BD5WT8 -OEChem-04042105173D 41 43 0 0 0 0 0 0 0999 V2000 -1.3073 3.9834 -0.1614 S 0 0 0 0 0 0 0 0 0 0 0 0 4.9016 -2.0143 0.3115 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4292 1.0796 -1.3709 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5124 -0.6137 -0.2091 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3240 1.6369 0.4088 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2262 3.5347 0.5017 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4794 -0.8659 -1.2772 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5971 -1.5532 0.9141 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8816 -1.0049 -0.7014 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0373 -1.6690 1.3973 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5424 0.3739 -0.3655 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 0.5699 0.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6690 1.4510 0.0569 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3069 0.1333 0.0092 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0854 2.9666 0.3162 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3330 2.5764 -0.2628 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2674 -0.6187 -1.1651 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9528 -0.3703 1.1383 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5199 -2.3773 -0.0811 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8738 -1.8738 -1.2103 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5594 -1.6256 1.0932 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1691 -3.7190 -0.1294 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4524 -0.0721 -2.0297 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1733 -1.8021 -1.7589 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2484 -2.5201 0.5326 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9508 -1.2667 1.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2351 -0.0583 -0.2755 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5833 -1.3022 -1.4868 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1176 -2.4557 2.1539 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3828 -0.7317 1.8496 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1536 0.8670 1.6784 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0693 -0.3670 1.0029 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3690 2.6409 -0.5661 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7656 -0.2406 -2.0526 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9904 0.2030 2.0615 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8343 -2.4511 -2.1303 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0577 -2.0079 1.9801 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1273 4.5418 0.3333 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4549 -4.4927 0.1692 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0350 -3.7633 0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5320 -3.9465 -1.1375 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 9 1 0 0 0 0 2 10 1 0 0 0 0 3 11 2 0 0 0 0 4 7 1 0 0 0 0 4 8 1 0 0 0 0 4 11 1 0 0 0 0 5 12 1 0 0 0 0 5 13 1 0 0 0 0 5 15 1 0 0 0 0 6 15 2 0 0 0 0 6 38 1 0 0 0 0 7 9 1 0 0 0 0 7 23 1 0 0 0 0 7 24 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 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 12 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 16 2 0 0 0 0 14 17 2 0 0 0 0 14 18 1 0 0 0 0 16 33 1 0 0 0 0 17 20 1 0 0 0 0 17 34 1 0 0 0 0 18 21 2 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 M END $$$$