BG5IO3 -OEChem-04022107383D 59 61 0 1 0 0 0 0 0999 V2000 0.5288 -3.7030 0.6827 P 0 0 2 0 0 0 0 0 0 0 0 0 2.6681 -1.8294 1.4376 P 0 0 1 0 0 0 0 0 0 0 0 0 5.1614 2.4160 -1.5804 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.1616 -1.6490 -0.2269 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5256 0.8556 -0.6801 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9735 -1.6046 -3.1127 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4200 1.0182 -2.6097 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9376 -3.3360 0.1064 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8512 -0.3211 0.8942 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2656 4.0715 -0.2331 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9759 -0.3641 -0.9185 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1764 -2.2521 0.9800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2625 3.0750 -1.7845 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8378 2.0792 0.1972 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6171 -2.7255 0.4817 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3446 -4.2052 -0.6208 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9324 -1.9978 2.9059 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5526 -4.6482 1.8483 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8915 2.8829 3.6494 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0978 0.5583 0.5404 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3692 2.4781 1.9154 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7072 -1.3050 -2.5261 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.7535 0.0418 -1.8361 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.4956 -2.2560 -1.3558 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.4910 -0.2882 -0.5499 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9774 2.8141 -0.8367 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2080 1.9186 -0.7386 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7618 2.1686 -0.1601 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8786 0.5000 -1.1847 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0289 -2.4484 -0.9941 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6279 -0.0346 -0.4854 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4944 2.9865 -0.3906 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8418 1.7256 0.8319 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9865 0.2297 1.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5482 0.9568 2.3378 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2686 2.1916 2.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9483 -1.3665 -3.3113 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7329 0.3927 -1.6402 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9710 -3.2305 -1.5144 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5773 -0.2266 -0.6884 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7818 3.0025 -1.8986 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6446 1.9337 0.2661 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9174 2.1028 0.9244 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7195 0.5132 -2.2701 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5416 -1.5034 -0.7427 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5079 -2.8846 -1.8519 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3467 -0.9682 -0.9855 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3703 2.4908 0.0569 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5837 3.9953 0.0235 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9081 -2.4904 -3.5086 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4788 1.8261 -2.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4449 -0.6693 1.0546 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4386 3.9175 0.7114 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7274 -1.2555 -1.2174 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8885 3.3214 2.1427 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6758 0.6699 2.9122 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5555 3.5862 -1.9075 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7677 -3.6671 0.7114 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4791 -3.5935 -1.3751 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 12 1 0 0 0 0 1 16 1 0 0 0 0 1 18 2 0 0 0 0 2 9 1 0 0 0 0 2 12 1 0 0 0 0 2 15 1 0 0 0 0 2 17 2 0 0 0 0 3 27 1 0 0 0 0 4 24 1 0 0 0 0 4 25 1 0 0 0 0 5 28 1 0 0 0 0 5 31 1 0 0 0 0 6 22 1 0 0 0 0 6 50 1 0 0 0 0 7 23 1 0 0 0 0 7 51 1 0 0 0 0 8 30 1 0 0 0 0 9 31 1 0 0 0 0 10 26 1 0 0 0 0 10 53 1 0 0 0 0 11 29 1 0 0 0 0 11 54 1 0 0 0 0 13 32 1 0 0 0 0 13 57 1 0 0 0 0 14 33 2 0 0 0 0 15 58 1 0 0 0 0 16 59 1 0 0 0 0 19 36 2 0 0 0 0 20 25 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 21 33 1 0 0 0 0 21 36 1 0 0 0 0 21 55 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 37 1 0 0 0 0 23 25 1 0 0 0 0 23 38 1 0 0 0 0 24 30 1 0 0 0 0 24 39 1 0 0 0 0 25 40 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 41 1 0 0 0 0 27 29 1 0 0 0 0 27 42 1 0 0 0 0 28 32 1 0 0 0 0 28 43 1 0 0 0 0 29 31 1 0 0 0 0 29 44 1 0 0 0 0 30 45 1 0 0 0 0 30 46 1 0 0 0 0 31 47 1 0 0 0 0 32 48 1 0 0 0 0 32 49 1 0 0 0 0 34 35 2 0 0 0 0 34 52 1 0 0 0 0 35 36 1 0 0 0 0 35 56 1 0 0 0 0 M END $$$$