D0CA2S Wcorina 11010620293D 1 1.00000 0.00000 0 CORINA evaluation license 3.40 0067 02.08.2006 33 35 0 0 0 999 V2000 -0.0178 1.4648 0.0101 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0021 -0.0041 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 1.9864 -0.0006 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4298 3.9039 -3.6503 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2012 3.4503 -4.1095 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2125 3.0725 -3.2194 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6911 3.9869 -2.3004 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7075 3.6108 -1.3833 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4605 3.1507 -1.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9631 3.3066 0.9098 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9366 3.6786 0.0642 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0855 2.2560 -1.0934 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3414 2.3230 1.4364 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7264 2.8506 0.4825 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4280 2.7543 -0.8591 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0112 2.6299 -3.6756 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0051 4.0718 0.4965 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5779 -0.5296 1.2471 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3435 -0.5476 -0.2262 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8259 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8163 0.9069 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1903 4.1947 -4.3598 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0152 3.3925 -5.1718 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6513 4.3392 -1.9534 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1331 3.3590 1.8634 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6818 2.1162 -2.0853 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9720 1.6740 -3.8164 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0196 -0.1928 2.0942 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5806 -1.6191 1.2146 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5999 -0.1668 1.3562 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7182 -0.1978 -1.1882 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -1.6367 -0.2274 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0105 -0.2114 0.5676 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 20 1 0 0 0 0 1 21 1 0 0 0 0 2 18 1 0 0 0 0 2 19 1 0 0 0 0 3 13 1 0 0 0 0 3 12 2 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 5 23 1 0 0 0 0 6 9 2 0 0 0 0 6 16 1 0 0 0 0 7 8 2 0 0 0 0 7 24 1 0 0 0 0 8 11 1 0 0 0 0 8 9 1 0 0 0 0 9 15 1 0 0 0 0 10 14 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 11 17 2 0 0 0 0 12 15 1 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 16 27 1 0 0 0 0 18 28 1 0 0 0 0 18 29 1 0 0 0 0 18 30 1 0 0 0 0 19 31 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 M END $$$$