D04EXX Wcorina 11010620263D 1 1.00000 0.00000 0 CORINA evaluation license 3.40 0067 02.08.2006 28 28 0 0 0 999 V2000 -0.0034 1.4180 -0.0507 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0063 0.0204 -0.0244 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2036 2.1214 -0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2841 2.1478 -0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2068 -0.6586 -0.0196 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3996 1.4363 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2914 3.4455 -0.0864 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4071 0.0472 -0.0404 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2183 -2.0093 0.0057 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.5085 4.1391 -0.0972 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6232 -0.6441 -0.0346 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5161 5.4866 -0.1225 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7323 -0.0525 0.4517 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3527 6.1669 -0.1375 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0035 6.3343 -0.1357 S 0 0 0 0 0 0 0 0 0 0 0 0 6.0221 -0.8268 0.5404 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6922 1.1031 0.8181 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9247 -0.5268 -0.0075 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1995 3.2012 -0.0926 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2164 1.6027 -0.0501 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3325 1.9801 -0.0838 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3459 3.6496 -0.0865 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6683 -1.5491 -0.3806 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5099 5.6866 -0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3581 7.1367 -0.1557 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8644 -1.8392 0.1685 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7844 -0.3330 -0.0621 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3503 -0.8683 1.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 2 0 0 0 0 1 4 1 0 0 0 0 2 5 2 0 0 0 0 2 18 1 0 0 0 0 3 6 1 0 0 0 0 3 19 1 0 0 0 0 4 7 2 0 0 0 0 4 20 1 0 0 0 0 5 8 1 0 0 0 0 5 9 1 0 0 0 0 6 8 2 0 0 0 0 6 21 1 0 0 0 0 7 10 1 0 0 0 0 8 11 1 0 0 0 0 10 12 1 0 0 0 0 10 22 1 0 0 0 0 11 13 1 0 0 0 0 11 23 1 0 0 0 0 12 14 1 0 0 0 0 12 15 2 0 0 0 0 13 16 1 0 0 0 0 13 17 2 0 0 0 0 14 24 1 0 0 0 0 14 25 1 0 0 0 0 16 26 1 0 0 0 0 16 27 1 0 0 0 0 16 28 1 0 0 0 0 M END $$$$