D09HET -OEChem-10191522192D 29 29 0 1 0 0 0 0 0999 V2000 5.4641 0.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.1550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.8450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.8450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.3450 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8660 -0.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.3450 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8660 -1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 0.4276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -0.2627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 1.5350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.3450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.3450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.7750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.0350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 3.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 28 1 0 0 0 0 2 10 2 0 0 0 0 3 11 1 0 0 0 0 3 29 1 0 0 0 0 4 11 2 0 0 0 0 8 5 1 6 0 0 0 5 21 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 1 0 0 0 6 17 1 0 0 0 0 7 9 1 0 0 0 0 7 18 1 0 0 0 0 7 19 1 0 0 0 0 8 11 1 0 0 0 0 8 20 1 0 0 0 0 9 12 2 0 0 0 0 9 13 1 0 0 0 0 12 14 1 0 0 0 0 12 23 1 0 0 0 0 13 15 2 0 0 0 0 13 24 1 0 0 0 0 14 16 2 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 15 26 1 0 0 0 0 16 27 1 0 0 0 0 M END $$$$