BU2WQ4 -OEChem-04022103293D 32 34 0 0 0 0 0 0 0999 V2000 5.2998 -0.1338 -0.0722 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7901 -2.3174 0.7527 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7365 2.7785 0.5191 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8779 1.4362 0.2506 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0503 -0.8764 -0.1886 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3277 0.1841 0.0055 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1546 0.0970 -0.0138 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0825 0.4868 0.0699 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4499 -0.7420 -0.1621 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2416 1.6790 0.3003 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7895 -1.0803 0.3821 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9123 1.1927 -0.4276 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4766 0.5881 0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2424 -1.8747 -0.3769 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1818 -1.1621 0.3643 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9395 -0.0664 -0.0495 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3047 1.1110 -0.4452 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2508 -0.5508 -0.1283 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6353 -1.7800 -0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9991 1.0304 -0.5082 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2723 2.2315 0.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2061 -1.9366 0.7121 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4505 2.1154 -0.7672 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9723 1.5377 0.2678 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7783 -2.8410 -0.5596 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8281 1.9986 -0.7836 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3346 -0.4807 -0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2405 -2.6663 -0.5282 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1100 -2.9654 1.0046 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0686 0.8002 -0.4615 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8274 1.8794 0.1624 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7713 1.2707 -1.5523 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 20 1 0 0 0 0 2 15 1 0 0 0 0 2 29 1 0 0 0 0 3 10 2 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 4 21 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 7 11 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 13 2 0 0 0 0 9 14 2 0 0 0 0 11 15 1 0 0 0 0 11 22 1 0 0 0 0 12 17 2 0 0 0 0 12 23 1 0 0 0 0 13 18 1 0 0 0 0 13 24 1 0 0 0 0 14 19 1 0 0 0 0 14 25 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 26 1 0 0 0 0 18 19 2 0 0 0 0 18 27 1 0 0 0 0 19 28 1 0 0 0 0 20 30 1 0 0 0 0 20 31 1 0 0 0 0 20 32 1 0 0 0 0 M END $$$$