D0OH1O Wcorina 11010620323D 1 1.00000 0.00000 0 CORINA evaluation license 3.40 0067 02.08.2006 59 61 0 0 0 999 V2000 -0.4996 1.4517 -1.1109 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4411 -7.0980 6.9117 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.3424 -0.6864 -0.4953 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2899 0.1166 -0.7480 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3059 1.7586 -2.1991 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0934 2.4728 -0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7620 -6.6860 5.5265 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1417 -1.9815 -0.1809 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4678 -6.6312 7.4759 O 0 5 0 0 0 0 0 0 0 0 0 0 -5.1503 -7.9038 7.4871 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4730 -0.2424 -0.5510 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7447 -5.4243 1.2890 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.8711 -7.2125 4.8896 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9555 -5.7709 4.8746 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9568 0.6539 -2.9909 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9644 2.1445 0.8051 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2290 -2.7949 0.1665 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3624 -5.9152 2.9375 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3776 -4.4019 0.8527 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1737 -6.8302 3.5977 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2520 -5.3839 3.5827 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3168 -2.2507 0.8365 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2206 -4.1435 -0.1643 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2915 -4.9448 0.1774 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3879 -3.0514 1.1789 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1155 3.7895 -0.7407 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5109 3.0773 -2.5547 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9146 4.0916 -1.8281 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3417 2.7843 0.6187 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3174 2.6893 2.0801 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4535 0.9394 -3.1294 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3211 0.5796 -4.3806 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6131 -0.2309 -0.6784 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2449 -2.3507 -0.1951 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5009 -7.9238 5.4031 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0927 -5.3585 5.3766 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8142 -0.2956 -2.4749 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0742 1.0631 0.8869 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0397 -7.2420 3.1009 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6220 -4.6690 3.0744 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3247 -1.2009 1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3764 -4.5654 -0.6892 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2849 -5.9937 -0.0799 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2321 -2.6289 1.7035 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3454 4.5841 -0.1727 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1378 3.3167 -3.4009 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0768 5.1221 -2.1079 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8026 2.3962 -0.2896 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2319 3.8657 0.5369 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9717 2.5468 1.4759 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6638 2.2335 2.2129 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9474 2.4518 2.9373 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2076 3.7707 1.9983 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9244 0.1404 -3.7021 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9065 0.9923 -2.1394 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5961 1.8889 -3.6454 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2548 0.3763 -4.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7919 -0.2194 -4.9533 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4636 1.5291 -4.8966 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 5 2 0 0 0 0 1 6 1 0 0 0 0 2 7 1 0 0 0 0 2 9 1 0 0 0 0 2 10 2 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 11 2 0 0 0 0 4 33 1 0 0 0 0 5 15 1 0 0 0 0 5 27 1 0 0 0 0 6 16 1 0 0 0 0 6 26 2 0 0 0 0 7 14 1 0 0 0 0 7 13 2 0 0 0 0 8 17 1 0 0 0 0 8 34 1 0 0 0 0 12 19 1 0 0 0 0 12 18 1 0 0 0 0 13 20 1 0 0 0 0 13 35 1 0 0 0 0 14 21 2 0 0 0 0 14 36 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 15 37 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 16 38 1 0 0 0 0 17 22 1 0 0 0 0 17 23 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 19 25 1 0 0 0 0 19 24 2 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 22 25 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 26 28 1 0 0 0 0 26 45 1 0 0 0 0 27 28 2 0 0 0 0 27 46 1 0 0 0 0 28 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 32 59 1 0 0 0 0 M CHG 2 2 1 9 -1 M END $$$$