B2WX4Y -OEChem-04022116043D 36 38 0 0 0 0 0 0 0999 V2000 4.6824 -1.6753 -0.0092 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.6419 0.0179 0.3718 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1016 2.4516 0.2941 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8813 -2.8229 -0.8556 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3127 1.3704 -0.4624 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4710 0.8610 0.4743 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7879 0.5627 -0.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2232 0.3969 0.1064 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1618 -0.9449 -0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0610 1.2552 0.0335 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6526 1.0299 -0.2527 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7597 -0.7549 -0.6711 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9676 -1.6284 -0.5884 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3207 -0.1448 0.4485 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6721 1.7145 -0.9268 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9930 0.0003 0.6344 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3377 0.3488 0.1677 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0088 1.3755 -0.7175 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3298 -0.3388 0.8436 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7575 -0.0365 0.7829 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9227 -1.3409 0.7048 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3043 -1.6972 0.1987 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1322 2.3513 -0.6495 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1441 -1.2559 -1.0039 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4301 2.5165 -1.6202 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2381 -0.5313 1.2079 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7897 1.9143 -1.2471 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5448 -1.1201 1.5665 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0124 0.9935 1.0529 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0123 -0.6768 1.6336 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3820 -0.3216 -0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8847 -1.4599 1.7931 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2119 -2.0319 0.2343 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3621 -1.5698 -0.8874 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0580 -1.0346 0.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5576 -2.7318 0.4468 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 14 1 0 0 0 0 2 17 1 0 0 0 0 2 21 1 0 0 0 0 3 10 2 0 0 0 0 4 13 2 0 0 0 0 5 7 1 0 0 0 0 5 11 1 0 0 0 0 5 23 1 0 0 0 0 6 8 1 0 0 0 0 6 14 2 0 0 0 0 7 10 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 9 13 1 0 0 0 0 11 15 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 14 20 1 0 0 0 0 15 18 1 0 0 0 0 15 25 1 0 0 0 0 16 19 2 0 0 0 0 16 26 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 27 1 0 0 0 0 19 28 1 0 0 0 0 20 29 1 0 0 0 0 20 30 1 0 0 0 0 20 31 1 0 0 0 0 21 22 1 0 0 0 0 21 32 1 0 0 0 0 21 33 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 M END $$$$