BHS53B -OEChem-04022116353D 45 47 0 1 0 0 0 0 0999 V2000 2.0743 0.1703 -2.3442 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0642 3.1425 1.8974 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2228 -0.5340 -2.0553 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2156 1.3568 2.7230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6107 0.3398 0.0025 N 0 0 1 0 0 0 0 0 0 0 0 0 4.1476 -0.1831 0.5403 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9197 0.1960 -0.1447 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0563 1.6956 0.3340 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5628 1.6791 0.0468 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6988 -0.5682 0.3661 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6851 -0.0615 0.5197 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1734 -0.1042 -1.6001 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8085 2.0160 1.7779 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8290 0.7114 -0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9019 -1.5654 0.4376 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9971 0.9540 0.6027 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4808 -2.1257 -0.7009 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7096 1.1771 -1.4293 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5216 -2.3835 1.5013 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0459 1.6624 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6796 -3.5043 -0.7759 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7581 1.8856 -2.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7203 -3.7622 1.4265 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9263 2.1281 -1.2933 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2993 -4.3225 0.2879 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5704 2.4438 -0.3015 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7930 2.2682 -0.8497 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1296 2.1255 0.8739 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6306 -1.5424 -0.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7696 -0.7257 1.4489 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7423 0.1635 1.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9386 0.3449 0.1746 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3502 -1.1704 0.3902 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1041 0.5961 1.6232 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7708 -1.5311 -1.5603 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8231 0.9898 -2.0285 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0793 -1.9637 2.4007 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 -0.0180 -3.2958 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1119 3.3672 2.8358 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9556 1.8509 0.5785 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1257 -3.9418 -1.6644 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6672 2.2444 -3.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4262 -4.3991 2.2556 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7432 2.6787 -1.7505 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4533 -5.3960 0.2293 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 38 1 0 0 0 0 2 13 1 0 0 0 0 2 39 1 0 0 0 0 3 12 2 0 0 0 0 4 13 2 0 0 0 0 5 8 1 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 26 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 14 1 0 0 0 0 11 15 1 0 0 0 0 11 31 1 0 0 0 0 14 16 2 0 0 0 0 14 18 1 0 0 0 0 15 17 2 0 0 0 0 15 19 1 0 0 0 0 16 20 1 0 0 0 0 16 34 1 0 0 0 0 17 21 1 0 0 0 0 17 35 1 0 0 0 0 18 22 2 0 0 0 0 18 36 1 0 0 0 0 19 23 2 0 0 0 0 19 37 1 0 0 0 0 20 24 2 0 0 0 0 20 40 1 0 0 0 0 21 25 2 0 0 0 0 21 41 1 0 0 0 0 22 24 1 0 0 0 0 22 42 1 0 0 0 0 23 25 1 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 M END $$$$