B6WM5I -OEChem-04022108332D 44 47 0 0 0 0 0 0 0999 V2000 4.6783 -2.2557 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.5490 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.5490 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.9510 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -0.6462 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.4510 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 -1.4510 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.4510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 4.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.9510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.9510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -1.4510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.9510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7619 -2.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 -3.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 -2.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7619 -4.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2619 -3.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 -4.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 1.9414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 2.6316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 2.6316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 1.9414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 0.4664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 1.1567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 1.1567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 0.4664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4766 3.4414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0781 4.1316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 4.5860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 4.3590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 3.5121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.2610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5719 -0.9140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6419 -3.1830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0719 -1.7800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4519 -4.5860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8819 -3.1830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0719 -4.5860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 8 1 0 0 0 0 2 9 1 0 0 0 0 2 12 1 0 0 0 0 3 10 1 0 0 0 0 3 11 1 0 0 0 0 3 13 1 0 0 0 0 4 13 1 0 0 0 0 4 18 2 0 0 0 0 5 15 1 0 0 0 0 5 17 2 0 0 0 0 6 16 2 0 0 0 0 6 18 1 0 0 0 0 7 17 1 0 0 0 0 7 19 1 0 0 0 0 7 39 1 0 0 0 0 8 10 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 11 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 14 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 15 2 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 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 40 1 0 0 0 0 21 23 2 0 0 0 0 21 41 1 0 0 0 0 22 24 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 M END $$$$