D0N3SP Wcorina 10100417253D 1 1.00000 0.00000 CORINA evaluation license 3.40 0067 02.08.2006 42 44 0 1 0 0 0 0 0999 V2000 3.1062 1.4422 1.9743 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.0822 2.9099 1.4595 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -5.1893 -4.3313 2.8695 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.5842 1.8824 0.1515 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8702 0.5961 -1.5009 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2205 2.1624 -2.1174 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0624 0.1340 0.0803 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1678 -0.7417 0.3264 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6440 -0.1799 -1.2997 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6378 -0.5662 1.7718 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7795 -1.5106 2.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5025 2.2007 1.8826 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1272 0.2517 -1.0828 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9723 1.7821 -2.1386 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5337 -2.7410 2.6274 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0727 -1.1439 1.7242 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9529 1.2407 -1.4747 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5804 -3.6076 2.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1202 -2.0093 1.9772 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6233 2.0037 2.6811 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6813 2.6551 2.4525 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8742 -3.2434 2.5524 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5554 2.2549 4.0384 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7412 2.9041 3.8106 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3743 2.7014 4.6025 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8119 -0.0692 0.8452 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9665 -0.4457 -0.3538 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0891 -1.7865 0.1522 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9174 0.0829 -2.0685 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8726 -1.2437 -1.3642 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1863 -0.7847 2.4509 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9710 0.4605 1.9234 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4037 -0.6415 -0.5422 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1563 2.3256 -2.5916 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5237 -3.0253 2.8831 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2645 -0.1809 1.2746 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0181 1.2840 -1.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3882 -4.5691 3.3328 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1305 -1.7227 1.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4257 2.1021 4.6594 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6605 3.2571 4.2541 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3241 2.8962 5.6636 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 2 21 1 0 0 0 0 3 22 1 0 0 0 0 4 7 1 0 0 0 0 4 12 1 0 0 0 0 5 9 1 0 0 0 0 5 13 1 0 0 0 0 5 14 1 0 0 0 0 6 14 2 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 26 1 0 0 0 0 8 10 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 15 2 0 0 0 0 11 16 1 0 0 0 0 12 20 2 0 0 0 0 12 21 1 0 0 0 0 13 17 2 0 0 0 0 13 33 1 0 0 0 0 14 34 1 0 0 0 0 15 18 1 0 0 0 0 15 35 1 0 0 0 0 16 19 2 0 0 0 0 16 36 1 0 0 0 0 17 37 1 0 0 0 0 18 22 2 0 0 0 0 18 38 1 0 0 0 0 19 22 1 0 0 0 0 19 39 1 0 0 0 0 20 23 1 0 0 0 0 21 24 2 0 0 0 0 23 25 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 M END $$$$