L8D1MB -OEChem-05022322032D 28 29 0 0 0 0 0 0 0999 V2000 4.7026 3.5483 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.4462 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.0538 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.5538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.0538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.4462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.5538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.9462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.9462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5116 2.1470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.9462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.9462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.4462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 2.8902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6808 3.7562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 1.1364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 0.4461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 2.6364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 1.9461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.7438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.6362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.6362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6405 1.5406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.2562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.2562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7974 2.8254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9329 4.3226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -3.7562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 15 1 0 0 0 0 2 13 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 20 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 9 1 0 0 0 0 7 10 2 0 0 0 0 8 11 1 0 0 0 0 8 21 1 0 0 0 0 9 12 2 0 0 0 0 9 22 1 0 0 0 0 10 14 1 0 0 0 0 10 23 1 0 0 0 0 11 13 2 0 0 0 0 11 24 1 0 0 0 0 12 13 1 0 0 0 0 12 25 1 0 0 0 0 14 15 2 0 0 0 0 14 26 1 0 0 0 0 15 27 1 0 0 0 0 M END $$$$