BX8Z3L -OEChem-04012113453D 42 42 0 1 0 0 0 0 0999 V2000 -2.7286 1.9246 -0.4532 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4045 -1.2549 1.5347 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9709 1.5959 0.1729 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0304 0.9943 1.5428 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5774 -0.8457 0.3299 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3259 0.0539 -0.5607 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2718 -0.6867 -1.5077 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0796 -1.7852 -0.8201 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3277 -1.9297 0.9692 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1626 -2.7136 -0.0339 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7377 0.1666 -0.7516 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7461 -0.6368 0.7082 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4545 0.4755 0.0331 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8315 -0.4273 0.1693 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0545 1.0263 0.3198 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4115 -0.8040 -1.9018 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2513 1.4804 -1.3672 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2229 0.4504 1.3535 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4722 2.9160 0.2628 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6386 0.6295 -1.1855 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6651 -1.1599 -2.2918 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9538 0.0003 -2.0211 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6365 -2.3593 -1.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8180 -1.3351 -0.1458 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9699 -1.4955 1.7428 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6383 -2.6116 1.4789 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7576 -3.4710 0.4883 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4996 -3.2436 -0.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7368 -0.6072 -0.4264 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5368 -1.4153 0.5386 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2875 -0.9746 -2.5373 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6041 -0.4139 -2.5322 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0830 -1.7770 -1.5197 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2021 1.3293 -1.8907 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4004 2.2627 -0.6154 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5341 1.8791 -2.0952 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9542 -0.0762 1.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6894 1.3844 1.0281 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3643 0.6923 1.9859 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8006 3.5205 0.8798 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2410 2.4402 0.8792 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9606 3.5674 -0.4668 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 19 1 0 0 0 0 2 12 2 0 0 0 0 3 13 2 0 0 0 0 4 15 2 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 15 1 0 0 0 0 6 20 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 7 22 1 0 0 0 0 8 10 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 11 16 1 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 14 18 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 M END $$$$