BHSC21 -OEChem-04012119202D 45 48 0 0 0 0 0 0 0999 V2000 4.0908 0.9372 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5908 0.0712 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5908 1.8032 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2187 -0.0628 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2247 1.4372 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6351 -0.8676 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.9027 2.1049 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6100 3.1810 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9659 2.4031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2588 1.1784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.1443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9568 0.4372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6888 0.4372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6888 -0.5628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8228 0.9372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9568 -0.5628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6351 0.7419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8228 -1.0628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2187 -0.0628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9457 -1.8181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9242 -2.0243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9457 1.6924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2349 -2.9748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5921 -1.2800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2134 -3.1810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5706 -1.4862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9242 1.8986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2779 2.4367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8812 -2.4367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5648 2.5636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8055 3.0020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6600 1.0179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4193 0.5795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8395 2.7432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4011 1.9838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8228 1.5572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4199 -0.8728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8228 -1.6828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3319 -1.9054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9252 -2.4377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8208 -3.4363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3995 -0.6907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4060 -3.7704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9846 -1.0247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4879 -2.5646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 5 1 0 0 0 0 1 12 1 0 0 0 0 4 19 2 0 0 0 0 5 9 1 0 0 0 0 5 10 1 0 0 0 0 6 14 1 0 0 0 0 6 19 1 0 0 0 0 6 20 1 0 0 0 0 7 27 3 0 0 0 0 8 28 3 0 0 0 0 9 11 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 15 2 0 0 0 0 12 16 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 13 17 1 0 0 0 0 14 18 1 0 0 0 0 15 36 1 0 0 0 0 16 18 2 0 0 0 0 16 37 1 0 0 0 0 17 19 1 0 0 0 0 17 22 2 0 0 0 0 18 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 22 27 1 0 0 0 0 22 28 1 0 0 0 0 23 25 1 0 0 0 0 23 41 1 0 0 0 0 24 26 2 0 0 0 0 24 42 1 0 0 0 0 25 29 2 0 0 0 0 25 43 1 0 0 0 0 26 29 1 0 0 0 0 26 44 1 0 0 0 0 29 45 1 0 0 0 0 M END $$$$