D08TNQ -OEChem-10101305022D 44 45 0 1 0 0 0 0 0999 V2000 3.7320 -2.6550 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 6.3301 5.8450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 4.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.3450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 4.8450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.3450 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5981 2.8450 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 3.7320 0.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 4.8450 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 2.8660 -0.1550 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 2.8660 -3.1550 0.0000 C 0 0 0 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 -1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -5.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -5.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -6.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 2.7624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 3.4527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 3.4276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9875 2.7373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 1.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 5.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 4.5350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 0.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -2.5724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -3.2627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -1.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -4.3450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -4.3450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -5.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -5.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 6.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -6.7750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 16 1 0 0 0 0 2 10 2 0 0 0 0 3 12 1 0 0 0 0 3 43 1 0 0 0 0 4 12 2 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 5 30 1 0 0 0 0 8 6 1 6 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 12 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 11 14 2 0 0 0 0 11 15 1 0 0 0 0 13 17 2 0 0 0 0 13 18 1 0 0 0 0 14 17 1 0 0 0 0 14 33 1 0 0 0 0 15 18 2 0 0 0 0 15 34 1 0 0 0 0 16 19 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 20 22 1 0 0 0 0 20 39 1 0 0 0 0 21 23 2 0 0 0 0 21 40 1 0 0 0 0 22 24 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 44 1 0 0 0 0 M END $$$$