BA9HU3 -OEChem-04022110362D 47 49 0 0 0 0 0 0 0999 V2000 5.1350 3.4050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -4.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9473 -1.3997 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9473 0.2097 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.5950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.4050 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.0950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -1.5950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2579 -2.3502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2364 -2.5565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5901 -3.0946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5309 -0.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -2.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 2.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 1.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -3.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 3.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 2.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 4.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6512 -2.2224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1086 -3.1632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8431 -2.6843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3643 -1.9498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1286 -2.6805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1760 -3.5560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0515 -3.5086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1509 -0.5950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 1.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6150 -3.1776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0135 -2.4873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 0.7850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3249 -2.5124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9264 -3.2027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 4.0250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.5950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7550 4.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 5.0250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5150 4.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 1 25 1 0 0 0 0 2 21 1 0 0 0 0 2 44 1 0 0 0 0 3 9 1 0 0 0 0 3 10 1 0 0 0 0 3 14 1 0 0 0 0 4 11 1 0 0 0 0 4 14 2 0 0 0 0 5 10 2 0 0 0 0 5 16 1 0 0 0 0 6 15 1 0 0 0 0 6 17 1 0 0 0 0 6 34 1 0 0 0 0 7 15 1 0 0 0 0 7 16 2 0 0 0 0 8 16 1 0 0 0 0 8 18 1 0 0 0 0 8 35 1 0 0 0 0 9 12 1 0 0 0 0 9 13 1 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 11 15 2 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 33 1 0 0 0 0 17 19 1 0 0 0 0 17 20 2 0 0 0 0 18 21 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 22 2 0 0 0 0 20 23 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 24 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 M END $$$$