D0AJ3K -OEChem-05112005213D 29 30 0 1 0 0 0 0 0999 V2000 0.3741 -1.9974 -1.0754 F 0 0 0 0 0 0 0 0 0 0 0 0 1.9988 -2.2753 0.3506 F 0 0 0 0 0 0 0 0 0 0 0 0 1.2815 0.5879 1.1205 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1405 -0.8398 -1.5938 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1302 2.7224 1.0081 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9612 -1.9118 1.3135 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8267 -0.1141 0.4154 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2222 -0.3501 0.2540 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5084 1.2528 -0.8345 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0170 -0.2991 -0.9314 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1982 -1.3521 -0.2323 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4219 0.5731 0.2425 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4686 -0.5673 0.8391 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7793 1.9931 -0.1568 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9175 1.0775 -0.2868 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0072 -0.8479 0.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0758 1.5725 -0.7186 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2910 0.7757 -0.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4159 0.2393 -1.6705 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2560 0.1341 0.8053 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3767 -1.1520 1.7604 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9529 2.5196 -0.6405 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6371 2.0030 -0.8361 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6425 -1.3718 -0.9531 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0197 1.6337 -0.5015 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3636 2.7043 1.6063 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1547 2.5008 -1.2685 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5944 2.1225 -1.3501 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3637 0.7415 -0.6447 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 2 11 1 0 0 0 0 3 12 1 0 0 0 0 3 13 1 0 0 0 0 4 10 1 0 0 0 0 4 24 1 0 0 0 0 5 14 1 0 0 0 0 5 26 1 0 0 0 0 6 16 2 0 0 0 0 7 13 1 0 0 0 0 7 15 1 0 0 0 0 7 16 1 0 0 0 0 8 16 1 0 0 0 0 8 18 2 0 0 0 0 9 18 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 19 1 0 0 0 0 11 13 1 0 0 0 0 12 14 1 0 0 0 0 12 20 1 0 0 0 0 13 21 1 0 0 0 0 14 22 1 0 0 0 0 14 23 1 0 0 0 0 15 17 2 0 0 0 0 15 25 1 0 0 0 0 17 18 1 0 0 0 0 17 27 1 0 0 0 0 M END $$$$