L2E3OT -OEChem-05022323102D 36 37 0 1 0 0 0 0 0999 V2000 3.4543 -0.3450 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5768 2.4332 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5313 -3.9328 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2313 -1.6322 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1756 1.4151 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7634 0.6061 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 4.0512 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2634 -0.9328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2634 -1.9328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0724 -0.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9945 3.1376 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7634 0.6061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 2.3286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3973 -2.4328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1294 -2.4328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.0331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0234 -0.6540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3973 -3.4328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1294 -3.4328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2634 -3.9328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7666 0.0151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6301 3.6392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5590 1.3503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8604 -2.1228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6663 -2.1228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9352 3.6497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 2.9683 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0648 2.4165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6663 -3.7428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2634 -4.5528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0368 4.5528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0179 4.1160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1814 -0.4456 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2273 0.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3517 0.4759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5313 -4.5528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 12 1 0 0 0 0 2 13 2 0 0 0 0 3 18 1 0 0 0 0 3 36 1 0 0 0 0 4 17 2 0 0 0 0 5 12 1 0 0 0 0 5 13 1 0 0 0 0 5 23 1 0 0 0 0 6 10 1 0 0 0 0 6 12 2 0 0 0 0 11 7 1 1 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 9 14 2 0 0 0 0 9 15 1 0 0 0 0 10 17 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 11 22 1 0 0 0 0 14 18 1 0 0 0 0 14 24 1 0 0 0 0 15 19 2 0 0 0 0 15 25 1 0 0 0 0 16 26 1 0 0 0 0 16 27 1 0 0 0 0 16 28 1 0 0 0 0 17 21 1 0 0 0 0 18 20 2 0 0 0 0 19 20 1 0 0 0 0 19 29 1 0 0 0 0 20 30 1 0 0 0 0 21 33 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 M END $$$$