BDN6S5 -OEChem-04022108342D 65 67 0 1 0 0 0 0 0999 V2000 6.5546 4.6092 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.0188 0.0575 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1216 -1.5562 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3295 -2.5025 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8126 1.0129 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1653 0.4776 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2601 3.5387 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9074 4.0740 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5472 2.3798 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0726 -1.2472 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0726 -0.2472 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.0188 -1.5519 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.1216 0.0618 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.6024 -0.7472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5338 -0.7472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3080 -2.7087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8344 1.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5254 2.1718 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.6187 -3.6592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1945 2.9150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8855 3.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9508 -4.4035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5972 -3.8654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2382 3.3308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9511 4.4898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2615 -5.3540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9078 -4.8159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2400 -5.5602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6420 5.4408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 4.1808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9021 4.7988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2456 5.5602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0737 -2.0972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0737 0.6028 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6313 -1.6481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5600 0.5002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0633 -1.1619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0633 -0.3325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0730 -0.3323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0730 -1.1621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9218 -2.6213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3286 -2.0890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3338 2.7615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5762 2.4264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7419 3.2060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1324 1.9190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5038 4.3546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3381 3.5750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3442 -4.2756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0112 -3.4040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8474 -5.8155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5145 -4.9438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4326 -6.1496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2317 5.6324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4504 6.0305 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0524 5.2492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8084 4.7704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4103 3.9892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1916 3.5911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0937 4.2091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4918 4.9904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7105 5.3884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8353 5.7518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0540 6.1499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6560 5.3686 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 1 32 1 0 0 0 0 2 11 1 0 0 0 0 2 14 1 0 0 0 0 3 10 1 0 0 0 0 3 15 1 0 0 0 0 12 4 1 1 0 0 0 4 16 1 0 0 0 0 13 5 1 1 0 0 0 5 17 1 0 0 0 0 6 17 2 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 24 2 0 0 0 0 18 9 1 1 0 0 0 9 24 1 0 0 0 0 9 46 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 33 1 6 0 0 0 11 13 1 0 0 0 0 11 34 1 6 0 0 0 12 14 1 0 0 0 0 12 35 1 0 0 0 0 13 15 1 0 0 0 0 13 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 19 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 18 20 1 0 0 0 0 18 43 1 0 0 0 0 19 22 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 26 1 0 0 0 0 22 49 1 0 0 0 0 23 27 2 0 0 0 0 23 50 1 0 0 0 0 25 29 1 0 0 0 0 25 30 1 0 0 0 0 25 31 1 0 0 0 0 26 28 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 30 59 1 0 0 0 0 31 60 1 0 0 0 0 31 61 1 0 0 0 0 31 62 1 0 0 0 0 32 63 1 0 0 0 0 32 64 1 0 0 0 0 32 65 1 0 0 0 0 M END $$$$