D0I5QK Wcorina 11010620253D 1 1.00000 0.00000 0 CORINA evaluation license 3.40 0067 02.08.2006 47 51 0 0 0 999 V2000 -0.0167 1.3807 0.0096 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 1.2101 -0.6791 -0.0131 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3986 0.0309 -0.0206 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3774 1.4152 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1702 2.0884 0.0021 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5546 2.2406 0.0216 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.3405 1.6430 1.0436 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2400 3.6260 -0.0071 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3155 1.9041 -1.4103 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6780 0.1081 -3.0024 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7256 0.5962 -1.6945 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1840 -0.2320 -0.6815 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5826 -1.5324 -1.0162 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5046 -1.9436 -2.3448 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0628 -1.1255 -3.2796 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2510 -2.1197 1.7585 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.8784 -3.7286 2.1477 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9156 -4.4009 0.9662 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4788 -3.6794 -0.1377 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0791 -2.4565 0.0271 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3121 -4.5050 3.1166 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6440 -5.6948 2.6134 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4104 -5.6700 1.2724 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3581 -6.6274 -1.0432 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6384 -6.7752 0.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1433 -8.0122 0.7534 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3294 -8.9986 -0.1961 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0345 -8.7613 -1.4617 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5729 -7.6343 -1.8640 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2361 0.9127 -4.0021 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2103 0.3572 -5.3185 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5786 -0.6268 -0.0350 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.1584 -0.6957 0.0098 F 0 0 0 0 0 0 0 0 0 0 0 0 1.2257 -1.7590 -0.0187 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3044 1.9693 -0.0189 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1546 3.1683 0.0084 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4770 2.6133 -2.0521 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2322 0.1166 0.3396 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8094 -2.9446 -2.6123 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0308 -6.5334 3.1733 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9725 -5.6918 -1.4204 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3781 -8.1870 1.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7156 -9.9638 0.0965 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5552 -0.5139 -5.3324 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2182 0.0586 -5.6067 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8377 1.1033 -6.0204 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 7 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 12 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 11 31 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 21 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 22 2 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 20 21 2 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 26 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 25 42 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 43 1 0 0 0 0 28 29 2 0 0 0 0 28 44 1 0 0 0 0 29 30 1 0 0 0 0 31 32 1 0 0 0 0 32 45 1 0 0 0 0 32 46 1 0 0 0 0 32 47 1 0 0 0 0 M END $$$$