BB3NU9 -OEChem-04022105293D 29 32 0 0 0 0 0 0 0999 V2000 3.6091 1.6161 0.3073 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5646 -0.5534 -0.1266 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9106 0.7314 -0.1482 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8186 -1.1097 0.3988 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1945 1.3799 -0.2992 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1611 0.1804 -0.2416 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4018 -0.9530 0.4985 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9977 -0.5550 0.2857 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6232 1.0570 -0.3455 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9508 -0.1029 0.0043 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4714 -0.2547 -0.0364 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2933 0.8549 0.1754 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0288 -1.5204 -0.2896 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6583 0.6593 0.1265 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2039 -0.5795 -0.1213 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4145 -1.6911 -0.3337 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8144 0.8407 0.1456 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2304 1.9130 -1.2518 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3267 2.0606 0.5465 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3865 -0.1487 -1.2647 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1124 0.4299 0.2381 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6344 -1.9335 0.0754 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6444 -0.9487 1.5657 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3037 2.0263 -0.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9008 1.8445 0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3936 -2.3872 -0.4595 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8486 -2.6650 -0.5295 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4073 0.9181 1.0642 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3940 1.2619 -0.6839 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 17 1 0 0 0 0 2 15 1 0 0 0 0 2 17 1 0 0 0 0 3 5 1 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 4 8 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 18 1 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 7 22 1 0 0 0 0 7 23 1 0 0 0 0 9 10 2 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 12 14 1 0 0 0 0 12 25 1 0 0 0 0 13 16 2 0 0 0 0 13 26 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 27 1 0 0 0 0 17 28 1 0 0 0 0 17 29 1 0 0 0 0 M END $$$$