BO9BR1 -OEChem-04042102493D 39 41 0 0 0 0 0 0 0999 V2000 1.2600 1.9280 1.3883 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7512 0.5241 -0.3125 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3848 2.2498 2.2467 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2936 2.9558 1.0521 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4569 0.5439 2.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9349 -2.0460 1.1005 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4827 -0.1450 1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2125 -1.4376 0.7452 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1698 -2.0735 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6628 0.5162 0.8368 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6013 -0.1161 0.0307 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3568 -1.4085 -0.4243 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9317 1.3027 -0.1252 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8983 -3.3747 -0.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1866 1.3774 -1.3021 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2043 0.7321 -0.1406 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2832 -4.0041 -0.1525 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1587 -3.3021 0.6508 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6976 1.9466 -0.4151 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7141 0.8812 -2.4943 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7319 0.2359 -1.3326 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9868 0.3103 -2.5095 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6945 2.4038 -1.4586 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0331 -0.0737 2.6071 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8518 1.5034 1.2481 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0945 -1.8997 -1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6064 -3.9049 -1.1497 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1943 1.8188 -1.3152 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7983 0.6555 0.7656 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5093 -5.0097 -0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0983 -3.7428 0.9674 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9481 2.3864 0.5565 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7075 2.2977 -0.7325 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1338 0.9388 -3.4105 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7217 -0.2109 -1.3442 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3971 -0.0769 -3.4375 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4635 1.9606 -2.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7062 2.0792 -1.1935 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6881 3.4931 -1.5558 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 5 1 0 0 0 0 1 13 1 0 0 0 0 2 11 1 0 0 0 0 2 19 1 0 0 0 0 5 7 1 0 0 0 0 5 24 1 0 0 0 0 6 8 1 0 0 0 0 6 18 2 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 9 12 2 0 0 0 0 9 14 1 0 0 0 0 10 11 2 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 12 26 1 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 14 17 2 0 0 0 0 14 27 1 0 0 0 0 15 20 1 0 0 0 0 15 28 1 0 0 0 0 16 21 2 0 0 0 0 16 29 1 0 0 0 0 17 18 1 0 0 0 0 17 30 1 0 0 0 0 18 31 1 0 0 0 0 19 23 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 20 22 2 0 0 0 0 20 34 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 22 36 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 M END $$$$