BB8S9I -OEChem-04022108313D 28 29 0 0 0 0 0 0 0999 V2000 3.0488 -2.1328 0.0369 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8484 -1.3034 -0.0891 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6504 0.7234 0.0328 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1265 1.9256 0.1724 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4208 1.4370 -0.4643 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0487 0.8796 0.0792 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8552 0.1166 0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3570 -0.4885 0.0237 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7736 -0.9363 0.0474 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2973 1.2717 0.0923 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3352 -1.4430 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3147 0.3194 0.0256 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9985 -1.0352 -0.0453 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7973 -0.0795 -0.0244 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0593 0.7456 0.0067 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8084 2.8428 -0.3373 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2912 2.1698 1.2288 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2751 1.3086 -1.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2078 2.1876 -0.3313 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1113 0.2416 1.2078 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7425 -0.2486 -0.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5468 2.3292 0.1527 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5579 -2.5055 -0.0922 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7302 -1.8291 -0.0996 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7996 1.7289 0.0866 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1126 1.3036 0.9457 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9321 0.0911 -0.0681 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0672 1.4439 -0.8349 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 2 0 0 0 0 2 14 2 0 0 0 0 3 12 1 0 0 0 0 3 14 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 16 1 0 0 0 0 4 17 1 0 0 0 0 5 7 1 0 0 0 0 5 18 1 0 0 0 0 5 19 1 0 0 0 0 6 8 2 0 0 0 0 6 10 1 0 0 0 0 7 9 1 0 0 0 0 7 20 1 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 10 12 2 0 0 0 0 10 22 1 0 0 0 0 11 13 2 0 0 0 0 11 23 1 0 0 0 0 12 13 1 0 0 0 0 13 24 1 0 0 0 0 14 15 1 0 0 0 0 15 26 1 0 0 0 0 15 27 1 0 0 0 0 15 28 1 0 0 0 0 M END $$$$