D00RJE Wcorina 11010620293D 1 1.00000 0.00000 0 CORINA evaluation license 3.40 0067 02.08.2006 48 51 0 0 0 999 V2000 -0.0179 1.4680 0.0101 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0021 -0.0041 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1866 2.1886 0.0025 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1558 -0.6938 0.0094 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2375 2.1534 0.0196 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1603 3.5716 0.0097 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 -2.1586 0.0013 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1534 -3.5077 1.7735 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2527 3.5290 0.0267 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0554 4.2437 0.0244 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9895 -2.6777 1.4346 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7871 1.4188 -0.0341 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3731 1.5307 -0.0115 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1585 2.0851 -0.1618 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7248 1.4770 1.1735 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0635 -0.5978 -0.0113 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4512 -2.6873 -0.5847 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4192 -4.2205 -0.5538 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6091 -2.2042 0.2979 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3944 -2.7226 1.7227 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2379 -4.6824 0.8948 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5579 2.3296 -0.0185 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0784 5.6348 0.0321 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7671 4.3776 0.0378 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.0023 -0.2203 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1667 1.6028 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0852 4.1291 0.0042 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2982 -2.5092 -0.6015 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0813 -3.2752 1.5139 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9316 -1.8343 2.1227 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6500 0.4523 -0.5191 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9237 1.5568 -0.7305 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1850 3.1723 -0.2347 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4659 2.1642 1.9791 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2047 0.5486 1.4833 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5734 -2.3354 -1.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3564 -4.6134 -0.9479 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5870 -4.5807 -1.1588 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6326 -1.1145 0.3054 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5511 -2.5890 -0.0927 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2356 -3.3530 2.0109 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3196 -1.8792 2.4091 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3210 -5.2659 0.9785 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0886 -5.2968 1.1898 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5800 2.9546 0.8742 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5637 2.9630 -0.9056 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9264 6.1058 0.0389 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7535 6.1336 0.0305 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 5 2 0 0 0 0 2 4 1 0 0 0 0 2 16 2 0 0 0 0 3 6 2 0 0 0 0 3 13 1 0 0 0 0 4 7 1 0 0 0 0 4 25 1 0 0 0 0 5 9 1 0 0 0 0 5 26 1 0 0 0 0 6 10 1 0 0 0 0 6 27 1 0 0 0 0 7 11 1 0 0 0 0 7 17 1 0 0 0 0 7 28 1 0 0 0 0 8 11 1 0 0 0 0 8 20 1 0 0 0 0 8 21 1 0 0 0 0 9 10 2 0 0 0 0 9 24 1 0 0 0 0 10 23 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 22 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 12 31 1 0 0 0 0 13 22 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 36 1 0 0 0 0 18 21 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 M END $$$$