LJE1B9 -OEChem-05032301333D 33 35 0 1 0 0 0 0 0999 V2000 -2.5497 0.9866 2.1737 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6544 0.1675 0.2693 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8284 -1.6715 0.4079 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9006 0.8444 -0.3374 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2324 -1.4292 0.1081 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8326 -0.6404 0.5297 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.9821 0.2356 1.0436 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.2427 -1.3929 -0.7402 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5334 1.1709 -0.0336 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8248 -0.4767 -1.8184 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9543 0.3973 -1.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6277 -0.3477 0.2122 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7183 0.4825 -0.0422 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9679 -0.1243 -0.0776 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9222 1.8638 -0.2912 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2756 2.0578 -0.4696 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1010 -2.1239 0.3446 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5931 -1.3612 1.3225 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7917 -0.4212 1.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0037 -2.1377 -0.4729 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4004 -1.9521 -1.1629 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7928 1.9363 -0.2953 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3925 1.7243 0.3653 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1958 -1.0821 -2.6533 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0314 0.1645 -2.2216 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2816 1.0977 -2.0556 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8173 -0.2356 -1.0377 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7723 1.1577 0.0896 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3050 1.5168 2.4802 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1695 2.6389 -0.3373 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8957 0.6884 -0.4193 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8482 2.9505 -0.6783 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2277 -3.1890 0.5056 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 29 1 0 0 0 0 2 6 1 0 0 0 0 2 12 1 0 0 0 0 2 28 1 0 0 0 0 3 12 2 0 0 0 0 3 17 1 0 0 0 0 4 14 1 0 0 0 0 4 16 1 0 0 0 0 4 31 1 0 0 0 0 5 14 1 0 0 0 0 5 17 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 18 1 0 0 0 0 7 9 1 0 0 0 0 7 19 1 0 0 0 0 8 10 1 0 0 0 0 8 20 1 0 0 0 0 8 21 1 0 0 0 0 9 11 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 30 1 0 0 0 0 16 32 1 0 0 0 0 17 33 1 0 0 0 0 M END $$$$