BUA03Z -OEChem-04042102443D 40 43 0 1 0 0 0 0 0999 V2000 -5.2712 -1.2273 -0.2323 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1537 4.0722 0.4717 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3539 -1.9435 0.2493 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7055 0.5214 -0.4664 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5915 -0.4368 -0.0898 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7736 0.3222 -0.1494 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8971 -0.7345 0.1209 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1342 1.7493 -0.2868 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2523 0.6659 -0.4364 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.8158 -0.7345 -0.1452 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8419 1.6921 0.6131 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5307 1.6993 -0.6623 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9263 -1.5797 -0.0596 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1733 2.7698 0.3606 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1405 -0.7785 -0.2622 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6671 2.9552 0.4419 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5403 -1.2434 0.0166 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8166 -2.9335 0.1915 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4024 -2.6118 0.2714 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5303 -3.4487 0.3582 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9551 -0.8049 0.0268 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1865 0.3872 -0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7941 1.6073 -0.3102 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2372 -0.5925 0.1444 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8448 0.6276 -0.0559 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9337 0.9696 -1.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0167 1.3244 1.6317 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7839 1.9556 0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5885 1.4275 -0.5901 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3373 2.0614 -1.6783 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5212 2.4819 1.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6453 3.7203 0.0931 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6864 -3.5763 0.2594 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5464 -3.1099 0.4152 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3973 -4.5089 0.5577 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4233 0.5374 -0.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3001 1.2047 -0.3266 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2346 2.5169 -0.4966 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8088 -1.4934 0.3298 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9216 0.7409 -0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 2 0 0 0 0 2 16 2 0 0 0 0 3 21 2 0 0 0 0 4 9 1 0 0 0 0 4 12 1 0 0 0 0 4 15 1 0 0 0 0 5 17 1 0 0 0 0 5 21 1 0 0 0 0 5 36 1 0 0 0 0 6 21 1 0 0 0 0 6 22 1 0 0 0 0 6 37 1 0 0 0 0 7 22 2 0 0 0 0 7 24 1 0 0 0 0 8 23 2 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 26 1 0 0 0 0 10 13 2 0 0 0 0 10 17 1 0 0 0 0 11 16 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 14 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 15 1 0 0 0 0 13 18 1 0 0 0 0 14 16 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 17 19 2 0 0 0 0 18 20 2 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 20 35 1 0 0 0 0 22 23 1 0 0 0 0 23 38 1 0 0 0 0 24 25 2 0 0 0 0 24 39 1 0 0 0 0 25 40 1 0 0 0 0 M END $$$$