D09XQU -OEChem-04152108583D 19 20 0 0 0 0 0 0 0999 V2000 1.3497 -2.3024 -0.0002 O 0 5 0 0 0 0 0 0 0 0 0 0 0.2057 2.8438 -0.0001 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0147 -1.0685 -0.0002 N 0 3 0 0 0 0 0 0 0 0 0 0 0.3991 1.5928 -0.0001 N 0 3 0 0 0 0 0 0 0 0 0 0 1.6864 1.2124 0.0002 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3173 -0.4982 0.0003 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3182 -0.6914 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6382 0.6759 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3412 -1.6479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9769 1.0864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9664 -0.0966 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6741 -1.2337 0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9907 0.1274 0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1264 -2.7128 0.0001 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2486 2.1381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4703 -1.9729 0.0004 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0312 0.4399 0.0003 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0449 0.2032 0.0004 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5443 -1.4830 0.0002 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 2 4 1 0 0 0 0 3 7 1 0 0 0 0 3 11 2 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 11 1 0 0 0 0 6 11 1 0 0 0 0 6 18 1 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 9 2 0 0 0 0 8 10 2 0 0 0 0 9 12 1 0 0 0 0 9 14 1 0 0 0 0 10 13 1 0 0 0 0 10 15 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 17 1 0 0 0 0 M CHG 4 1 -1 2 -1 3 1 4 1 M END $$$$