BDUK84 -OEChem-04022109563D 29 30 0 0 0 0 0 0 0999 V2000 5.0749 0.1875 0.0964 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3965 0.6315 0.0624 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6438 -0.1382 -1.3935 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0861 1.6245 0.2685 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7131 -0.6988 1.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1881 0.2111 -0.0364 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6222 0.5352 -0.0017 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2821 1.1895 -0.0078 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3738 -0.3124 0.0334 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2127 -0.0330 0.0018 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8269 -1.5721 -0.0449 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4234 -1.3907 -0.0656 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0269 0.7622 0.0173 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2637 0.2481 -1.2067 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2342 0.2103 1.2089 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5171 -0.3639 -1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4878 -0.4017 1.2145 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1290 -0.6891 0.0096 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2103 1.8561 -0.8782 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1933 1.8330 0.8785 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3690 -2.5060 -0.0832 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6651 -2.1586 -0.1228 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1028 1.8583 0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7967 0.4944 -2.1567 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7442 0.4267 2.1545 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0164 -0.5880 -2.1391 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9642 -0.6553 2.1571 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1048 -1.1659 0.0139 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5958 0.0735 -1.5382 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 9 1 0 0 0 0 2 9 1 0 0 0 0 2 10 1 0 0 0 0 3 29 1 0 0 0 0 6 8 1 0 0 0 0 6 13 2 0 0 0 0 7 8 1 0 0 0 0 7 14 2 0 0 0 0 7 15 1 0 0 0 0 8 19 1 0 0 0 0 8 20 1 0 0 0 0 9 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 12 22 1 0 0 0 0 13 23 1 0 0 0 0 14 16 1 0 0 0 0 14 24 1 0 0 0 0 15 17 2 0 0 0 0 15 25 1 0 0 0 0 16 18 2 0 0 0 0 16 26 1 0 0 0 0 17 18 1 0 0 0 0 17 27 1 0 0 0 0 18 28 1 0 0 0 0 M END $$$$