D04IDW Wcorina 11010620263D 1 1.00000 0.00000 0 CORINA evaluation license 3.40 0067 02.08.2006 52 55 0 0 0 999 V2000 -0.3677 0.4666 1.4182 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6966 -0.1990 0.6342 P 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -0.7211 -0.7619 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9570 2.7725 -0.5116 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6676 2.1184 -0.2751 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6262 2.6211 -1.6863 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7831 3.2594 -1.8032 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0081 4.1162 -0.2683 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5342 3.5602 0.4276 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0584 7.4809 -7.7811 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2798 7.4299 -6.7302 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3568 6.4619 -5.8341 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2439 5.4834 -5.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3770 4.3894 -7.5771 S 0 0 0 0 0 0 0 0 0 0 0 0 8.7155 5.3552 -9.0037 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9145 6.4077 -9.0583 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9948 6.5303 -8.0049 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1033 5.4922 -7.0771 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3213 4.4709 -5.0236 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4192 4.4742 -3.8693 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7110 3.2561 -2.9906 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0597 3.8457 1.6382 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9577 3.2367 2.0844 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0275 2.1092 2.5422 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7688 3.8690 2.0285 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3751 3.2547 2.5486 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6121 3.4736 1.9572 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7406 2.8646 2.4736 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6376 2.0377 3.5784 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4067 1.8188 4.1692 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2750 2.4199 3.6544 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2881 3.1376 1.7358 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.8841 0.8486 0.3437 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2755 -1.4487 1.4681 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7459 -1.1006 -1.3604 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0583 2.7422 0.3789 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1525 1.9765 -1.2252 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2343 2.0098 -2.4857 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5456 8.2096 -6.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4737 5.1224 -9.7367 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9657 7.1269 -9.8624 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9727 3.7598 -5.1281 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5731 5.3849 -3.2905 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3864 4.4337 -4.2152 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7438 3.2966 -2.6447 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5571 2.3454 -3.5694 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7064 4.7500 1.6275 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6926 4.1192 1.0952 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5204 1.5628 3.9803 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3295 1.1732 5.0316 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6859 2.2479 4.1163 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6135 -2.1212 1.6791 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 3 35 1 0 0 0 0 4 9 1 0 0 0 0 4 6 1 0 0 0 0 4 5 1 0 0 0 0 5 33 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 2 0 0 0 0 6 38 1 0 0 0 0 7 21 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 22 2 0 0 0 0 10 17 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 13 18 1 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 31 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 0 0 0 0 28 32 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 30 31 2 0 0 0 0 30 50 1 0 0 0 0 31 51 1 0 0 0 0 34 52 1 0 0 0 0 M END $$$$