0 27 62 1 0 0 0 0 27 63 1 0 0 0 0 28 64 1 0 0 0 0 28 65 1 0 0 0 0 28 66 1 0 0 0 0 29 67 1 0 0 0 0 30 68 1 0 0 0 0 31 33 1 0 0 0 0 31 69 1 0 0 0 0 31 70 1 0 0 0 0 32 71 1 0 0 0 0 33 72 1 0 0 0 0 33 73 1 0 0 0 0 34 74 1 0 0 0 0 34 75 1 0 0 0 0 34 76 1 0 0 0 0 35 77 1 0 0 0 0 35 78 1 0 0 0 0 35 79 1 0 0 0 0 36 80 1 0 0 0 0 36 81 1 0 0 0 0 36 82 1 0 0 0 0 37 83 1 0 0 0 0 37 84 1 0 0 0 0 37 85 1 0 0 0 0 M END $$$$