B6P1BS -OEChem-04022109113D 34 36 0 0 0 0 0 0 0999 V2000 6.2478 2.2533 0.0002 S 0 0 0 0 0 0 0 0 0 0 0 0 4.3796 -2.3500 -0.0002 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3628 1.3496 0.0003 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1342 -0.1736 0.0012 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6464 1.6509 -0.0005 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3715 -0.3263 -0.0009 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3053 -1.0510 -0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7681 0.0523 -0.0014 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7044 -0.5308 1.2069 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6921 -0.4864 -1.2085 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 -0.8954 1.2072 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3456 -0.8509 -1.2083 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7256 -1.4346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7642 -0.5874 0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7573 -0.9306 -0.0225 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1245 1.4005 0.0213 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1432 -1.1454 0.0008 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4950 0.8757 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1034 -0.5653 -0.0208 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4708 1.7658 0.0229 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4603 0.7830 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9520 1.1966 0.0007 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2190 -0.4100 2.1573 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1969 -0.3308 -2.1591 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1505 -1.0517 2.1548 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1725 -0.9725 -2.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8823 -2.5111 0.0017 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4967 -1.9863 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3660 2.1795 0.0383 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8740 -1.3305 -0.0371 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7486 2.8156 0.0407 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0947 -0.5052 0.0014 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5147 2.6586 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5084 1.0675 0.0033 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 2 0 0 0 0 2 17 2 0 0 0 0 3 18 2 0 0 0 0 4 17 1 0 0 0 0 4 22 1 0 0 0 0 4 32 1 0 0 0 0 5 18 1 0 0 0 0 5 22 1 0 0 0 0 5 33 1 0 0 0 0 6 8 1 0 0 0 0 6 9 2 0 0 0 0 6 10 1 0 0 0 0 7 11 2 0 0 0 0 7 12 1 0 0 0 0 7 13 1 0 0 0 0 8 15 2 0 0 0 0 8 16 1 0 0 0 0 9 11 1 0 0 0 0 9 23 1 0 0 0 0 10 12 2 0 0 0 0 10 24 1 0 0 0 0 11 25 1 0 0 0 0 12 26 1 0 0 0 0 13 14 2 0 0 0 0 13 27 1 0 0 0 0 14 17 1 0 0 0 0 14 18 1 0 0 0 0 15 19 1 0 0 0 0 15 28 1 0 0 0 0 16 20 2 0 0 0 0 16 29 1 0 0 0 0 19 21 2 0 0 0 0 19 30 1 0 0 0 0 20 21 1 0 0 0 0 20 31 1 0 0 0 0 21 34 1 0 0 0 0 M END $$$$