BW86ZU -OEChem-04022105182D 36 38 0 1 0 0 0 0 0999 V2000 5.6454 1.6783 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.6624 -1.9560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6498 1.9141 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3923 -1.9560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0274 -0.2238 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0547 0.1908 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3364 0.7273 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.0274 -0.2238 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5274 1.3150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7183 0.7273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3424 -1.0085 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3518 0.9595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7123 -1.0085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7029 0.9595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3219 -0.7998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7328 -0.7998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.1908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0321 0.4025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9763 2.4215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3991 -1.5455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3791 -0.9976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9422 1.7758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1125 1.7758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9320 -1.4733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5182 1.5513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9088 -1.2622 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 0.3221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2529 -2.4215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1633 -0.2034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6380 0.5337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9008 1.0085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4370 2.8363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5614 2.8822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5155 2.0066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2052 -2.1344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0060 -1.4190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7 1 1 6 0 0 0 1 19 1 0 0 0 0 11 2 1 1 0 0 0 2 28 1 0 0 0 0 3 12 2 0 0 0 0 4 13 2 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 5 13 1 0 0 0 0 6 12 1 0 0 0 0 6 16 1 0 0 0 0 6 18 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 8 21 1 1 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 10 14 2 0 0 0 0 11 15 1 0 0 0 0 11 24 1 0 0 0 0 13 16 1 0 0 0 0 14 17 1 0 0 0 0 14 25 1 0 0 0 0 15 17 2 0 0 0 0 15 26 1 0 0 0 0 16 20 2 0 0 0 0 17 27 1 0 0 0 0 18 29 1 0 0 0 0 18 30 1 0 0 0 0 18 31 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 M END $$$$