BWHM58 -OEChem-04022112533D 54 55 0 1 0 0 0 0 0999 V2000 2.0314 1.5405 -3.0712 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8993 -0.8685 -2.1394 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8108 -1.9613 0.1508 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9475 -1.5554 3.1444 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7486 0.1853 2.3177 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5744 -3.7853 0.3211 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6160 -0.5421 -0.6011 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9621 2.3088 -2.5521 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3111 -1.6413 0.8160 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2571 3.5148 1.2653 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8618 3.6468 2.9308 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2011 1.5602 2.2945 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9508 1.2677 -2.0166 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6381 2.2332 -0.9043 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2997 2.6764 -1.3608 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4295 3.5246 -0.4961 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7543 -0.1596 -1.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6137 -1.8646 -0.0185 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6707 -1.9639 1.1736 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4222 2.6591 0.4181 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0905 -0.9885 2.2549 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3783 -2.5784 0.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8768 -2.8183 -0.2736 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0463 2.9149 2.1003 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1015 -1.9887 -0.5258 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0084 -1.7523 0.5073 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3330 -1.4537 -1.7929 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1470 -0.9813 0.2733 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4715 -0.6826 -2.0271 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3785 -0.4464 -0.9939 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9730 1.3927 -2.3896 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3114 3.0957 -0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5997 1.8073 0.0992 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2101 4.1468 -1.1328 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0605 4.2021 0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6437 -2.0804 0.2855 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3274 -2.5875 -0.7909 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6857 -2.9801 1.5841 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2928 0.1266 -0.2449 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2307 2.0315 1.0378 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0487 1.9963 -0.1924 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0194 -0.6680 0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0803 -3.5676 0.5014 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5837 -3.3479 -1.1886 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2361 -0.9170 3.8311 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8374 -2.1611 1.4997 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6325 -1.6286 -2.6051 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8525 -0.7963 1.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6514 -0.2653 -3.0135 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2647 0.1545 -1.1761 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8608 4.6606 2.9053 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4867 3.1974 3.5912 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6775 0.8737 1.7632 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8575 1.2022 2.9799 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 13 1 0 0 0 0 2 17 2 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 4 21 1 0 0 0 0 4 45 1 0 0 0 0 5 21 2 0 0 0 0 6 22 2 0 0 0 0 7 17 1 0 0 0 0 7 18 1 0 0 0 0 7 39 1 0 0 0 0 8 15 2 0 0 0 0 9 19 1 0 0 0 0 9 22 1 0 0 0 0 9 42 1 0 0 0 0 10 20 1 0 0 0 0 10 24 2 0 0 0 0 11 24 1 0 0 0 0 11 51 1 0 0 0 0 11 52 1 0 0 0 0 12 24 1 0 0 0 0 12 53 1 0 0 0 0 12 54 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 16 20 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 21 1 0 0 0 0 19 38 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 23 25 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 26 28 1 0 0 0 0 26 46 1 0 0 0 0 27 29 2 0 0 0 0 27 47 1 0 0 0 0 28 30 2 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 30 50 1 0 0 0 0 M END $$$$