D0D5FU -OEChem-05112005172D 43 46 0 0 0 0 0 0 0999 V2000 6.3383 1.9602 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.1819 2.9479 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4947 0.9725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3506 1.8038 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 0.7735 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 0.7735 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3538 4.1594 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.2653 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -3.5700 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.7653 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9538 1.5825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7628 0.9948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5416 2.3916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1448 2.1703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3260 2.1166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -0.1775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.7653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2493 3.1648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0570 -0.1775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6844 3.0502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.7653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.2653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.2653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -1.9606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.2653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -2.7653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3984 0.4932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2644 0.6303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9060 2.8932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0400 2.7560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5488 2.3412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8730 1.6131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3152 1.4967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9346 1.9983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2647 -0.3691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4674 -0.3691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2632 2.8280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9066 3.6290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1055 3.2724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8709 -1.3713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8709 -4.1594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8819 -2.7653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.5753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 4 1 0 0 0 0 1 15 1 0 0 0 0 4 12 1 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 5 16 1 0 0 0 0 6 19 2 0 0 0 0 7 18 3 0 0 0 0 8 21 1 0 0 0 0 8 25 2 0 0 0 0 9 23 1 0 0 0 0 9 26 1 0 0 0 0 9 41 1 0 0 0 0 10 23 2 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 18 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 20 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 17 19 1 0 0 0 0 17 21 1 0 0 0 0 19 36 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 26 2 0 0 0 0 24 40 1 0 0 0 0 25 43 1 0 0 0 0 26 42 1 0 0 0 0 M END $$$$