BO5AT1 -OEChem-04022106293D 49 51 0 0 0 0 0 0 0999 V2000 0.6477 2.8459 0.6812 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.2556 2.5100 1.0160 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9637 2.6000 0.7644 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8667 1.4802 -1.0079 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0703 -1.6690 1.1052 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1264 0.6560 0.1587 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1896 1.7893 0.5935 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5789 0.8766 0.5963 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7544 1.5048 0.1577 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5015 -0.2628 0.2435 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6052 0.8466 -1.2876 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2777 1.3377 -0.8107 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6781 -1.3008 1.1461 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1587 -0.2539 -0.9776 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9881 -0.4744 -0.6762 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8482 2.2262 0.0488 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2372 2.1990 0.4062 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1088 1.0538 -1.4077 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5320 -2.3545 0.8199 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0124 -1.3076 -1.3039 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6315 -1.6588 -1.2915 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1991 -2.3579 -0.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6964 -0.5177 0.5032 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9981 -2.8638 -0.7026 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7104 -2.8151 0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1211 -4.0894 1.1449 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0876 0.5486 -0.9329 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7619 -0.2913 0.5767 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5402 2.7321 0.1554 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2383 1.8954 1.6845 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9599 1.8043 0.1494 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6145 1.0426 1.6812 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4065 0.5634 0.5965 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7232 1.4100 -0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3899 1.5902 -1.0969 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5943 0.7443 -2.3818 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1614 -1.3082 2.1015 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0183 0.5585 -1.6848 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8477 3.1896 1.5829 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0997 0.4295 -2.2964 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6769 -3.1727 1.5193 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5315 -1.3108 -2.2579 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0724 -1.6653 -2.2225 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8636 -3.1785 -0.6592 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0052 0.3833 1.0223 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7293 -3.8064 -1.1673 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6734 -3.8933 2.0698 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7697 -4.6699 0.4811 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2403 -4.6879 1.3983 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 16 1 0 0 0 0 2 17 2 0 0 0 0 3 16 1 0 0 0 0 3 17 1 0 0 0 0 3 39 1 0 0 0 0 4 16 2 0 0 0 0 4 18 1 0 0 0 0 5 23 1 0 0 0 0 5 25 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 27 1 0 0 0 0 6 28 1 0 0 0 0 7 9 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 10 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 13 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 17 1 0 0 0 0 12 18 2 0 0 0 0 13 19 1 0 0 0 0 13 37 1 0 0 0 0 14 20 2 0 0 0 0 14 38 1 0 0 0 0 15 21 1 0 0 0 0 15 23 2 0 0 0 0 18 40 1 0 0 0 0 19 22 2 0 0 0 0 19 41 1 0 0 0 0 20 22 1 0 0 0 0 20 42 1 0 0 0 0 21 24 2 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 M END $$$$