D06EDT -OEChem-10121501332D 41 44 0 0 0 0 0 0 0999 V2000 5.0331 1.8101 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -2.3910 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.0250 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.0250 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 8.5390 2.9050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6730 -2.5950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8069 -1.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6730 1.4050 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6730 0.4050 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8378 0.4163 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8069 1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4050 0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4050 1.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5390 -0.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5390 1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9409 1.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8660 0.2071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3660 1.0731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5390 -1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2989 -0.1297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2989 1.9397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3660 -0.6590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -0.6590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 1.0731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2050 0.3842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2050 1.4258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.2071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.5250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6730 -1.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2054 2.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4084 2.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7510 -1.6776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1496 -0.9873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2918 -0.7496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2918 2.5596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6760 -1.1959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0560 1.6100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7407 0.0721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7407 1.7379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 0.2071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2099 -2.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 18 1 0 0 0 0 2 28 1 0 0 0 0 3 28 1 0 0 0 0 4 28 1 0 0 0 0 5 15 2 0 0 0 0 6 29 1 0 0 0 0 6 41 1 0 0 0 0 7 29 2 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 15 1 0 0 0 0 9 14 2 0 0 0 0 10 16 2 0 0 0 0 10 17 1 0 0 0 0 11 16 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 20 2 0 0 0 0 13 15 1 0 0 0 0 13 21 2 0 0 0 0 14 19 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 24 1 0 0 0 0 19 29 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 20 25 1 0 0 0 0 20 34 1 0 0 0 0 21 26 1 0 0 0 0 21 35 1 0 0 0 0 22 23 2 0 0 0 0 22 36 1 0 0 0 0 23 27 1 0 0 0 0 23 28 1 0 0 0 0 24 27 2 0 0 0 0 24 37 1 0 0 0 0 25 26 2 0 0 0 0 25 38 1 0 0 0 0 26 39 1 0 0 0 0 27 40 1 0 0 0 0 M END $$$$