BY97GQ -OEChem-04022116023D 29 30 0 0 0 0 0 0 0999 V2000 -3.7576 -0.3165 -0.0006 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4458 1.9642 -0.0017 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2764 -0.7569 -0.0128 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0773 -0.7836 0.0011 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7922 1.4844 0.0019 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6906 0.5771 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2993 -0.7634 0.0018 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5683 0.4945 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4982 1.3593 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0663 0.8820 0.0014 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2185 -1.8186 0.0028 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9972 -0.1632 0.0025 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5776 -1.4920 0.0032 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9621 0.8085 -0.0008 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4194 0.1437 0.0027 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1773 -0.1319 -0.0015 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8509 -1.4875 -0.0011 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5574 2.4397 -0.0009 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6411 -1.6227 0.0014 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3288 1.9314 0.0003 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8924 -2.8533 0.0034 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2977 -2.3072 0.0042 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4702 0.4302 0.8919 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4691 0.4291 -0.8959 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5503 -2.0673 -0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5513 -2.0662 0.8789 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9395 -1.3834 -0.0017 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7788 1.7241 -0.0049 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1653 2.2783 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 16 1 0 0 0 0 2 14 2 0 0 0 0 3 15 2 0 0 0 0 4 7 1 0 0 0 0 4 8 1 0 0 0 0 4 19 1 0 0 0 0 5 15 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 6 10 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 14 1 0 0 0 0 9 18 1 0 0 0 0 10 12 2 0 0 0 0 10 20 1 0 0 0 0 11 13 2 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 22 1 0 0 0 0 16 17 1 0 0 0 0 16 23 1 0 0 0 0 16 24 1 0 0 0 0 17 25 1 0 0 0 0 17 26 1 0 0 0 0 17 27 1 0 0 0 0 M END $$$$