BL67JA -OEChem-04012120262D 27 28 0 1 0 0 0 0 0999 V2000 2.8090 0.3849 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.3122 1.3328 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7770 -0.3145 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6180 0.9726 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.6906 -0.7213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1079 -1.0577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5860 -1.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6079 -1.9237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3090 1.9237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5691 0.6636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 1.9237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.9726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7150 0.3603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2970 -0.8502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8821 -0.1316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6930 -0.5969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6063 -1.4221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6508 -2.3324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2060 -1.7158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0415 -2.1759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7995 -2.5134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9155 2.0526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2442 2.5403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3738 2.5403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7026 2.0526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4336 1.2248 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 0.4357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 12 1 0 0 0 0 2 10 2 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 3 10 1 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 4 13 1 0 0 0 0 5 7 1 0 0 0 0 5 14 1 0 0 0 0 5 15 1 0 0 0 0 6 8 1 0 0 0 0 6 16 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 18 1 0 0 0 0 7 19 1 0 0 0 0 8 20 1 0 0 0 0 8 21 1 0 0 0 0 9 11 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 11 12 1 0 0 0 0 11 24 1 0 0 0 0 11 25 1 0 0 0 0 12 26 1 0 0 0 0 12 27 1 0 0 0 0 M END $$$$