BD81OH -OEChem-04022109123D 33 34 0 0 0 0 0 0 0999 V2000 4.2580 3.3552 -0.4578 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0637 -2.4500 -1.2163 S 0 0 0 0 0 0 0 0 0 0 0 0 1.3597 2.6207 -0.4977 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0907 1.3113 0.5303 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3105 -2.7964 0.6693 O 0 5 0 0 0 0 0 0 0 0 0 0 6.0358 -1.4467 0.5258 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3092 0.0727 -0.0959 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8410 -0.8273 -0.3945 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7989 -1.6547 0.4897 N 0 3 0 0 0 0 0 0 0 0 0 0 1.7080 0.3022 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5463 -0.7722 0.1921 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2068 1.5774 -0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9249 -0.5644 0.2371 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5854 1.7853 -0.2109 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4444 0.7144 0.0357 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0439 0.0871 0.1299 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4491 -1.0080 -0.5276 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6002 0.2622 0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8143 0.7857 1.0595 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6579 -0.7789 -0.7747 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1989 0.6183 1.0842 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0425 -0.9463 -0.7499 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8130 -0.2477 0.1795 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1482 -1.7511 0.4296 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2405 0.9067 0.0834 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5164 0.8974 0.0669 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3573 -1.6530 -0.6821 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3554 1.4621 1.7759 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1068 -1.3136 -1.5423 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7990 1.1618 1.8081 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5224 -1.6135 -1.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8913 -0.3765 0.1975 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5072 2.2811 -0.8138 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 2 17 2 0 0 0 0 3 12 1 0 0 0 0 3 33 1 0 0 0 0 4 18 2 0 0 0 0 5 9 1 0 0 0 0 6 9 2 0 0 0 0 7 10 1 0 0 0 0 7 17 1 0 0 0 0 7 25 1 0 0 0 0 8 17 1 0 0 0 0 8 18 1 0 0 0 0 8 27 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 12 2 0 0 0 0 11 13 2 0 0 0 0 11 24 1 0 0 0 0 12 14 1 0 0 0 0 13 15 1 0 0 0 0 14 15 2 0 0 0 0 15 26 1 0 0 0 0 16 18 1 0 0 0 0 16 19 2 0 0 0 0 16 20 1 0 0 0 0 19 21 1 0 0 0 0 19 28 1 0 0 0 0 20 22 2 0 0 0 0 20 29 1 0 0 0 0 21 23 2 0 0 0 0 21 30 1 0 0 0 0 22 23 1 0 0 0 0 22 31 1 0 0 0 0 23 32 1 0 0 0 0 M CHG 2 5 -1 9 1 M END $$$$