D0Q9OR Wcorina 08120616573D 1 1.00000 0.00000 0 CORINA evaluation license 3.40 0067 02.08.2006 34 35 0 0 0 999 V2000 -0.0162 1.3436 0.0094 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1893 0.0119 -0.0217 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0704 2.2164 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2995 1.7322 0.0986 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7771 -0.6054 -0.1919 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.8551 -0.8337 0.0812 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9515 -2.9964 0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5543 -3.3640 -0.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6316 -2.2812 0.0474 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3558 2.5229 0.1093 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2138 3.8953 0.0366 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8531 3.5874 -0.0639 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6118 4.9243 0.0583 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.9399 4.4433 -0.0491 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4880 -3.2328 1.5614 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8764 -4.0735 -0.9332 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9799 -3.5670 1.4973 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1869 -4.6643 0.4438 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9204 1.6946 0.0218 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7546 -0.4840 0.1776 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0762 -3.1462 -1.8486 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1636 -2.5546 -0.8983 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0212 -2.5674 0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3438 2.0918 0.1761 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 3.9791 -0.1337 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8013 5.5130 -0.1027 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9512 -4.0631 2.0203 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3443 -2.3355 2.1633 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6596 -3.3672 -1.2083 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8404 -4.8753 -1.6706 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3176 -3.9238 2.4703 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5428 -2.6776 1.2141 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2214 -5.0069 0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5161 -5.4989 0.6474 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 19 1 0 0 0 0 2 5 2 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 12 1 0 0 0 0 4 10 1 0 0 0 0 6 9 1 0 0 0 0 6 20 1 0 0 0 0 7 9 1 0 0 0 0 7 8 2 0 0 0 0 7 15 1 0 0 0 0 8 16 1 0 0 0 0 8 21 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 10 11 2 0 0 0 0 10 24 1 0 0 0 0 11 14 1 0 0 0 0 11 13 1 0 0 0 0 12 14 2 0 0 0 0 12 25 1 0 0 0 0 14 26 1 0 0 0 0 15 17 1 0 0 0 0 15 27 1 0 0 0 0 15 28 1 0 0 0 0 16 18 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 M END $$$$