BXG69T -OEChem-04012116452D 54 58 0 1 0 0 0 0 0999 V2000 6.8509 -0.8975 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8743 -0.0709 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0544 0.3165 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 2.5826 1.2601 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2616 -3.2525 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2606 1.6516 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.6027 0.7119 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2342 2.2699 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.9754 1.3040 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.4976 3.2525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8177 0.1020 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2673 1.6144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9941 0.6585 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.6331 1.7611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3743 0.7951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2884 0.9593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8807 -0.6683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3486 0.6173 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9410 -1.0103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1750 -0.3675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7330 -1.3685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7662 -2.3680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5820 -0.8400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6483 -2.8390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4641 -1.3110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4973 -2.3105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3794 -2.7815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9699 2.4504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8934 -0.0868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4542 3.0909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7554 0.4829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2751 -0.1979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8154 3.7848 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8844 3.3444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3093 2.2329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6565 1.7211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5405 1.0812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2271 1.5833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8281 2.3496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7633 1.3578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9784 1.4962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9884 -1.2789 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5007 -0.6683 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7660 0.4052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4661 -1.4088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2510 -1.5472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5924 -0.1555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8650 -0.9044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.0480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6903 1.8707 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2398 -2.6956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5614 -0.2204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6689 -3.4586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9905 -0.9834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11 1 1 1 0 0 0 1 21 1 0 0 0 0 2 15 2 0 0 0 0 13 3 1 6 0 0 0 3 16 1 0 0 0 0 3 17 1 0 0 0 0 18 4 1 1 0 0 0 4 49 1 0 0 0 0 4 50 1 0 0 0 0 5 27 3 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 12 1 0 0 0 0 6 28 1 1 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 7 29 1 1 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 8 30 1 6 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 9 31 1 1 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 13 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 16 18 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 19 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 20 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 22 24 1 0 0 0 0 22 51 1 0 0 0 0 23 25 2 0 0 0 0 23 52 1 0 0 0 0 24 26 2 0 0 0 0 24 53 1 0 0 0 0 25 26 1 0 0 0 0 25 54 1 0 0 0 0 26 27 1 0 0 0 0 M END $$$$