BW7J3F -OEChem-04012116552D 28 29 0 0 0 0 0 0 0999 V2000 4.0000 -2.5202 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -3.5202 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.5202 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -1.5202 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 3.0186 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2320 3.0186 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4921 1.7586 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 1.4798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 0.4798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9230 2.0676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5411 2.0676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -0.0202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 -0.0202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9720 1.7586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -1.0202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 -1.0202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -1.5202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -2.5202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3291 0.2898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1350 0.2898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8676 3.5202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7804 2.3482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3823 1.5670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1636 1.1689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1350 -1.3302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -2.1402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9529 2.1734 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6210 1.1521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 2 18 1 0 0 0 0 3 18 1 0 0 0 0 4 15 1 0 0 0 0 4 18 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 21 1 0 0 0 0 6 11 2 0 0 0 0 7 11 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 9 12 2 0 0 0 0 9 13 1 0 0 0 0 10 14 1 0 0 0 0 12 15 1 0 0 0 0 12 19 1 0 0 0 0 13 16 2 0 0 0 0 13 20 1 0 0 0 0 14 22 1 0 0 0 0 14 23 1 0 0 0 0 14 24 1 0 0 0 0 15 17 2 0 0 0 0 16 17 1 0 0 0 0 16 25 1 0 0 0 0 17 26 1 0 0 0 0 M END $$$$