BO3MJ8 -OEChem-04022101353D 34 37 0 0 0 0 0 0 0999 V2000 -4.9982 1.8831 0.4489 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3282 -2.6241 -0.3774 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1250 -0.3755 0.0319 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3544 1.6582 -0.5986 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3397 -0.4815 -0.1124 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9645 0.7406 0.1445 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1797 0.6330 0.0017 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1124 -1.7489 -0.3164 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9384 -0.5232 -0.1819 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2639 0.5713 -0.0732 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2043 1.9031 0.3291 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8131 1.8457 0.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4355 0.8154 0.2239 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6101 -1.6341 -0.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9542 -0.5777 0.2851 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3527 -0.6143 0.2031 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0217 0.5418 -0.2502 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0050 1.6525 -0.5047 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0810 -1.7623 0.5586 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4110 0.5048 -0.3318 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4699 -1.7714 0.4675 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1353 -0.6363 0.0214 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8804 -2.1498 -1.3104 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8001 -2.4801 0.4389 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4731 -1.4795 -0.4114 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6773 2.8595 0.5355 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2628 2.7660 0.4327 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4363 -1.4575 0.6613 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1380 -0.3143 0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5551 2.5845 -0.8321 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5704 -2.6567 0.9087 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9560 1.3811 -0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0293 -2.6601 0.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2189 -0.6347 -0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 2 0 0 0 0 2 14 2 0 0 0 0 3 13 1 0 0 0 0 3 14 1 0 0 0 0 3 29 1 0 0 0 0 4 17 1 0 0 0 0 4 18 2 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 5 9 1 0 0 0 0 6 11 1 0 0 0 0 6 13 1 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 7 12 1 0 0 0 0 8 14 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 25 1 0 0 0 0 10 15 2 0 0 0 0 10 18 1 0 0 0 0 11 12 2 0 0 0 0 11 26 1 0 0 0 0 12 27 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 16 17 1 0 0 0 0 16 19 2 0 0 0 0 17 20 2 0 0 0 0 18 30 1 0 0 0 0 19 21 1 0 0 0 0 19 31 1 0 0 0 0 20 22 1 0 0 0 0 20 32 1 0 0 0 0 21 22 2 0 0 0 0 21 33 1 0 0 0 0 22 34 1 0 0 0 0 M END $$$$