B3AGR9 -OEChem-04022108292D 33 35 0 1 0 0 0 0 0999 V2000 3.4782 2.1195 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.3147 2.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0468 1.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 0.7183 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1808 0.6250 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9487 -0.2410 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4487 0.6250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4487 0.6250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9487 -1.2410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 1.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3147 1.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0827 -1.7410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8147 -1.7410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 2.3275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.4614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0827 -2.7410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8147 -2.7410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9487 -3.2410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0933 3.2410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5476 -0.4015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8477 0.0240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2882 1.2239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5457 -1.4310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3517 -1.4310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1808 0.0050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 1.3966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5457 -3.0510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3517 -3.0510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9487 -3.8610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6597 3.4932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8411 3.8074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5269 2.9888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5837 0.8150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 14 1 0 0 0 0 2 11 2 0 0 0 0 3 5 1 0 0 0 0 3 33 1 0 0 0 0 4 10 2 0 0 0 0 4 15 1 0 0 0 0 5 11 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 6 0 0 0 6 20 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 7 21 1 6 0 0 0 8 11 1 6 0 0 0 8 22 1 0 0 0 0 9 12 2 0 0 0 0 9 13 1 0 0 0 0 12 16 1 0 0 0 0 12 23 1 0 0 0 0 13 17 2 0 0 0 0 13 24 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 26 1 0 0 0 0 16 18 2 0 0 0 0 16 27 1 0 0 0 0 17 18 1 0 0 0 0 17 28 1 0 0 0 0 18 29 1 0 0 0 0 19 30 1 0 0 0 0 19 31 1 0 0 0 0 19 32 1 0 0 0 0 M END $$$$