L89TKY -OEChem-05022322533D 29 30 0 1 0 0 0 0 0999 V2000 3.5238 1.5696 -0.4574 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.7868 1.1447 0.1704 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4129 -1.9739 0.2545 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4667 -0.1675 -0.9057 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9683 1.0362 -0.6999 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6818 -0.2878 0.1080 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.1031 -0.8118 -0.0039 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8614 0.1985 0.8198 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1486 1.4872 0.4683 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7956 -0.6890 -1.0552 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5458 -0.8632 -0.2526 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8590 -0.1750 -0.1592 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0178 -0.7162 0.4675 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0647 0.1753 0.3776 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4516 0.0728 0.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2373 -0.6134 1.0572 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2081 -1.8372 0.3612 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4547 -0.7784 -1.0422 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9322 0.2299 0.6024 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7341 -0.0207 1.8865 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5793 1.9464 -0.4278 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1756 2.2174 1.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1819 -0.2765 -1.9938 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7510 -1.7794 -1.1477 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2693 0.7552 -1.2825 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0842 -1.6838 0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1659 0.1384 0.0406 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6749 0.8718 1.5826 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6191 -0.8829 1.3758 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 14 1 0 0 0 0 2 6 1 0 0 0 0 2 9 1 0 0 0 0 3 11 2 0 0 0 0 4 10 1 0 0 0 0 4 11 1 0 0 0 0 4 25 1 0 0 0 0 5 12 2 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 6 16 1 0 0 0 0 7 8 1 0 0 0 0 7 17 1 0 0 0 0 7 18 1 0 0 0 0 8 9 1 0 0 0 0 8 19 1 0 0 0 0 8 20 1 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 26 1 0 0 0 0 14 15 1 0 0 0 0 15 27 1 0 0 0 0 15 28 1 0 0 0 0 15 29 1 0 0 0 0 M END $$$$