BWKO90 -OEChem-04012115182D 35 38 0 0 0 0 0 0 0999 V2000 3.9771 1.6283 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.7567 1.7215 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3010 -0.0832 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7861 0.2270 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8846 0.7215 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 -1.7035 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6227 1.2215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3548 1.2215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3548 0.2215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4888 1.7215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6227 0.2215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4888 -0.2785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8907 1.2215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7567 2.7215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3010 1.5263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8080 0.0191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3080 0.8851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 -0.8944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4067 -0.9990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.9125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 -2.6170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5878 -2.7215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4888 2.3415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0858 -0.0885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4888 -0.8985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3767 2.7215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7567 3.3415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1367 2.7215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4936 2.1156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4936 -0.6725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6914 0.9499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0423 -0.4974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 -1.9773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9467 -3.1186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3356 -3.2879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 17 1 0 0 0 0 2 7 1 0 0 0 0 2 13 1 0 0 0 0 2 14 1 0 0 0 0 3 5 1 0 0 0 0 3 9 1 0 0 0 0 3 30 1 0 0 0 0 4 13 2 0 0 0 0 4 16 1 0 0 0 0 5 15 2 0 0 0 0 6 18 1 0 0 0 0 6 21 2 0 0 0 0 7 10 2 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 8 15 1 0 0 0 0 9 12 1 0 0 0 0 10 23 1 0 0 0 0 11 12 2 0 0 0 0 11 24 1 0 0 0 0 12 25 1 0 0 0 0 14 26 1 0 0 0 0 14 27 1 0 0 0 0 14 28 1 0 0 0 0 15 29 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 17 31 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 20 22 2 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 22 35 1 0 0 0 0 M END $$$$