BSQ50I -OEChem-04042105273D 46 46 0 1 0 0 0 0 0999 V2000 -0.3066 -0.7829 -1.5296 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8196 1.6405 0.6377 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5618 -1.7214 1.0262 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7599 -1.0787 -0.7803 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2798 -0.5969 0.2646 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2888 -0.6619 0.1621 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4018 2.2536 0.7483 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9986 -1.1105 0.7314 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.2256 -2.6062 0.9179 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3094 -2.9311 -0.1074 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1829 -1.6858 -0.0993 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -0.8299 -0.3433 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6099 0.7480 0.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4388 -0.4046 -0.6654 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6278 1.0932 -0.9497 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0356 1.0839 -0.0319 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5632 2.0657 0.2499 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7046 -1.0753 -0.1556 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6622 1.7009 1.2552 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6992 3.5359 -0.1393 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1445 1.3636 -1.5173 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7169 -0.6108 1.6646 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3253 -3.2110 0.7735 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6123 -2.8000 1.9258 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8688 -3.8380 0.1384 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8583 -3.0697 -1.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9526 -1.7625 0.6764 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6599 -1.5055 -1.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2439 -0.8991 -1.6272 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4345 -0.7203 1.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5735 1.2476 -1.4858 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8372 1.3990 -1.6492 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5921 1.9531 0.7478 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7212 0.2793 0.2439 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6424 1.6212 0.7736 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7389 2.4674 2.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4398 0.7649 1.7722 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6664 3.7312 -0.6147 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9125 3.8203 -0.8458 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6126 4.1856 0.7379 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5039 2.2022 -1.8159 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8365 0.5010 -2.1162 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1742 1.6128 -1.7963 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4097 2.0197 1.7405 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3522 2.5401 0.5169 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3934 -2.1588 1.3078 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 2 0 0 0 0 2 13 2 0 0 0 0 3 18 1 0 0 0 0 3 46 1 0 0 0 0 4 18 2 0 0 0 0 5 8 1 0 0 0 0 5 11 1 0 0 0 0 5 13 1 0 0 0 0 6 12 1 0 0 0 0 6 14 1 0 0 0 0 6 30 1 0 0 0 0 7 16 1 0 0 0 0 7 44 1 0 0 0 0 7 45 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 9 23 1 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 14 29 1 0 0 0 0 15 17 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 16 21 1 0 0 0 0 16 34 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 17 33 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 M END $$$$