BK3A1B -OEChem-04022113023D 35 36 0 1 0 0 0 0 0999 V2000 -3.6829 1.4696 1.3293 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2235 -0.0655 2.4963 F 0 0 0 0 0 0 0 0 0 0 0 0 2.4155 3.3749 -0.5255 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.7162 -0.7035 -1.9565 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0716 0.1161 -0.2644 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2487 -4.1405 0.0078 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3378 -2.7125 -0.3252 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.0370 -2.0994 -0.0562 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3628 1.3777 -0.9346 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4669 -2.0838 0.5206 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2508 -0.8371 -0.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6073 0.0350 1.0887 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6930 1.8999 -0.4252 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7204 -0.6222 0.2428 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5810 0.3188 1.2631 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0941 -0.2126 -1.0372 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8156 1.6690 1.0035 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3286 1.1376 -1.2968 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1894 2.0784 -0.2764 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5951 -2.6525 -1.3886 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8393 -2.7794 -0.3737 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1538 -1.9489 1.0198 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3673 1.2482 -2.0218 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5475 2.0700 -0.6892 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2489 -2.2322 1.5867 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4088 -2.6194 0.3367 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1758 -0.8920 1.2053 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7836 0.0599 1.8079 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8045 2.9758 -0.5816 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5281 1.3814 -0.9066 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1421 -4.5924 -0.1833 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4345 -4.5929 -0.5985 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2187 -0.9340 -1.8401 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7069 2.4015 1.7978 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6218 1.4565 -2.2926 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 2 15 1 0 0 0 0 3 19 1 0 0 0 0 4 11 2 0 0 0 0 5 9 1 0 0 0 0 5 11 1 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 7 20 1 0 0 0 0 8 11 1 0 0 0 0 8 21 1 0 0 0 0 8 22 1 0 0 0 0 9 13 1 0 0 0 0 9 23 1 0 0 0 0 9 24 1 0 0 0 0 10 14 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 15 17 1 0 0 0 0 16 18 2 0 0 0 0 16 33 1 0 0 0 0 17 19 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 M END $$$$